smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1ccc(F)cc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65680273 FBOWPCSLXHPEOL-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CSc1ccc(/C=C/C(=O)c2ccc(Br)s2)cc1 103292333 CPWZHJGWIAEWCN-QPJJXVBHSA-N 339.279 5.129 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCc2cccc(C#N)c2)cc1 174526170 BSIIOUYCZHCJIN-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@H](SCC(=O)Nc1ccc(C#N)cc1)c1ccc2ccccc2c1 195541800 ACZFGLKVFGOSQK-HNNXBMFYSA-N 346.455 5.144 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1C(C)(C)C 303017728 SQPJMORSBUKBPS-UHFFFAOYSA-N 336.479 5.247 30 20 EKED Cc1cc(Cl)cc2nc(SCc3cc(C#N)ccc3F)oc12 303656761 GKOOYDBTYJKHGF-UHFFFAOYSA-N 332.787 5.093 30 20 EKED Cc1ccc(SC2CCCC2)c(/C(O)=N/[C@@H]2CCC[C@@H]2C#N)c1 329205119 DGZBYRCEZFGJFR-RHSMWYFYSA-N 328.481 5.027 30 20 EKED COc1ccc2oc([C@@H](C)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 358344245 VXVUOFIKVCEBBJ-OXQOHEQNSA-N 348.446 5.446 30 20 EKED Cc1cccc(N(CCCC2(C#N)CCOCC2)Cc2ccccc2)c1 410318684 QPXJBUWJYSEGHS-UHFFFAOYSA-N 348.490 5.102 30 20 EKED C[C@@H](C1CCCCC1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458840004 MXTVQEGBLMXKNN-PXNSSMCTSA-N 341.499 5.032 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCCC1(C)C 467468488 OOUZSGGOJGPMCJ-WMLDXEAASA-N 345.512 5.029 30 20 EKED Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1C(F)(F)F 474428949 VLFIAEKFBMUFIZ-OAHLLOKOSA-N 346.352 5.040 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1cc(C)ccc1C)c1ccc(F)c(F)c1 479772079 OBIYWFVXVZIEHI-GOSISDBHSA-N 330.378 5.021 30 20 EKED C=CCCCC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1ccccn1 480843983 NHFRANLYTLFNKG-HXUWFJFHSA-N 342.870 5.029 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=O)NCC(C)(C)CCC#N)c2)o1 483324386 MIHCCLJZJPIYJF-UHFFFAOYSA-N 339.439 5.015 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1csc(C2CCCC2)n1 521195896 ZVQNZOZTFJEUCX-UHFFFAOYSA-N 339.508 5.083 30 20 EKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1(C#N)CC(C)C1 532074597 ZOJTYMDESWKZIR-WIVVBHTDSA-N 348.446 5.013 30 20 EKED CCCCOc1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551790123 WFCGIDVTCRBALL-KRWDZBQOSA-N 334.463 5.077 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 576057005 DYHSSXSUQJAKOU-DNVCBOLYSA-N 346.396 5.791 30 20 EKED COc1cccc2c1CCC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 581205752 OULAMKCBJNZUSC-SFTDATJTSA-N 334.463 5.097 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)cc1 582211092 VZYMURJDQMNHFY-YCRPNKLZSA-N 336.504 5.397 30 20 EKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1Cl 582994805 UGFSGVXXQZQVJB-ADLMAVQZSA-N 331.246 5.203 30 20 EKED C[C@H](Nc1ccccc1NC(=O)CCCCCC#N)c1ccccc1 594355981 XTGZMEQNPBSWGE-KRWDZBQOSA-N 335.451 5.272 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618805858 PIHWMCKBOLNPMM-YCRPNKLZSA-N 336.504 5.397 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)/N=C\c1ccccc1O 729150143 UBECOUHYVMIZCH-UORWWSPDSA-N 340.423 5.143 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 735214223 NYDYYGNONILOOM-HIFRSBDPSA-N 346.471 5.608 30 20 EKED CCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749050115 ZXFPUCCVEGHVTP-HOCLYGCPSA-N 326.465 5.121 30 20 EKED CCCCCCCCC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 754717175 OXTZQFNMLTUZIE-PMACEKPBSA-N 349.490 5.255 30 20 EKED C[C@H](CC(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 773984064 QDCPVNJQXGZUBD-PWSUYJOCSA-N 334.872 5.198 30 20 EKED CC(C)(C#N)CCCOC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 784988281 ISFFXWMJGUXGRA-UHFFFAOYSA-N 341.373 5.013 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(F)c(Cl)c1 799900865 QWSYZJIYXOUXNW-UHFFFAOYSA-N 334.847 5.407 30 20 EKED O=C1/C(=C/c2csc(-c3ccc(Cl)cc3)n2)Cc2ccccc21 916137151 QTPICIDRFXJPQX-GXDHUFHOSA-N 337.831 5.286 30 20 EKED CC(=NNc1cccc(Cl)c1F)c1sccc1Br 921137817 NAUNJIANFUNPIW-UHFFFAOYSA-N 347.640 5.139 30 20 EKED C=CC[C@@]1(C(=O)O)CCCN([C@@H](CC(C)C)c2ccc(CC)cc2)C1 1776154463 BEUCZJZDYQQDEW-RBBKRZOGSA-N 343.511 5.079 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776699964 KYXMFWVPGBSKMQ-IQQGHNRFSA-N 348.851 5.509 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Cl)c(Cl)c1 27353997 MQGWPTDOJIDCNX-UHFFFAOYSA-N 335.234 5.214 30 20 EKED N#C[C@H](C(=O)c1cccc(Oc2ccc(Cl)cc2)c1)c1ccccn1 182060224 OZNOOGKATAJTFI-SFHVURJKSA-N 348.789 5.017 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 192985577 DWLBDGXVAVEDBK-AUUYWEPGSA-N 328.843 5.044 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2)nnc1-c1cccc(C)c1 255932996 ASPNCOUIEGVZPH-INIZCTEOSA-N 335.476 5.293 30 20 EKED N#CCCC[C@@H](N[C@H]1CCSc2ccc(F)cc21)c1ccccc1 340453904 RTALYRDIPMJSDX-MOPGFXCFSA-N 340.467 5.387 30 20 EKED Cc1ccc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c(Cl)c1 411007202 MCNGEINENLWFON-UHFFFAOYSA-N 332.856 5.131 30 20 EKED Cc1ccc(-c2nnc([C@H](C)S[C@H](C)c3ccc(C#N)cc3)o2)cc1 419425790 PSQAGVKDIDDDIF-CABCVRRESA-N 349.459 5.472 30 20 EKED COc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)c(Cl)c1 424302402 MCSRTAALNBOIEO-IFXJQAMLSA-N 328.843 5.044 30 20 EKED Cc1cc(CNc2ccccc2Oc2ncccc2C#N)c(C)s1 435896125 CDBZCXMFXGRSIG-UHFFFAOYSA-N 335.432 5.036 30 20 EKED N#Cc1cc(NC(=O)c2ccccc2Sc2ccccc2)ccc1F 460177949 UUMUWVWTKLIKDF-UHFFFAOYSA-N 348.402 5.101 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 466548832 ULBDHTQBAHBVNI-CQSZACIVSA-N 339.401 5.014 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cncc(C)c1)c1ccc(C(F)(F)F)cc1 467746276 NDENTTJMGSIWNV-DNVCBOLYSA-N 348.412 5.767 30 20 EKED C[C@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccc(C#N)cc1 474478450 LQNYFACSYFDPTD-GVAFMPQTSA-N 330.884 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2CCC2)cc1 480529392 NLTJSJMFJXBUNV-UHFFFAOYSA-N 333.475 6.058 30 20 EKED Cc1c(Cl)cccc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 486436984 MVFCTZJNEAUPSR-UHFFFAOYSA-N 332.856 5.131 30 20 EKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccccc2)c1 523879400 IBYJZBAYHHTGNX-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C=CCC[C@H](Nc1cccc(NC(=O)c2cccs2)c1)C1CC1 537397438 WXSIFFHMLOLYQL-KRWDZBQOSA-N 326.465 5.157 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cscn1 543961456 KGPGDZXNLFKCCX-CABCVRRESA-N 333.460 5.094 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCC2)cc1)c1nc2ccccc2s1 574252887 XVSJHTSXCKYMCF-MRXNPFEDSA-N 332.428 5.054 30 20 EKED CCCCSc1ccc(Cl)cc1-c1noc(CC2(C#N)CC2)n1 590270910 IGTHZXJBDODHNR-UHFFFAOYSA-N 347.871 5.128 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCCc1ccc(C#N)cc1 596629267 OFILZJKXOHJVIQ-UHFFFAOYSA-N 349.478 5.169 30 20 EKED N#Cc1c(NC(=O)c2ccc(C(F)F)cc2)sc2c1CCCCC2 608802576 DVBJQAJAXKZGMW-UHFFFAOYSA-N 346.402 5.079 30 20 EKED C[C@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccsc1 609970481 JORLFYYVNBHAOW-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)C1CCCCC1 726317809 DUCOKKVRSIVPJE-DZGCQCFKSA-N 326.465 5.079 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093199 OKOPMZRKAKOMAP-HXUWFJFHSA-N 349.478 5.432 30 20 EKED CCOc1ccccc1C=NOCc1csc(C2CCCCC2)n1 744180321 QYEDRNPWJKTXFD-UHFFFAOYSA-N 344.480 5.140 30 20 EKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747197589 IXDKJTHSIQVXFC-KRWDZBQOSA-N 340.492 5.199 30 20 EKED C#CCCCCCC(=O)Nc1cccc(COc2ccccc2)c1C 779930200 LKXCSMSPTLFVKC-UHFFFAOYSA-N 335.447 5.096 30 20 EKED Cc1[nH]c2ccc(F)cc2c1C=NOc1ccccc1C(F)(F)F 782227725 RFCJGQRRORDBAP-UHFFFAOYSA-N 336.288 5.047 30 20 EKED O=c1[nH]ccc2cc(NN=C3CCCC[C@H](c4ccccc4)C3)ccc12 789076442 JUFYOZIAADKUEL-KRWDZBQOSA-N 345.446 5.044 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)nc1Cl 789718376 BDMYKSYBXIYQNK-UHFFFAOYSA-N 328.843 5.148 30 20 EKED CC(C)c1ccc(C=NOCc2coc(-c3cccs3)n2)cc1 823553892 NXKQKAJTBVERTJ-UHFFFAOYSA-N 326.421 5.077 30 20 EKED C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1c(F)cccc1F 864002138 KRIQDOBVIUYLSD-SECBINFHSA-N 326.268 5.028 30 20 EKED O=C1/C(=C\c2csc(-c3ccc(Cl)cc3)n2)Cc2ccccc21 916137161 QTPICIDRFXJPQX-UVTDQMKNSA-N 337.831 5.286 30 20 EKED CC(C)c1cccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)c1 1776375348 IFQDQOJECQAVNL-HJWRWDBZSA-N 328.795 5.058 30 20 EKED C[C@@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1CCC#N 11408053 CYJWJBRQDICSNH-PBHICJAKSA-N 349.865 5.243 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCCCC)c1 65451855 KRXLQJLAKVEVBW-UHFFFAOYSA-N 344.480 5.147 30 20 EKED CC(C)c1ccc(-c2nnc(SCc3cccc(C#N)c3)o2)cc1 66261080 JZJZPWGSNZSZQT-UHFFFAOYSA-N 335.432 5.024 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1CCCCCCC1 303289532 ANMABINMUGWBRV-OAHLLOKOSA-N 345.512 5.173 30 20 EKED CC(C)c1nc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cs1 340447113 OZKHUOOLQBORHN-RDJZCZTQSA-N 327.497 5.352 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)NCCCCC(C)(C)C#N 444789037 ZAZCPMAJGPWPPN-INIZCTEOSA-N 326.406 5.298 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc2ccncc12 530797928 LKLWNLWBICXTKI-UHFFFAOYSA-N 349.393 5.026 30 20 EKED Cc1nc([C@H](C)Oc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 532162556 BJQFMOMZWRPWPF-ZDUSSCGKSA-N 338.794 5.315 30 20 EKED C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1 561279926 WGOPMVJJSXDDNH-STZQEDGTSA-N 346.474 5.074 30 20 EKED CCCCN(C(=O)Nc1cc(C#N)ccc1C)[C@H](C)c1ccc(C)o1 604501784 MGVFDEJEIOHGLZ-MRXNPFEDSA-N 339.439 5.163 30 20 EKED N#C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C1CCCCC1 609648655 ZJZBXQBYFPVAIA-GFCCVEGCSA-N 334.794 5.318 30 20 EKED N#Cc1ccc(Cl)cc1NCc1nc2cc(Cl)ccc2s1 609892182 NNKPUGPWWIVYPU-UHFFFAOYSA-N 334.231 5.087 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2ccccc2COC(C)(C)CC)C1 666701598 CWBXLOZYMFTXTM-KRWDZBQOSA-N 344.499 5.212 30 20 EKED C[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2ccc3ccccc3n2)CC(C)(C)C1 727629222 PJDXFBJQMLEPNA-SOLBZPMBSA-N 334.463 5.264 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccc(Cl)c(Cl)c1O 727651229 NWDNANPQPQPAMG-UHFFFAOYSA-N 346.217 5.083 30 20 EKED Cc1ccsc1C(=O)/C=C/c1c(-c2ccccc2)nn(C)c1Cl 734753359 SYRXMHSMQAXZRF-CMDGGOBGSA-N 342.851 5.007 30 20 EKED Cc1ccc(-c2ccc(CNCc3cc(C#N)ccc3F)s2)cc1 742381943 UILCNEBZORNWMG-UHFFFAOYSA-N 336.435 5.024 30 20 EKED COc1cccc2cc(/C=C3/C(=O)c4ccsc4S[C@H]3C)oc12 742437525 VFJSPOLOTGCPRZ-RSYJBZMQSA-N 342.441 5.263 30 20 EKED CCOc1cccc(/C=N/[C@H](C)c2ccc(-c3ccncc3)cc2)c1O 746393188 HRGMWFMFTNDTOO-DTVDJLOLSA-N 346.430 5.033 30 20 EKED FC(F)(F)c1ccccc1C=NOc1ccccc1C(F)(F)F 754725264 RMFHFAWSZWLEQP-UHFFFAOYSA-N 333.231 5.137 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 776075561 XYTFJOMGUAIEAR-XLIONFOSSA-N 342.442 5.070 30 20 EKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(SC(C)(C)C)cc1C 782403363 NGJMOFAFHKXQRO-IBGZPJMESA-N 335.513 5.053 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 799902286 VUGNJYXBOZPVGD-UHFFFAOYSA-N 348.418 5.216 30 20 EKED Cc1ccc(C)c(C(=O)/C=C\c2ccccc2OCc2ccccn2)c1 819843392 YBVUVBQNLUGEMG-SEYXRHQNSA-N 343.426 5.174 30 20 EKED N#Cc1ccc(Oc2ccc(C(F)(F)F)c(Cl)n2)c(Cl)c1 883998882 DSKCKUQGRSMRDR-UHFFFAOYSA-N 333.096 5.071 30 20 EKED O=C(O)c1ccccc1NN=CCCc1ccc(-c2ccccc2)cc1 1776030478 DHWOEYBLMHDVAF-UHFFFAOYSA-N 344.414 5.082 30 20 EKED O=C(O)c1cc(NN=C2CCCC[C@H](c3ccccc3)C2)ccc1F 1776063081 ZOTFSKODVLNHJG-HNNXBMFYSA-N 340.398 5.040 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1cccs1)c1ccccc1 160362747 GVDQCVWMDCYBQK-DOTOQJQBSA-N 328.481 5.158 30 20 EKED CC(C)Cc1ccc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 326611200 LWEMOLMRLCFILE-ROUUACIJSA-N 336.479 5.199 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cc(Cl)ccc1Cl 427874059 HVENFPUAYZMKSM-MNOVXSKESA-N 337.225 5.416 30 20 EKED CC(C)Sc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 433027841 NAJPSBWPBZXLHK-OAQYLSRUSA-N 338.520 5.712 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCC1CCC(C#N)CC1 442869419 AQIAKPRSXAMCKZ-SOAGJPPSSA-N 338.520 5.260 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 464535276 CTHDINARJFHOLX-CQSZACIVSA-N 327.390 5.045 30 20 EKED CCC(=O)Nc1ccc(C)c(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481674619 VWDAIEVGVJQWMK-HXUWFJFHSA-N 347.462 5.095 30 20 EKED Cc1ccc(OCc2nc(CSCCC(C)(C)C#N)cs2)cc1 514812947 SQOFTISALVKNNO-UHFFFAOYSA-N 346.521 5.204 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)Cc1coc2ccc3ccccc3c12 527310972 AYBHIZBWRAEDFW-UHFFFAOYSA-N 348.446 5.059 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1ccc(-c2ccc(F)cc2)cc1 536723752 ZSGFLVRIXVSWSB-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)c1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c(C(C)C)c1 538534897 DVKKUOZZHGTJHX-UHFFFAOYSA-N 346.474 5.741 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1cc2c(ccc3ccccc32)o1 540597806 ZQUQXRPNMMFWDJ-HNNXBMFYSA-N 326.399 5.308 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C1CCOCC1 543034305 IAWXYBDMXKTZFS-UZUQRXQVSA-N 348.490 5.081 30 20 EKED N#CCc1ccccc1NC(=O)CCCc1ccc(Cl)c(Cl)c1 565857441 RJMFRCICZROZAU-UHFFFAOYSA-N 347.245 5.021 30 20 EKED C[C@@H](CCC#N)Sc1ncnc2scc(-c3ccc(F)cc3)c12 572106542 PEQKWWAIMGZVTG-NSHDSACASA-N 343.452 5.282 30 20 EKED Cc1ccccc1-c1cnc(CN[C@@H](CCCC#N)c2ccccc2)o1 576896122 NQCZFPXHIWCCSO-FQEVSTJZSA-N 345.446 5.175 30 20 EKED CC(C)[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 603657781 LKJSZYPCQUDBPJ-IBGZPJMESA-N 335.451 5.007 30 20 EKED C=CCC[C@H](NCc1nc(C)oc1C)c1ccc(C(F)(F)F)cc1 660203628 GESBZLLAUQGVRR-INIZCTEOSA-N 338.373 5.107 30 20 EKED C[C@@H](C#N)Oc1ccc(C=NN(c2ccccc2)c2ccccc2)cc1 727687798 PPQQSIMCMVOLMK-SFHVURJKSA-N 341.414 5.150 30 20 EKED CC[C@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 732915848 JFBBHXGZJJXCBQ-GOTSBHOMSA-N 326.443 5.905 30 20 EKED CC(=NNc1nc2ccccc2s1)c1cccc(-c2ccncc2)c1 741450873 CYBKSGSPSOHTMX-UHFFFAOYSA-N 344.443 5.194 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1cnc(-c3ccccc3)[nH]1)C2=O 742435604 YYMWMBVHCXYYEN-LFIBNONCSA-N 346.455 5.011 30 20 EKED CC1(C)CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc2ccccc2s1 752473323 FZURDELYLQKTEN-UONOGXRCSA-N 326.465 5.079 30 20 EKED C[C@@H](C=NOCc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1 756895487 PLKMPGHMEKITLE-LBPRGKRZSA-N 325.305 5.151 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2cnc(-c3cccs3)s2)c1 763292599 QFESNTPTUOJNDA-ALCCZGGFSA-N 329.421 5.215 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 785851748 MZKOPPNGMDBDPH-HXUWFJFHSA-N 344.414 5.311 30 20 EKED C=CCC[C@H](N[C@@H]1COCc2cccc(Cl)c21)c1ccccc1 788668483 BEETZKNOYOSAPH-RBUKOAKNSA-N 327.855 5.208 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CCCC)ON=C(C)C 789887973 HLORUQVRGTUHET-IBGZPJMESA-N 344.499 5.448 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(Cl)c(Cl)nc1C 808805767 QCTHYORKFLAOCA-UHFFFAOYSA-N 335.234 5.068 30 20 EKED O=C1C(=Cc2ccc(-c3ccc(F)cc3)s2)C(=O)c2ccccc21 834681065 VHOCTTJGEAQFGX-UHFFFAOYSA-N 334.371 5.017 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 915988210 SEBZOXRNCQZESP-SOFGYWHQSA-N 329.421 5.215 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)cc1 917142495 FQBLIKNFLMCYJP-MDWZMJQESA-N 328.415 5.163 30 20 EKED CC(=NOCc1csc(C(C)(C)C)n1)c1cc2ccccc2o1 918186250 XMLKMNVHWVKPNF-UHFFFAOYSA-N 328.437 5.128 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(COC(C)(C)CC)c1C 78797232 ICPBCNKXXQPCME-UHFFFAOYSA-N 332.488 5.130 30 20 EKED C=CCC[C@@H](NCc1sc(C)nc1C(F)(F)F)c1ccccc1 183644656 TWCQRRCOVODCJT-CQSZACIVSA-N 340.414 5.267 30 20 EKED Cc1sc(CN[C@H]2CCCCc3cc(C#N)ccc32)nc1C(C)C 360837977 AAKUKCARDOTLGX-SFHVURJKSA-N 339.508 5.004 30 20 EKED N#CCC[C@@H](NCc1csc(Cl)c1Cl)c1ccccc1 432256925 IBTQOVMALKVTBZ-CYBMUJFWSA-N 325.264 5.190 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 433928843 CTFDFKKBELTKGX-AWEZNQCLSA-N 334.444 5.084 30 20 EKED C[C@H](S[C@@H](C)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 443144512 QAPROSWKONJUIF-KBPBESRZSA-N 335.432 5.164 30 20 EKED C=CCC[C@H](C(=O)N(CC=C)Cc1cccs1)c1ccccc1 448137244 CXRPRXKBORQAJU-IBGZPJMESA-N 325.477 5.013 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(COC(C)C)cc1 485451988 DWNHMKYIEVEZOW-UHFFFAOYSA-N 341.476 5.142 30 20 EKED CCC(CC)(NCc1ccc(C#N)cn1)c1ccc(Cl)c(Cl)c1 516488317 MOZDNAHYMBLMCY-UHFFFAOYSA-N 348.277 5.065 30 20 EKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCCC3)c(Cl)c1C 543043733 JKWPVVRXGILMMY-UHFFFAOYSA-N 344.867 5.021 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 582501793 IFWSPJSOMWHJFO-UHOFOFEASA-N 342.895 5.044 30 20 EKED Cc1ccc2sc(CN[C@@H](CCCC#N)c3ccccc3)nc2c1 599426583 JFKWEZLKQWECOG-KRWDZBQOSA-N 335.476 5.130 30 20 EKED CC(C)CCc1ccccc1NC(=O)c1cc2ccccc2n1CC#N 609169528 DEAIASDSLATYPQ-UHFFFAOYSA-N 345.446 5.006 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](C)CC(C)(C)C 609377885 QJVNXHUBDVWQOY-GJZGRUSLSA-N 332.513 5.339 30 20 EKED CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 610142569 APKCOOFIOAQWAH-ARFHVFGLSA-N 345.512 5.171 30 20 EKED Cc1cc2cc([C@H](C)N[C@@H]3CCc4cc(C#N)ccc43)oc2cc1C 618803026 GMSPYKQPGTXYHY-MGPUTAFESA-N 330.431 5.259 30 20 EKED CCCCCCCCC(=O)Nc1ccccc1SC(=O)N(C)C 731415163 DMLAJRZBRYCFCM-UHFFFAOYSA-N 336.501 5.149 30 20 EKED O=C1/C(=C\c2ccc3ncccc3c2)CSc2c(Cl)cccc21 731939761 UNBCEQVHULBKBA-UVTDQMKNSA-N 337.831 5.260 30 20 EKED C=CCCCN(C)C(=S)Nc1ccccc1Oc1ccccc1 736450036 ISNUEMSPALJOCX-UHFFFAOYSA-N 326.465 5.074 30 20 EKED C=CCCCC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 748525356 ZMXSZUZEEPVHDK-GFCCVEGCSA-N 344.307 5.267 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)C3CCCC3)n2)cc1 750687795 OSPVDZMGFTUVIL-RHSMWYFYSA-N 338.476 5.121 30 20 EKED C[C@H]1C/C(=C\c2cccc(OCCCC#N)c2)C(=O)c2ccccc21 751537726 ZJFNPSZZWOQDAV-KXGFGANYSA-N 331.415 5.143 30 20 EKED CCC(CC)[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 762033790 DXYLKIKSJTUSTL-CZUORRHYSA-N 326.465 5.059 30 20 EKED C=CCC[C@@H](NCc1ccc2c(c1)COC(C)(C)O2)c1ccccc1 768706543 PNDZVJBGZISQAJ-HXUWFJFHSA-N 337.463 5.129 30 20 EKED Cc1cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)o1 782383942 YRQHAFLTLMLIQL-MRXNPFEDSA-N 330.431 5.286 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc(C)c(Br)s1)c1ccccc1 796340055 ILPKYGINGWAOBO-ZFWWWQNUSA-N 348.309 5.234 30 20 EKED C=CC[C@@H](N[C@H](c1cccc(OC(C)C)c1)C(F)F)c1ccncc1 848531969 YJYZAZHAVZKESE-RTBURBONSA-N 346.421 5.082 30 20 EKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)C1CC(F)(F)C1 863096314 CQSNLQMLCLBNGL-UHFFFAOYSA-N 349.328 5.148 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(C2CC2)CC1 931061076 AUDLXMUJULGEDC-UHFFFAOYSA-N 344.474 5.285 30 20 EKED C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(CCC#N)cc1 932560460 WZCSDQMFTOWSGW-CQSZACIVSA-N 341.842 5.021 30 20 EKED CC1(C)CCC/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C1=O 1776550752 FIFRRMGQMGTQGS-XMHGGMMESA-N 334.415 5.214 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sccc1C1CC1 70859313 SGPORODVDIXLBU-LBPRGKRZSA-N 342.489 5.130 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C 113570163 BFLDSAWUCSVLRM-ZDUSSCGKSA-N 339.464 5.199 30 20 EKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1ccccn1 159748386 WNGVBZRWMKQGNW-GOSISDBHSA-N 348.789 5.017 30 20 EKED Cc1nc2ccccc2cc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 179550918 WFOJFOAJZBOMRT-UHFFFAOYSA-N 349.459 5.026 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCc2occc21 191417151 QCHHHFDKROLTIY-GOSISDBHSA-N 338.451 5.331 30 20 EKED Cc1cc(/C=C\C(=O)c2cnn(C(C)C)c2)c(C)n1C1CCCCC1 214913389 VYPHKVTZKWUFQD-KHPPLWFESA-N 339.483 5.284 30 20 EKED COc1cc(C(=O)/C=C\c2ccccc2F)ccc1SC(F)F 214926280 DFMLWZRYLOANNT-VURMDHGXSA-N 338.350 5.045 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnn(C(C)C)c2)cc1 255331988 DGQPUXHTHFGTCT-JYRVWZFOSA-N 346.430 5.036 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CC1CCCCC1 303525635 FZOSQDSYLBXWHM-JKSUJKDBSA-N 344.524 5.483 30 20 EKED N#Cc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)c(Cl)c1 430362501 FAUAOCYKURGYRJ-ROUUACIJSA-N 346.817 5.107 30 20 EKED C[C@H](N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc(C#N)cc1 435672903 LGFVVQVBPSJLQF-IXDGSTSKSA-N 344.380 5.174 30 20 EKED C=CCC(CC=C)C(=O)N1CC=C(c2cccc3ccccc23)CC1 467337516 VQISNVJBHIMLEI-UHFFFAOYSA-N 331.459 5.224 30 20 EKED C=CCC(CC=C)C(=O)Nc1c(F)cccc1Oc1ccccc1 467527976 CHIVEEGOXJCAHE-UHFFFAOYSA-N 325.383 5.325 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CCCCC1(C)C 469198157 IYCMOWZAESMWLU-CABCVRRESA-N 330.497 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@@H]1c1ccccc1 475565104 WAQACGPZYRULLL-UXHICEINSA-N 334.463 5.216 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCCC[C@H]1C 476087666 BRSBNYYOYULHRS-VQIMIIECSA-N 329.484 5.072 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccc(F)c(F)c1 502431821 PNVQEYGTPDZHPL-VLIAUNLRSA-N 345.437 5.244 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccnc(-c2ccccc2)c1 504149351 OSVSZVGONLXZBM-UHFFFAOYSA-N 349.459 5.030 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1cccc(-c2ccncc2)c1 507173491 NHIVVMVHETZMGU-UHFFFAOYSA-N 341.458 5.031 30 20 EKED C=C(C)CCc1noc(C(F)(F)c2ccc(Cl)c(Cl)c2)n1 508661880 APXKMQSIYRBYIG-UHFFFAOYSA-N 333.165 5.025 30 20 EKED CC(C)CCSCC(=O)Nc1sc(-c2ccccc2)cc1C#N 512323841 PKEILWSFURGREE-UHFFFAOYSA-N 344.505 5.005 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 523512008 CRBQCHBTKGGUAJ-JKSUJKDBSA-N 339.401 5.014 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)CCC(C)(C)C#N 540688251 UWYBRJLIMGCGPK-HNNXBMFYSA-N 327.497 5.051 30 20 EKED CCSc1ccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 561129976 DPIJIKYHQOQEBV-QVKFZJNVSA-N 336.504 5.398 30 20 EKED C[C@@H](Nc1ccc(F)cc1C#N)c1ccc(Oc2cccnc2)cc1 576975381 PDQZBGCATUAATP-CQSZACIVSA-N 333.366 5.058 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 588719966 NJWHFUOFSAHNQR-UHFFFAOYSA-N 340.854 5.521 30 20 EKED N#Cc1cc(CS[C@H](c2ccccc2)c2ccc(F)cc2)ccn1 610954401 TVRCEKKSMBGGEG-HXUWFJFHSA-N 334.419 5.115 30 20 EKED CCCCCCCCCN(C)C(=O)c1csc(-c2ccoc2)n1 730965795 JBYRMHCNLHHOTQ-UHFFFAOYSA-N 334.485 5.226 30 20 EKED C=CCN(CCc1ccccc1)Cn1ccc(=S)c2ccccc21 731661907 WRJUDLVOAPRURR-UHFFFAOYSA-N 334.488 5.059 30 20 EKED COc1cc(C(=O)/C=C\c2cccc(OC(C)C)c2)ccc1SC 747614661 LLWQEYAPKHCHOE-NTMALXAHSA-N 342.460 5.100 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1 763288844 JGGMFGMEVJWSMM-HYXAFXHYSA-N 329.421 5.215 30 20 EKED CCCCCCCS(=O)(=O)Cc1csc(C2CCCCC2)n1 764738501 PPRGYZHGEQZUAK-UHFFFAOYSA-N 343.558 5.076 30 20 EKED N#Cc1ccc(F)c(CN[C@H]2CCCSc3ccc(Cl)cc32)c1 773030884 WZHFCMMMQCRYPB-KRWDZBQOSA-N 346.858 5.068 30 20 EKED CCCCCCCCS(=O)(=O)Cc1csc(C2CCCC2)n1 790147350 CEYMEVMUICPHLL-UHFFFAOYSA-N 343.558 5.076 30 20 EKED O=C(/C=C/c1ccc(C(F)F)cc1)c1sccc1Br 794936851 FZMRWUOCOHGUQE-ZZXKWVIFSA-N 343.192 5.344 30 20 EKED CC(/C=C/C(=O)c1cncc(F)c1)=C\c1ccccc1C(F)(F)F 799893925 WSMPHXHGNGEVTO-ZYUHXDNHSA-N 335.300 5.082 30 20 EKED C[C@@H]1/C(=C/c2ccccc2OCc2ccccn2)C(=O)c2ccccc21 809156604 MTWJQRBADCCVSF-AKGOGDBKSA-N 341.410 5.044 30 20 EKED CCCc1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1 915984569 AFGUKLSRKYRBFH-QXMHVHEDSA-N 334.444 5.054 30 20 EKED CC(C)[C@H]1/C(=C/c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776308776 MUXKDUNGYOWEPC-PLMLNFJUSA-N 346.382 5.151 30 20 EKED O=C(/C=C\c1ccc(Cl)cc1)c1sccc1Br 90486098 MDTCGCSONJTCQV-UTCJRWHESA-N 327.630 5.060 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(F)cc1Cl 130318082 NAUMLHOYMKSITQ-AWEZNQCLSA-N 346.833 5.012 30 20 EKED CCc1cccc(C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 432462161 SEGCADOXBUFTRC-LJQANCHMSA-N 335.451 5.114 30 20 EKED CC(C)(C#N)CCCCSCc1nc(-c2cccc(Cl)c2)no1 435883171 ITGMEPHWVOCKRJ-UHFFFAOYSA-N 349.887 5.343 30 20 EKED Cc1sc2ncnc(S[C@H](C)c3cccc(C#N)c3)c2c1C 442901037 IXXFUUJFGPVBJW-GFCCVEGCSA-N 325.462 5.033 30 20 EKED N#Cc1ccc(N[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1Cl 445593685 RKZFWLKWLIAYJX-GOSISDBHSA-N 340.858 5.013 30 20 EKED CCO[C@H](C)c1nc(CSc2ccc(C#N)cc2Cl)cs1 465389915 VMLIBZCXLUEAND-SNVBAGLBSA-N 338.885 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCc2sccc21 476123981 RCWLDAXMPBUUQT-SFHVURJKSA-N 339.504 5.659 30 20 EKED Cc1nc(C)c(C#N)c(S[C@H](Cc2ccccc2)c2ccccc2)n1 496521728 XVPJZLNCUZZCSK-HXUWFJFHSA-N 345.471 5.041 30 20 EKED N#CCSc1cccc(-c2nc(C(C3CCC3)C3CCC3)no2)c1 508612942 CAYXWMQTEAJWQY-UHFFFAOYSA-N 339.464 5.036 30 20 EKED N#CC1(CCCSCC2CCC(C(F)(F)F)CC2)CCOCC1 512379275 ZLWACLDIHRYLTR-UHFFFAOYSA-N 349.462 5.189 30 20 EKED N#CC1(CCCSC/C=C/c2ccc(Cl)cc2)CCOCC1 512390291 BXBDUPXTAGZSDH-HNQUOIGGSA-N 335.900 5.187 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(CSC)c1 522115963 RBXDXMYGIRORSK-UHFFFAOYSA-N 332.513 5.150 30 20 EKED Cc1sc(CNCC(C)(C)CCC#N)nc1-c1ccc(Cl)cc1 525196053 VABZDZUCHDBUQT-UHFFFAOYSA-N 347.915 5.192 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1ccccc1)c1cccc(Cl)c1 532159692 XCLGXZIPNNQMKS-IBGZPJMESA-N 326.871 5.349 30 20 EKED N#CCC1(CSCc2nc(-c3ccccc3Cl)cs2)CC1 596368104 WGSXEXCZDFGATG-UHFFFAOYSA-N 334.897 5.391 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 604903981 CFZAVPYGMLFBED-ZDUSSCGKSA-N 337.448 5.049 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)s1 609407969 KLAVFNTUEKXDPB-OALUTQOASA-N 346.455 5.078 30 20 EKED C[C@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1cccc(C#N)c1 610829947 SVXUDCXSPSDLLU-KGLIPLIRSA-N 346.446 5.327 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C2CC2)C1 685089274 HZORZWLNSPQRNY-GOSISDBHSA-N 326.484 5.192 30 20 EKED CCC[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 726445232 UBJNALUBPPLAME-QGZVFWFLSA-N 343.883 5.039 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1nccs1 735232887 WBDZNFYOEGMMDQ-SREVYHEPSA-N 346.864 5.125 30 20 EKED O=C(/C=C\c1cc2ccccc2o1)c1sccc1Br 750903752 DFBTZZXJLIDMPZ-WAYWQWQTSA-N 333.206 5.153 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1 763007512 AIULRLGGLZRHKZ-JOCHJYFZSA-N 349.474 5.060 30 20 EKED C=CCC[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1 775464203 QYSJRKCRGIZSSS-LJQANCHMSA-N 340.854 5.039 30 20 EKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 776081295 MQWAIRDXOSCHLW-ZIAGYGMSSA-N 347.409 5.214 30 20 EKED CCSc1ccc(Cl)cc1N[C@@H](C)c1ccc(OCC#N)cc1 777677356 JJHJBOXQDSBQQM-ZDUSSCGKSA-N 346.883 5.527 30 20 EKED C=CC[C@@H](C(=O)OCc1nc(-c2ccccc2)oc1C)c1ccccc1 778426336 DHTCNVMQMNHFSN-LJQANCHMSA-N 347.414 5.053 30 20 EKED O=C(/C=C\c1scnc1C1CC1)c1c[nH]c2cc(Cl)ccc12 782328713 KEDZTJUVXDXHTF-WAYWQWQTSA-N 328.824 5.051 30 20 EKED CC(C)Oc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)c(Cl)c1 783316707 PGWMCRLPPIBIBB-AWEZNQCLSA-N 344.842 5.203 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C(C)=C/c1ccc(F)cc1 789718966 MALODKHVQWEATL-JQIJEIRASA-N 337.438 5.720 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1ccnc(F)c1 794720356 QDDQZPKEWCXREE-ALCCZGGFSA-N 327.742 5.030 30 20 EKED Clc1cccnc1NN=Cc1c(Cl)ccc(Cl)c1Cl 917546464 NCXPIYQMRIEQFS-UHFFFAOYSA-N 335.021 5.141 30 20 EKED Cc1c(NN=C(CC(C)(C)C)c2ccc(F)cc2)cccc1C(=O)O 1776086672 HQWOYGNNLGOLTB-UHFFFAOYSA-N 342.414 5.085 30 20 EKED Cc1ccc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)s1 71813670 MTNJUYCAVFVYDK-BQYQJAHWSA-N 329.421 5.215 30 20 EKED CCC[C@H]1CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 135770462 AMWMQXRQRNGPFU-HOTGVXAUSA-N 345.512 5.125 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H]1CCc2ccc(F)cc21 178396715 DVWITRNIEARBBF-SUMWQHHRSA-N 326.440 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1C 189872761 HNMBDJAIIOTJJU-UHFFFAOYSA-N 327.855 5.753 30 20 EKED N#Cc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)cc1 237843316 XQNUNGDTUUNSGD-QHCPKHFHSA-N 326.443 5.022 30 20 EKED CCC(C)(C)[C@@H]1CCc2nc(N=C(O)C3CCC(=O)CC3)sc2C1 329234141 MNPZVGGOZHTKOU-CYBMUJFWSA-N 348.512 5.032 30 20 EKED O/C(=N\C1CCC2(CC1)CC2)C1CCC(/N=C(/O)C2CCCC2)CC1 329960208 QZJFHTGWHXTYDD-UHFFFAOYSA-N 346.515 5.371 30 20 EKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 364721671 LLSSPDCVGUDAQD-FQEVSTJZSA-N 347.462 5.165 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H]1CC[C@H](C#N)C1 424335008 WBXVZALMUFRXQK-PVXIVEMSSA-N 345.899 5.115 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2cccs2)n1C1CC1 436119665 DDWIWUYFSWOCGM-UHFFFAOYSA-N 346.525 5.154 30 20 EKED COc1ccc(Br)cc1SCCCCC(C)(C)C#N 436193156 HRWDFTKMUZRBEZ-UHFFFAOYSA-N 342.302 5.270 30 20 EKED C=CCOc1ccc(CN[C@H](CC(F)(F)F)c2ccccc2C)cc1 444009110 IOZTUXRSAJBTCL-LJQANCHMSA-N 349.396 5.343 30 20 EKED Cc1ccc(N(C(=O)CCCC#N)c2nc3ccccc3s2)c(C)c1 463579312 XRWDTVHLPAYUHB-UHFFFAOYSA-N 349.459 5.272 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C 466248879 VVUHRVQOWZLXQV-NEPJUHHUSA-N 326.267 5.041 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1cccc(C)c1C 473361492 PSKXGWPGMVLPQR-OAQYLSRUSA-N 347.462 5.243 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C/c1ccccc1F 476092096 VAYLGADQHYMEPL-DHZHZOJOSA-N 337.438 5.720 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(F)c(F)c1 476121712 HOUGPDBESZQBKT-CQSZACIVSA-N 343.417 5.559 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C2CCC2)cc1 489794860 GNGANQUGDZJITJ-UHFFFAOYSA-N 347.462 5.270 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@@H](c2cccs2)C2CC2)CC1 507655131 ZSSFUOXPLIGLNL-VEDCXYSMSA-N 336.504 5.193 30 20 EKED C[C@H](N[C@@H](COc1ccccc1)c1ccccc1)c1cccc(C#N)c1 540609556 UPJZSCZJEGUNRM-MBSDFSHPSA-N 342.442 5.029 30 20 EKED C=CCCOCCCCC(=O)N(c1ccccc1)C1CCCCC1 540617632 VGZBHDASBINQJN-UHFFFAOYSA-N 329.484 5.115 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)c(F)c1 540709259 JVCUMSNDSHMPBH-BFUOFWGJSA-N 328.406 5.274 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Cl 559862230 BYIJLYWTTMZEOO-IFXJQAMLSA-N 330.834 5.565 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)c1ccccc1 560565058 SGONJUHISBMEBZ-OAQYLSRUSA-N 348.421 5.610 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 580101748 HHNMIBCCOXGUED-FDDCHVKYSA-N 328.459 5.926 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cc3ccccc3o2)cc1Cl 589636338 ICHZOFMTUNFGQR-AWEZNQCLSA-N 341.838 5.502 30 20 EKED CC(C)(NCc1ccc(C2(C#N)CC2)cc1)c1cccc(Cl)c1F 594946511 PELQFKMNOLVLLX-UHFFFAOYSA-N 342.845 5.059 30 20 EKED C[C@@H](CCNC(=O)c1c(Cl)cc(C#N)cc1Cl)CC(C)(C)C 615491050 NSLDHOAKXMUZIR-NSHDSACASA-N 341.282 5.057 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2ccc(SC(C)C)cc2)cc1 726940315 QEIIWGBIBJYVAD-UHFFFAOYSA-N 338.476 5.056 30 20 EKED CCc1c(C)sc(NC(=O)c2cc3c(F)cccc3s2)c1C#N 727790426 IHLYHNCCRMJEDU-UHFFFAOYSA-N 344.436 5.097 30 20 EKED C#CCCOc1ccc(CN[C@@H](C)c2cccc(Cl)c2Cl)cc1 735509122 VDQIFHVMOSFNHK-AWEZNQCLSA-N 348.273 5.246 30 20 EKED C/C(=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 742537740 OYCFNWZAQAVNJA-FZWACIFYSA-N 332.447 5.273 30 20 EKED C=C(C)[C@@H](Cc1nc(-c2ccc(SC(C)(C)C)cc2)no1)OCC 762344722 AZWZZHJNZOAAGI-MRXNPFEDSA-N 346.496 5.151 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(F)c(Br)c1)c1ccccc1 773113875 GIQGKZUFNBJKPM-FZKQIMNGSA-N 346.243 5.003 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792099396 IAUQQQPHVDUKTL-QUCCMNQESA-N 334.463 5.408 30 20 EKED Cc1cc(NC(=O)NCC2CCC(C#N)CC2)ccc1-c1ccccc1 799412415 YYAYQHPBGXSBLP-UHFFFAOYSA-N 347.462 5.114 30 20 EKED CC(C)N(Cc1ccc(O[C@H](C)C#N)cc1)[C@H](C)c1ccsc1 817415915 AFRHCYUPQIETGY-HZPDHXFCSA-N 328.481 5.011 30 20 EKED Cc1ccc(CNc2ccccc2S[C@H](C)CC#N)c(Cl)n1 841695926 XUILWYMQERHWSK-CYBMUJFWSA-N 331.872 5.050 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc2ccccc2s1 1776033592 DYZMDDBRFDAQCG-UHFFFAOYSA-N 344.823 5.089 30 20 EKED Cc1nc(-c2cccc(NCc3ccc(O[C@@H](C)C#N)cc3)c2)cs1 155738538 QXTIITYEBARCJV-AWEZNQCLSA-N 349.459 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC[C@H]1CCCCO1 191423143 XGVWLKPOXOXIAO-GOSISDBHSA-N 344.499 5.009 30 20 EKED Cc1cc(C)c(C/N=C(/O)C2(C3CCCCC3)CCCCC2)c(O)n1 329922257 TWEKESBHVOSDOE-UHFFFAOYSA-N 344.499 5.391 30 20 EKED CC(C)[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 431767877 BLJHKTOGJLBGFJ-SFTDATJTSA-N 349.478 5.118 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2cc3[nH]ccc3cc2C)CCCC1(C)C 445156016 GRZIHJCBDYRSLK-SFHVURJKSA-N 325.456 5.075 30 20 EKED C[C@H](N[C@H]1CCCc2occc21)c1ccc(-c2cccc(C#N)c2)cc1 447593274 QUQBDWVBROWMKT-AOMKIAJQSA-N 342.442 5.546 30 20 EKED C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1F 512286701 DIXYYWSCUCJDEL-ZDUSSCGKSA-N 347.393 5.403 30 20 EKED Cc1cc(SCC(=O)Nc2c(C)cccc2C(C)C)ccc1C#N 521625258 PJYNUUWLMZSHMH-UHFFFAOYSA-N 338.476 5.029 30 20 EKED N#Cc1cccc(SCc2ncc(-c3ccc(Cl)cc3)o2)c1 531199804 QGUCCQNPNMJXQV-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccccc1 535422553 YOOMBNZJKCFZBV-QGZVFWFLSA-N 346.430 5.257 30 20 EKED CC(C)(C#N)CCSCc1cc(Br)cc2cccnc12 562889250 BGZZSQKDIXIIJE-UHFFFAOYSA-N 349.297 5.170 30 20 EKED N#Cc1ccc(CNCc2csc3ccccc23)c(C(F)(F)F)c1 568568769 KKPOCQKSDAJROL-UHFFFAOYSA-N 346.377 5.082 30 20 EKED CCCOc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 582560556 MHEDHSWRLICLNC-GCJKJVERSA-N 336.479 5.561 30 20 EKED N#CC1(c2ccc(CN[C@@H](c3ccc(Cl)cc3)C3CC3)cc2)CC1 594916392 DPDQNGDKKILEQK-HXUWFJFHSA-N 336.866 5.136 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@H](C)c1cccc(C#N)c1 610830362 ODDHQIYBJLVTJN-CHWSQXEVSA-N 327.497 5.033 30 20 EKED CC(C)(C#N)c1ccc(CNc2cccc(Oc3ccccn3)c2)cc1 614058786 VWPFPICTMBVLFW-UHFFFAOYSA-N 343.430 5.287 30 20 EKED N#CCCSc1ccccc1N=Cc1c(O)ccc2ccccc12 730951072 JVLKIRCRIRIVAV-UHFFFAOYSA-N 332.428 5.302 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2cnn(C(C)C)c2)o1 734304878 ZPIXEGGIKZZFSJ-VMPITWQZSA-N 338.382 5.068 30 20 EKED COc1cc(/C=C/C(=O)c2c(C)[nH]c3ccccc23)ccc1SC 746342711 ZHLMDTKJFVBQHH-CSKARUKUSA-N 337.444 5.103 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3cc4ccccc4o3)co2)cc1 748441774 VERRROZPNQINFA-ZHACJKMWSA-N 329.355 5.292 30 20 EKED N#C[C@H](C(=O)CC1CCCCCC1)c1nc(-c2ccccc2)cs1 750686651 IDXGVFYJWKZDRF-QGZVFWFLSA-N 338.476 5.347 30 20 EKED CSc1ccc(C(=O)/C=C\c2nc(Cl)cs2)c(Cl)c1 765614550 XVEUYNBPPVDISQ-PLNGDYQASA-N 330.261 5.068 30 20 EKED O=C(/C=C/c1scnc1C1CC1)c1cc(Cl)sc1Cl 782311618 DOXUYGZZRVQSQP-ONEGZZNKSA-N 330.261 5.285 30 20 EKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2ccc(Cl)cc21 788353906 JZWZLDHRTXYISM-UITAMQMPSA-N 343.757 5.028 30 20 EKED CCN(Cc1cc2ccccc2c(Cl)n1)[C@@H](C)c1ccc(C#N)cc1 788479096 NVNRRBROOPPJOD-HNNXBMFYSA-N 349.865 5.343 30 20 EKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1cc(Cl)ccc1Cl 804389874 NXVZCHUTDZCLPL-ZCFIWIBFSA-N 332.643 5.148 30 20 EKED N#Cc1cccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)c1 853284791 FYUMPQMHJTVSEQ-UHFFFAOYSA-N 337.267 5.011 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc2[nH]c(C(=O)O)cc2c1 1776786010 AHSQVTXRYIANCH-AWEZNQCLSA-N 344.455 5.191 30 20 EKED O=C(/C=C/c1ccc(C(=O)O)s1)c1cc2c(ccc3ccccc32)o1 1777569863 WLWPGXRUKFPKAM-SOFGYWHQSA-N 348.379 5.242 30 20 EKED CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CCO 95581635 CZWLTVDAEFVSGP-KHPPLWFESA-N 339.564 5.475 30 20 EKED Cc1cc2cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)oc2cc1C 124593601 ZVDFODOAJPGEJN-AWEZNQCLSA-N 338.432 5.120 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)[S@](=O)CCCC(C)(C)C#N 177118014 HGDRLWCHKAWVBP-PRWKNARSSA-N 332.296 5.133 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCCCCc2cccs2)n1 177769292 MRJNWSPOEJETQQ-HNNXBMFYSA-N 346.521 5.307 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2cc3ccccc3s2)cc1 237503341 QNTWIGMTHYACLT-LSDHHAIUSA-N 336.460 5.043 30 20 EKED Cc1ccccc1Oc1ccccc1CNCc1cc(C#N)cs1 237572220 ORUYSDSBNIOWQH-UHFFFAOYSA-N 334.444 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc([C@H]2CCOC2)c1 276498939 WWPBTOQFXBGLFC-FQEVSTJZSA-N 349.474 5.295 30 20 EKED CCCC[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 289628310 PFGAQNOTHSDJGE-CABCVRRESA-N 333.501 5.123 30 20 EKED CC[C@H](C#N)Oc1cccc(CNc2ncc(-c3ccccc3)s2)c1 301551840 YNNIRHGHKSJOFH-QGZVFWFLSA-N 349.459 5.103 30 20 EKED CCc1ccc([C@H](C)CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303770326 JENQXROOKCRRSV-MRXNPFEDSA-N 334.463 5.182 30 20 EKED CC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1c(C)noc1C 411522000 ZPPPRSCSFVWNKN-OAQYLSRUSA-N 345.446 5.071 30 20 EKED C=C(C)COc1cccc(NC(=O)CCc2c[nH]c3cc(C)ccc23)c1 465127785 JGWLRVGAPKISKD-UHFFFAOYSA-N 348.446 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]1Cc1ccccc1 475578044 LASBMIVJMLKPHM-HXUWFJFHSA-N 348.490 5.387 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccc(C)cc1 476168172 WLMBMDIDGMSGKB-SFHVURJKSA-N 335.491 5.664 30 20 EKED CC(C)C(=O)Nc1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481993530 RZGUMCBJRPTSPW-OAQYLSRUSA-N 347.462 5.032 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(F)c(Cl)cc1Cl 525952008 QGYNKPYZUWAZGC-MNOVXSKESA-N 337.225 5.416 30 20 EKED CC(C)(C#N)CCN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 540713357 SSSIIQGZSZZUAU-HNNXBMFYSA-N 344.808 5.339 30 20 EKED N#CCCCOc1cccc(CN[C@H]2CCCC[C@@H]2c2ccccc2)c1 559072232 YQCGKTGHJNXEMI-PKTZIBPZSA-N 348.490 5.185 30 20 EKED CC(=NNc1ccccc1)c1sc(-c2ccc(Cl)cc2)nc1C 727650795 UQQPNBBSWYLIOT-UHFFFAOYSA-N 341.867 5.608 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 740764134 LQCBQQYJFHWHAT-CMDGGOBGSA-N 327.305 5.150 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3cc4ccccc4o3)co2)cc1 748441773 VERRROZPNQINFA-KHPPLWFESA-N 329.355 5.292 30 20 EKED CCCc1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1 753143336 WQTIIKVPSYUHKD-QXMHVHEDSA-N 334.444 5.054 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1O 775522918 BRLHUEIJPUIUJR-MSOLQXFVSA-N 328.843 5.131 30 20 EKED N#Cc1ccc(CNc2ccccc2SCc2ccccc2)cc1 780649801 ONLKHGBSUKDLTC-UHFFFAOYSA-N 330.456 5.463 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccnc(Cl)c3)cs2)cc1 782183888 GBSZTVNXUGSUME-VOTSOKGWSA-N 340.835 5.063 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccccc1C(F)(F)F 789128421 SWVRPOUKBSNJCY-FPLPWBNLSA-N 349.333 5.318 30 20 EKED N#CCCC[C@H](NC(=S)Nc1cccc(Cl)c1)c1ccccc1 814210961 XOFAZMUACPGEIV-KRWDZBQOSA-N 343.883 5.062 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(Cl)cc1Cl 916137610 WKBFJXGVTAVEOV-YWEYNIOJSA-N 328.198 5.438 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@H]1CC2(CCC2)Oc2ccccc21 932217069 CJAJQDZSCNLFOV-FQEVSTJZSA-N 346.474 5.024 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(F)c(Cl)c2)c1 207592915 YNAHODAIXLAGOF-TWGQIWQCSA-N 343.785 5.058 30 20 EKED CCC[C@@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 236913103 BDOFLYHOGYQHDC-GOSISDBHSA-N 332.369 5.208 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@@H](C)c2cccc(C#N)c2)o1 237567649 BKGXFBAYGHWVNN-HNNXBMFYSA-N 334.394 5.117 30 20 EKED Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 286498932 MFTHBZMUISWCIU-ZDUSSCGKSA-N 342.464 5.358 30 20 EKED Cc1c(CNCc2ccc(C#N)cc2)sc2ccc(Cl)cc12 441363187 YQZGZAOWEZUTAP-UHFFFAOYSA-N 326.852 5.025 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(SC)ccc1C 469906484 LMFCVGVFPVYFQG-UHFFFAOYSA-N 340.492 5.327 30 20 EKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccccc1C(C)(C)C#N 487369164 SWFRYVAQEGGJQV-HNNXBMFYSA-N 349.503 5.290 30 20 EKED CC[C@@H](C)[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Cl)cc1 498012554 BHERQVXBNDNBOX-PBHICJAKSA-N 349.906 5.056 30 20 EKED N#Cc1ccccc1CSCc1csc(-c2ccsc2)n1 498118938 AAHSCZKQMDNLII-UHFFFAOYSA-N 328.487 5.177 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)[C@H](C)c1cccc(O)c1 505016267 DRYQWKDDHDMACH-MRXNPFEDSA-N 338.451 5.126 30 20 EKED CCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518752360 OECVJVJLDHJXMA-OAHLLOKOSA-N 337.423 5.003 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)Nc3cccc(F)c3)cc2)cc1 522779681 ZIOLWFLUAYJMCF-UHFFFAOYSA-N 347.349 5.134 30 20 EKED CSc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)ccc1F 539172635 HAPDOBIDNSEUSE-UHFFFAOYSA-N 348.468 5.031 30 20 EKED COc1ccc2cc([C@@H](C)NC3(c4cccc(C#N)c4)CC3)ccc2c1 551805686 CCZSKOYXDYVLDV-MRXNPFEDSA-N 342.442 5.060 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)CCCCCC#N 588327896 JGUZUGRWRUJVKL-KRWDZBQOSA-N 340.492 5.312 30 20 EKED N#Cc1cccc(CN[C@@H](CCCc2ccccc2)c2ccccc2)c1 611697170 YJIXTIBMSRFKSW-DEOSSOPVSA-N 340.470 5.412 30 20 EKED C=C(C)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 614092969 UACKBVXFKOCJEU-MRXNPFEDSA-N 335.476 5.223 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(C#N)cc3C)cc2)cs1 614407457 RFVWSVXTZQSKRX-OAHLLOKOSA-N 347.487 5.149 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1Cl 618808041 YRPIXYZIMGNJJR-PIGZYNQJSA-N 331.246 5.203 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 729892415 YGFQUILHLWXNIH-GOEBONIOSA-N 326.465 5.059 30 20 EKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 744037836 FJBJJGKPZQUHQW-KBPBESRZSA-N 347.409 5.214 30 20 EKED CCCCCCCC[S@](=O)[C@H](C)c1nc(-c2ccccc2C)no1 790139750 MMOBLQHHQAFAJK-GYCJOSAFSA-N 348.512 5.215 30 20 EKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NN[C@@H](C)C(C)(C)C 793114425 GUYDCBCJIIQWCM-AWEZNQCLSA-N 346.906 5.007 30 20 EKED CC(C)CC(=O)Nc1ccc(N=Cc2c(O)ccc3ccccc23)cc1 912782419 RNLBZQHBNCFFCW-UHFFFAOYSA-N 346.430 5.281 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCCCCC2)cc1 915352572 MJBKBETWFLKHRL-OAQYLSRUSA-N 347.462 5.140 30 20 EKED COc1ccc2c(c1)CC/C(=C\c1csc(-c3ccccc3)n1)C2=O 916153591 UXPPNMLLPIJIIT-LFIBNONCSA-N 347.439 5.031 30 20 EKED CCC/C(C)=C/C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 920224824 NCAVKHIBKVNSMU-NTCAYCPXSA-N 334.419 5.344 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1csc(C(F)(F)F)c1 926148781 TUQAVVXCTRKBCH-UWVGGRQHSA-N 342.361 5.189 30 20 EKED CCO[C@@H](C)c1nc(CS[C@@H](C)c2ccc(C#N)cc2)cs1 76861211 KNAAIVCBDHFLQW-STQMWFEESA-N 332.494 5.107 30 20 EKED CN(C(=O)c1ccccc1-c1ccccc1C#N)C1CCCCCC1 105356624 BJKDKJQFEQUJIP-UHFFFAOYSA-N 332.447 5.020 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1cccc2ccccc12 237495043 FEJLPCJNDULRKT-SFHVURJKSA-N 344.458 5.373 30 20 EKED Cc1nnc(S[C@H](C)c2cccc(C#N)c2)n1[C@H]1CCC[C@H](C)C1 248923975 LGKPRLKLRGNWRN-IYOUNJFTSA-N 340.496 5.063 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC(C)(C#N)CC1 272578240 SYCXDUSYDDJXLW-UHFFFAOYSA-N 345.512 5.043 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(CC(F)(F)F)c1 438559358 YHOUPQVEUNPLHR-UHFFFAOYSA-N 348.368 5.012 30 20 EKED Cc1sc(NC(=O)[C@H](C)c2ccc3ccccc3c2)c(C#N)c1C 439783589 OWFMTEHZBZNTEF-CYBMUJFWSA-N 334.444 5.132 30 20 EKED CC(C)(C#N)CCCCN(Cc1cccs1)Cc1cccs1 444599806 SFYFKAJBCANJCV-UHFFFAOYSA-N 332.538 5.532 30 20 EKED N#C[C@H](C(=O)c1cc(F)c2ccccc2c1)c1nc2ccccc2s1 495290725 ZYFUZUSSAJAWET-OAHLLOKOSA-N 346.386 5.079 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 505052561 VFWXPOSHJTXDEW-QFIPXVFZSA-N 334.463 5.001 30 20 EKED Cc1ccc2ccccc2c1CSCCCC1(C#N)CCOCC1 510121772 XZMWLDKDJHABHO-UHFFFAOYSA-N 339.504 5.482 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1Oc1ccncc1 510786984 KMAYTDSYFYJQHF-UHFFFAOYSA-N 344.414 5.245 30 20 EKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCC(C)(C)CCC#N 516476707 XHUMCFSLPIVFCM-CYBMUJFWSA-N 345.487 5.238 30 20 EKED CC(C)c1ccc(-c2noc(CSc3ccccc3C#N)n2)cc1 525081814 SEYSERGLZRYOHN-UHFFFAOYSA-N 335.432 5.024 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(-c2ccncc2)c1 531695884 QDOXIOUDQVLONO-SJORKVTESA-N 327.431 5.032 30 20 EKED C=CC[C@@H](C)[C@@H](C)Nc1ccccc1CN(C)C(=O)c1cccs1 541206235 PDYCGAPMEIZPGW-HZPDHXFCSA-N 342.508 5.033 30 20 EKED CC(C)[C@@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 556205724 MGWJPAWDWVTICG-RJGXRXQPSA-N 332.491 5.896 30 20 EKED CC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(C)cc1 568455717 WMIZXVIQHFKKJC-GOSISDBHSA-N 332.369 5.126 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@@H](C)c2ccc(C#N)cc2)o1 609677607 OXHWJSMIWNVJOM-HNNXBMFYSA-N 334.394 5.117 30 20 EKED C[C@H](N[C@H](C)CC1CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1 611871372 ATGLLHQIOQKOQV-MSOLQXFVSA-N 348.490 5.081 30 20 EKED CCOc1cccc2cc(C(=O)/C=C/C3=Cc4ccccc4OC3)oc12 726741850 IDJNMWAQTBOEMI-ZHACJKMWSA-N 346.382 5.046 30 20 EKED CCOc1c(Cl)cc(/C=C2/CCc3sccc3C2=O)cc1OC 726891267 HUGAPKFNOLZRNX-WQLSENKSSA-N 348.851 5.021 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 734083572 PVNAILNWYQJLSV-HIFRSBDPSA-N 344.455 5.218 30 20 EKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cc2ccccc2s1 780188962 SJOGVDBWUJSXRN-AATRIKPKSA-N 348.452 5.316 30 20 EKED C=CCN(CCC#N)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 814484063 AAIYFRGAPQYFPJ-UHFFFAOYSA-N 333.395 5.036 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(SC2CCCC2)cc1 914703711 XXMHZKKJBVLLCS-QXMHVHEDSA-N 327.449 5.222 30 20 EKED CCCCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351889 HMXOUJCXRAQWHE-HXUWFJFHSA-N 335.451 5.044 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2CCCCCC2)cc1 915352233 IXFRPMHUFOYCNV-OAQYLSRUSA-N 347.462 5.186 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1ccc(Cl)cc1Cl 921261802 JNXFORQRRKXLAY-KTAJNNJTSA-N 327.594 5.249 30 20 EKED C[C@@H](Sc1cccc(C#N)c1)c1nnc(-c2cccc(Cl)c2)o1 158747156 LYXGXLJGQIIAKZ-LLVKDONJSA-N 341.823 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cc2ccccc2o1 189878831 GHDQZBIWQZMFJV-INIZCTEOSA-N 347.458 6.027 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(OCC#N)cc1 192923081 KEPQKBKKYPKNRI-CHWSQXEVSA-N 349.261 5.308 30 20 EKED CCc1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)C(C)C)cc1 236967914 AZDMOROEWPZMLL-JTSKRJEESA-N 336.479 5.027 30 20 EKED Cc1cccc(CN(CCCCC(C)(C)C#N)Cc2ccccn2)c1 444667795 UAIMBGLXFMAVBF-UHFFFAOYSA-N 335.495 5.112 30 20 EKED C[C@H](SCc1ncc(-c2cccc(F)c2)o1)c1ccc(C#N)cc1 477022226 SWWNBTFMXJZCFX-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED C=C(CNC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 478095060 MQNQTACBYGMEKK-UHFFFAOYSA-N 336.769 5.113 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1CCC(C)(C)CC1 494832666 KPEDQOYGTJJEND-AWEZNQCLSA-N 330.497 5.093 30 20 EKED C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 497385935 HIVAWTYFSXYEHQ-IPHCALEISA-N 345.446 5.023 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C(CC)CC)[C@H]1CCCc2cccnc21 511301936 BZITUJGIARTOTQ-LPHOPBHVSA-N 328.500 5.079 30 20 EKED CC(C)c1ccc(-c2ncc(CN(C[C@@H](C)C#N)C3CC3)s2)cc1 533138828 XHQURMQSXMNCAV-HNNXBMFYSA-N 339.508 5.058 30 20 EKED CCN(c1ccccc1)c1ccc(CNCc2ccc(C#N)s2)cc1 539502427 BHEHBKTXGXWZPI-UHFFFAOYSA-N 347.487 5.068 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2cccnc2)cc1 539609764 LVEIDEAZTTVSBH-JKSUJKDBSA-N 345.421 5.171 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cccnc1 602987230 ISLVTSDCHJJRDF-WTKPLQERSA-N 340.835 5.063 30 20 EKED Cc1cc(OCc2ccccc2)ccc1N[C@@H](C#N)Cc1ccccc1 735316835 DFPGOSIXJSIRKA-OAQYLSRUSA-N 342.442 5.121 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1 743057594 UZCQLZJYVGUDKO-XGICHPGQSA-N 344.414 5.288 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)(C)C 744036088 XFJUTPAXIDMHPV-DNXIFWLFSA-N 338.476 5.287 30 20 EKED CCCCCCCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1 749129759 ARGYZXYTDRANCI-UHFFFAOYSA-N 344.480 5.299 30 20 EKED N#CCCN(CC1CC1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 750581839 XIWWXCJAICGVJQ-UHFFFAOYSA-N 347.422 5.260 30 20 EKED C[C@H](N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 766348490 AABZXSXMUVPCBM-MEDUHNTESA-N 347.245 5.039 30 20 EKED CCc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 770146508 QEAKLZORNNWMDH-QFIPXVFZSA-N 340.426 5.157 30 20 EKED C#CCCCCC(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 773626829 ZHPYCQGFDLQITM-CQSZACIVSA-N 345.826 5.101 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1 796000639 NAPIHVFREBVRQH-UHFFFAOYSA-N 344.867 5.355 30 20 EKED COCc1ccccc1/C=C(/C)C=NOc1ccccc1C(F)(F)F 814225702 VNYPJQSZGJUUOZ-NDBCLQIESA-N 349.352 5.320 30 20 EKED CCC/C(C)=C\C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 920222166 REIOHAFEWNRCIF-ICFOKQHNSA-N 348.446 5.017 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(C)cccc1C(C)C 63388921 LSHFSCCPEQPVQV-UHFFFAOYSA-N 347.462 5.210 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1cc(F)ccc1F 108407513 BVQHZOYRXQHCPB-CHWSQXEVSA-N 332.419 5.390 30 20 EKED C[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 192930441 QZTSQXGOLGSPQG-SFHVURJKSA-N 342.442 5.029 30 20 EKED CC(C)C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 236623343 LJACLCPMNJGZTK-JOCHJYFZSA-N 336.479 5.246 30 20 EKED Cc1cc(Cl)c2ccccc2c1N=C(O)C[C@@H]1CCCC(O)=N1 329630611 HZQUTVYSKLMAHT-LBPRGKRZSA-N 330.815 5.289 30 20 EKED Cc1cscc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 439177949 MPNRJEQVLUUMCN-UHFFFAOYSA-N 348.427 5.167 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@@H](C)CCC[C@H]1C 477777234 ZBINYUGGDXUBKH-JTOWHCCKSA-N 345.512 5.027 30 20 EKED C[C@@H](SCCCc1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 479527016 NTUDKYQHBFPNIS-OAHLLOKOSA-N 349.459 5.035 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)s1 483239646 SKXPNWMZPDLNJC-OAHLLOKOSA-N 334.444 5.084 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCCC(C)(C)C#N 488808963 VWVHKYKVRYLWQL-HJPURHCSSA-N 333.541 5.514 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 540705221 FLHGGMOLWMLYCQ-GAJHUEQPSA-N 344.433 5.332 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-c2ccc(F)cc2)o1 553305289 OJFJKMSOCRCOHB-OAQYLSRUSA-N 346.405 5.125 30 20 EKED CCCC[C@@H](CC)COCc1cccc(NC(=O)C2(C#N)CCC2)c1 609856557 ITSIXNKEONGQBJ-QGZVFWFLSA-N 342.483 5.052 30 20 EKED C=C(CNC(=O)c1ccccc1SCc1ccco1)c1ccccc1 673342204 QGIIBLOOABQVEI-UHFFFAOYSA-N 349.455 5.015 30 20 EKED CCCN1Cc2cccc(N=Cc3c(O)ccc4ccccc34)c2C1 727265640 VZKLWEVIMYBWEP-UHFFFAOYSA-N 330.431 5.022 30 20 EKED Fc1cccc(F)c1NN=Cc1c(Cl)ccc(Cl)c1Cl 735615519 SAYKURRQFHCEEQ-UHFFFAOYSA-N 335.568 5.371 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2cccc(-c3cccnc3)c2)c(Cl)c1 788360290 HYNZAYMLPKBRJX-CLFYSBASSA-N 344.801 5.170 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C\c2scnc2C2CC2)cc1Cl 789157954 RZNMTOFNFLYDPE-VURMDHGXSA-N 347.867 5.357 30 20 EKED O=C(/C=C/c1ccc(C(F)F)cc1)c1cccc(-c2ccncc2)c1 794942563 OICFMBHHQJNHJG-RMKNXTFCSA-N 335.353 5.582 30 20 EKED C=CCC[C@H](NCc1nc(C)c(C)o1)c1ccc(C(F)(F)F)cc1 342232385 YQCDOIVYUACBMM-INIZCTEOSA-N 338.373 5.107 30 20 EKED CCSc1cccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)c1 426578921 JMCSHSXFDAIKEF-MRXNPFEDSA-N 349.459 5.089 30 20 EKED C[C@@H](SCc1coc(-c2cccs2)n1)c1cccc(C#N)c1 443134159 NWQAYYAHDDINHX-GFCCVEGCSA-N 326.446 5.269 30 20 EKED CCCCN(C(=O)Nc1cccc(CC#N)c1)[C@H](C)c1ccccc1 455912280 WYYGXTDKEKYFFQ-QGZVFWFLSA-N 335.451 5.148 30 20 EKED Cc1cncc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 467636213 PCJYZEYTEGOKCG-ZWKOTPCHSA-N 341.458 5.341 30 20 EKED Cc1cccnc1[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)C(C)C 507633814 DPWLLYMZPDLUGJ-QKDPSFTKSA-N 347.506 5.081 30 20 EKED N#C[C@H](C(=O)c1occc1-c1ccccc1)c1nc2ccccc2s1 513682425 VGKOXNLQZZWNGW-OAHLLOKOSA-N 344.395 5.046 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1 572166252 IHBOKBWSTJPHDJ-FXAWDEMLSA-N 339.479 5.370 30 20 EKED N#CCCC[C@H](NCc1csc(C(F)(F)F)c1)c1ccccc1 598981497 YEKVWQXTRVMMKA-HNNXBMFYSA-N 338.398 5.292 30 20 EKED C=CCCSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 606756183 WTZHXKSROQYLAP-UHFFFAOYSA-N 342.295 5.501 30 20 EKED C=C(C)COc1cccc(NC(=O)[C@@H](C)c2cccc(Cl)c2)c1 607821873 OASDUWSVTDDQGR-AWEZNQCLSA-N 329.827 5.037 30 20 EKED CCc1ccsc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176609 SKYIIENUXHAYLM-UHFFFAOYSA-N 348.427 5.227 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccccc1 677521659 PRIKWRKMCBIBIN-QGZVFWFLSA-N 346.430 5.257 30 20 EKED CC(C)c1ccc(C=NOCc2ncc(-c3ccc(F)cc3)o2)cc1 727484160 YHTAUPKMLFJHQV-UHFFFAOYSA-N 338.382 5.155 30 20 EKED Cc1ccccc1NC(=S)Nc1ccccc1S[C@H](C)CC#N 731322351 XXVZTUDWXZCONQ-CQSZACIVSA-N 341.505 5.198 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N(C)[C@H](C)CC#N)sc2c1 732656866 FVXBCOOZPQUOPA-LLVKDONJSA-N 334.872 5.052 30 20 EKED C[C@H](SCC(=O)Nc1ccc2ccccc2c1)c1ccc(C#N)cc1 735675172 CBVCYUNVQQHOOS-HNNXBMFYSA-N 346.455 5.144 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 742429316 LRSNSMMLFPOPJQ-PLNGDYQASA-N 332.639 5.308 30 20 EKED Clc1ccc2c(NN=C3CCC4(CCOCC4)CC3)ccnc2c1 751515910 ARDJMPSMGWWCES-UHFFFAOYSA-N 343.858 5.027 30 20 EKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1scnc1C1CC1 782170013 DMEOEGXOQPFNQX-UHFFFAOYSA-N 347.487 5.057 30 20 EKED C[C@@H](Nc1snc(Cl)c1C#N)c1ccc(F)c2ccccc12 808120182 GGGRAYNQBHTGBS-SECBINFHSA-N 331.803 5.134 30 20 EKED CCCCCCCC(=O)N1CCC(c2c[nH]c3ccccc23)CC1 886306495 ORTRRJQEZWHXMW-UHFFFAOYSA-N 326.484 5.234 30 20 EKED CCCCCCCC(=O)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1 915660844 PUZPRXUMBYFERJ-UHFFFAOYSA-N 342.458 5.283 30 20 EKED CC(=NNc1cccc2ncccc12)c1cccc(C(F)(F)F)c1 915964848 RAJWSWZXJXXQOY-UHFFFAOYSA-N 329.325 5.090 30 20 EKED Cc1cc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)c(C)s1 915984808 OGDFOWBUYZZDII-YVMONPNESA-N 349.455 5.235 30 20 EKED CC(C)c1ccc(C=NOCc2csc(-c3cccs3)n2)cc1 920399274 PDDLCEDWAKEAMO-UHFFFAOYSA-N 342.489 5.546 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776697864 SXFNLGKXOOCJOQ-NHAQELONSA-N 342.822 5.448 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(C)o2)cc1OCc1ccccc1 16975945 RETHSTKDJPAHSD-PKNBQFBNSA-N 348.398 5.072 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 90665395 BCUZKIOAKXTOIQ-RBUKOAKNSA-N 344.405 5.374 30 20 EKED C[C@H](Nc1ccc(Cl)c(Br)c1)c1cccc(C#N)c1 94667965 LWFTXSWBLWZTOY-JTQLQIEISA-N 335.632 5.147 30 20 EKED Cc1ccccc1Sc1ccc(C(=O)[C@@H](C#N)c2ccccn2)cc1 122396831 XWMTVNFHKKHULV-SFHVURJKSA-N 344.439 5.031 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)CSCCC(C)(C)C#N 289469183 VYBRBJFYOCSDDK-UHFFFAOYSA-N 346.540 5.545 30 20 EKED N#CCCC[C@H](N[C@H]1CCSc2ccc(F)cc21)c1ccccc1 340453905 RTALYRDIPMJSDX-OALUTQOASA-N 340.467 5.387 30 20 EKED Cc1cccc([C@H]2CCCCN2C(=O)[C@H](C)c2cccc(C#N)c2)c1C 462180465 MGTURVKZQYVLDG-XMSQKQJNSA-N 346.474 5.032 30 20 EKED N#CCCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1 463082077 CFHNVKRAXUMOLS-UHFFFAOYSA-N 349.217 5.418 30 20 EKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 476037940 BWSWXQBCWAIZNF-AWEZNQCLSA-N 347.245 5.044 30 20 EKED Cc1ccc(C(F)(F)F)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 476205070 KOPDZXXSOYFYCR-OAHLLOKOSA-N 346.352 5.040 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519199300 WUMDYTJKDBGSLA-GOSISDBHSA-N 349.434 5.147 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)CCCC(F)(F)F)c2)cc1 538839166 OKPZLAPTLZRQLY-UHFFFAOYSA-N 348.324 5.022 30 20 EKED CCN(C(=O)c1coc2ccc(C(C)C)cc12)c1ccc(C#N)cc1 573878487 AEGCDYKDWJSKKI-UHFFFAOYSA-N 332.403 5.095 30 20 EKED CC[C@@H](C#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 593447350 DEGJUJUSVAKIJV-KGLIPLIRSA-N 341.842 5.001 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)c1ccc(C)o1 604499791 AEEIKALSCBSGFJ-INIZCTEOSA-N 339.439 5.049 30 20 EKED N#Cc1nc(N2CC=C(c3cccc4ccccc34)CC2)ccc1Cl 609449155 PMRNBXRIWPOKNN-UHFFFAOYSA-N 345.833 5.054 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)c(F)c1 611366147 DUBBRMHEIBDQOF-SFHVURJKSA-N 349.236 5.245 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)c(Cl)c1 618807787 WQZBKRICOVGLPJ-VOJFVSQTSA-N 331.246 5.203 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)[C@@H]1CCCCO1 654047734 UWDPNXKQCCBLBX-MOPGFXCFSA-N 344.499 5.008 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccccc1 677521657 PRIKWRKMCBIBIN-KRWDZBQOSA-N 346.430 5.257 30 20 EKED CCCCCCCC(=O)Nc1ccccc1NC(=O)c1cccs1 726516161 JLDWKQJAYHQVPL-UHFFFAOYSA-N 344.480 5.299 30 20 EKED CC[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)C 729316064 HGVQGLIBEHGQDL-UTKZUKDTSA-N 334.463 5.353 30 20 EKED C=CCCC[C@H](C)NC(=S)Nc1ccc(SC(F)F)cc1 776203367 PIQZJGGBZSCOKC-NSHDSACASA-N 330.469 5.033 30 20 EKED CC(C)N(C(=O)CC(C)(C)C#N)c1ccc(Nc2ccccc2)cc1 782750176 MOWXGPRAJWRNRO-UHFFFAOYSA-N 335.451 5.111 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(SC(C)(C)C)cc1C 785770011 VHQPDLKGCYIISB-OAHLLOKOSA-N 332.513 5.458 30 20 EKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccsc1 790313817 UJLUUDRUONBFRD-UHFFFAOYSA-N 349.484 5.023 30 20 EKED CC(/C=C/C(=O)c1ccnc(Cl)c1)=C\c1ccccc1OC(F)F 811693520 KFWNJMGECZGXPL-AOQSKOSGSA-N 349.764 5.179 30 20 EKED C=CCC(F)(F)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 815220774 WDBZNRLBZPKEKQ-AWEZNQCLSA-N 330.378 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(C(C)C)c1Cl 861269626 YOHHVKALSBIKBV-UHFFFAOYSA-N 345.874 5.222 30 20 EKED CC(C)[C@@H]1/C(=C\c2ccc(C(=O)O)cc2Cl)C(=O)c2ccccc21 1776308864 RVLCJAUGBVREAE-WBNHJWIASA-N 340.806 5.058 30 20 EKED Cc1cccc2c(C(=O)/C=C/c3cc(C(=O)O)c(Cl)s3)coc12 1777449106 XQHFPMYTOAYXAW-AATRIKPKSA-N 346.791 5.050 30 20 EKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 80457940 WVHNJGGIFCSSCY-JKSUJKDBSA-N 326.465 5.027 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C(C)(C)C)s2)n1 126043469 PZQMZQIGHKHUPB-NSHDSACASA-N 332.494 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1c(CC)noc1C 191448478 UGVRMSZCVVNKCD-UHFFFAOYSA-N 327.428 5.041 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416736810 PQJTZENKLIRJAP-FQEVSTJZSA-N 347.462 5.189 30 20 EKED N#CCC[C@@H](Nc1ncnc2sc3ccccc3c12)c1ccccc1 440642905 RDGWACAQZFJAPW-MRXNPFEDSA-N 344.443 5.301 30 20 EKED CC[C@H](N[C@H]1CCCOc2cc(Cl)ccc21)c1ccc(C#N)cc1 447578679 GKGXAFNWJMQYCW-OALUTQOASA-N 340.854 5.166 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1ccc(C#N)cc1 447591236 HIXALNKAJUFPGN-SCLBCKFNSA-N 348.368 5.259 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC12CCSCC2 451331554 OBKPYDZHZZZUNP-QGZVFWFLSA-N 329.509 5.010 30 20 EKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455900917 CXSBIDLKGLORDL-OAQYLSRUSA-N 347.462 5.245 30 20 EKED CCCCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)C(C)C 458799097 JFPMNVTYRIQVPM-LJQANCHMSA-N 329.488 5.032 30 20 EKED C=CCCC1(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)CC1 475458771 NJXMDLCEJKXLME-UHFFFAOYSA-N 342.826 5.212 30 20 EKED C=C(C)[C@@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480692037 FKNYLEDFKJXSIK-RBUKOAKNSA-N 346.377 5.231 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1Cl 507769852 WTQINMWOYQGRKT-UHFFFAOYSA-N 340.854 5.711 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 536836660 BUYJIEZFOFYKJM-DYVFJYSZSA-N 333.262 5.689 30 20 EKED C[C@H](NCCCC(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 543874604 FVXLYEMBECSOQM-KRWDZBQOSA-N 331.463 5.206 30 20 EKED CC(C)(C)C[C@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588159265 IFGXZHKFCGIFFT-KRWDZBQOSA-N 334.891 5.408 30 20 EKED C[C@H](Nc1cccc(-c2ccc3c(c2)CCO3)c1)c1cccc(C#N)c1 600853228 ZIZGAHKXPLIQKM-INIZCTEOSA-N 340.426 5.333 30 20 EKED CC(C)[C@@H]1CCCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609757070 ICTYAWSOPPXTSY-NRFANRHFSA-N 348.446 5.001 30 20 EKED N#CCCCn1cc(C(=O)Nc2ccc(C3CC3)cc2)c2ccccc21 618223733 ULMCWYOODHMZBX-UHFFFAOYSA-N 343.430 5.075 30 20 EKED CC[C@@H](Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(C#N)cc1 618573756 AMQKYAUGKPWHPZ-HXUWFJFHSA-N 331.419 5.393 30 20 EKED N#Cc1cccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)c1 727266678 CJOUMRKAOTWCBP-FNORWQNLSA-N 335.712 5.127 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2)s1)c1ccc(OCC#N)cc1 729685932 NNFKYIXVWDJQGQ-INIZCTEOSA-N 348.471 5.168 30 20 EKED CCO[C@@H](C)c1nc(CON=Cc2ccc(C(C)(C)C)cc2)cs1 736604819 PFIFTAUTEJAORC-AWEZNQCLSA-N 346.496 5.089 30 20 EKED COc1cc(/C=C\C(=O)c2cccc3ccccc23)ccc1SC 746340368 GWMSWOSBOFBVMK-BENRWUELSA-N 334.440 5.466 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)cn1 746686414 ARKIGRYNLAXXAQ-FPLPWBNLSA-N 340.423 5.228 30 20 EKED Cc1cc(CCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)s1 753390325 MPIFDUYUCKWLTJ-GOSISDBHSA-N 348.471 5.112 30 20 EKED Cc1cc(N[C@H](C)c2ccc(OCC#N)cc2)cc(C(F)(F)F)c1 754123548 LKYFPKYOZZDCEX-CYBMUJFWSA-N 334.341 5.089 30 20 EKED CC(C)n1cc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cn1 754690386 TZNWHFGLKDUDPC-UTCJRWHESA-N 342.748 5.032 30 20 EKED C[C@@H](C(=O)OCCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 768728429 ISSYHVVMXCKYPS-CYBMUJFWSA-N 341.373 5.072 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1ccccc1C(F)(F)F 769733050 NBZXZMYWRXOHFE-QGZVFWFLSA-N 338.417 5.562 30 20 EKED C=CC[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccncc1 780528480 XGDKDSVWRRJJTF-MRXNPFEDSA-N 340.776 5.161 30 20 EKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc(Cl)cc1 915043863 BPZAJMYIPLTYGH-XCVCLJGOSA-N 349.817 5.210 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C=C(C2CC2)C2CC2)cc1 917668660 DOLTWPLWHFWRIP-JOCHJYFZSA-N 342.442 5.027 30 20 EKED CC(C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46706895 DZKYVBLHPTVQCH-CQSZACIVSA-N 332.856 5.076 30 20 EKED COc1cc([C@H](C)N[C@H](CCC#N)c2ccccc2)ccc1SC 90665791 ZLFGUKZXGVYQKY-MAUKXSAKSA-N 340.492 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)cc1 189886016 SJHHPNLYXVWMSO-UHFFFAOYSA-N 327.855 5.373 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 255696918 YDJIHSAUYKLCBJ-ICDLMJIXSA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CCC[C@@H]1C 475549334 LKMJRAIQPNHUKU-IRXDYDNUSA-N 328.500 5.581 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2cccc3ccncc23)CC1 539695548 WFPARJXDOUSKGU-UHFFFAOYSA-N 327.431 5.051 30 20 EKED CC(C)(CCC#N)CN[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 554076527 FRTPKXJPOROMGD-RDJZCZTQSA-N 338.417 5.261 30 20 EKED CCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 726858188 GCFZGKNFNRXZSE-ZDUSSCGKSA-N 332.856 5.076 30 20 EKED C#CCN(CC)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 752715299 KEJICKVDYDIORJ-MRXNPFEDSA-N 338.476 5.027 30 20 EKED CC(C)(C#N)CCCCN1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 769788636 KGLJMNQBRAUVDK-INIZCTEOSA-N 338.417 5.215 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCc1ccsc1 783470723 VTIOKUVRZXIHOT-CQSZACIVSA-N 344.505 5.104 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(N=Cc2cc(Cl)ccc2O)cc1 915113063 MSVNPWLWDRIMPJ-FQEVSTJZSA-N 346.817 5.452 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(F)c(C(=O)O)c1 1776064318 HXPPOLKPZKLVAI-SUMWQHHRSA-N 348.462 5.554 30 20 EKED C=CCc1ccccc1/C=C(/CCC(=O)O)c1nc2ccccc2s1 1776125032 VPSXRZUOIJQVJH-VKAVYKQESA-N 349.455 5.430 30 20 EKED C=CCCC1(C(=O)O)CCN(CCCCCCCCCC2CC2)CC1 1776169760 JSUUAWMKZLAKOF-UHFFFAOYSA-N 349.559 5.650 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccccc2)C(C)(C)C)cc1OC 65980711 BFIWSQDMUPHVHD-OAQYLSRUSA-N 339.479 5.137 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cc1 110653158 YJMLIGJRCLNGIU-OXFRDRNISA-N 346.213 5.180 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(C(C)C)oc1C 286551642 RNFBGMRMLSJXAF-UHFFFAOYSA-N 326.440 5.211 30 20 EKED C=CCn1c(SCc2ccc(-c3ccccc3)cc2)nnc1C1CC1 301149585 WHERTFHUXWDSMB-UHFFFAOYSA-N 347.487 5.301 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)cc1 303680066 ITSOANOLELTJJE-AWEZNQCLSA-N 349.459 5.585 30 20 EKED C[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 315389154 FHYCOWMVRWEGCL-GHMZBOCLSA-N 337.225 5.416 30 20 EKED CC(C)(C)c1ccc(CNc2cccc(OCCCC#N)c2)s1 322970384 YGMDIFYJOQZHSW-UHFFFAOYSA-N 328.481 5.340 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccccc1F)c1ccccc1 435095606 IOSRSFUJTCJEPO-OXQOHEQNSA-N 340.442 5.236 30 20 EKED C[C@H]1CCCc2ccccc2[C@H]1NCc1cccc(OCCCC#N)c1 462542362 MIAUPNMYFBRZDB-MBSDFSHPSA-N 348.490 5.172 30 20 EKED Cc1ccc(C#N)cc1NCc1nc(C)c(-c2ccc(Cl)cc2)o1 489698652 FKFISNDGESNVCK-UHFFFAOYSA-N 337.810 5.096 30 20 EKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)sc1C 521499101 WNZSJURSYRHWHV-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CC(C)CCc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 540732623 AQOWVYLADKEBHV-UHFFFAOYSA-N 332.447 5.083 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1ccc(CC#N)cc1 541293867 CFFSZJYUFIXCDU-UHFFFAOYSA-N 340.473 5.211 30 20 EKED Cc1cc2cc([C@@H](C)NC3(c4cccc(C#N)c4)CC3)oc2cc1C 551817621 PZHDDWLOQXVAQL-MRXNPFEDSA-N 330.431 5.261 30 20 EKED C=CCC[C@@H](NCc1ccc(-c2csc(C)n2)cc1)c1ccco1 552048480 UOFVLIJWUXNRNR-GOSISDBHSA-N 338.476 5.509 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@H]1CCc2ccc(C#N)cc21 569513780 PXSAQWSONOSIOY-OALUTQOASA-N 344.380 5.137 30 20 EKED C=CCOc1cccc(CN[C@H](C)c2cccc(Cl)c2Cl)c1 605166464 RNIZQOAOCYMHHF-CYBMUJFWSA-N 336.262 5.409 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)CC(C)(C)C 609377883 QJVNXHUBDVWQOY-CABCVRRESA-N 332.513 5.339 30 20 EKED CC(C)[C@@H](CC1CCCC1)C(=O)Nc1cccc(OCCCC#N)c1 609693882 HVPUZWIHESNRCZ-HXUWFJFHSA-N 342.483 5.160 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(CC)cccc1CC 615471635 CDHDMXBDAXLHCD-UHFFFAOYSA-N 340.442 5.171 30 20 EKED C=CCC[C@@H](NCc1cccc(OCc2ccccn2)c1)c1ccco1 671741305 LSKLOUNWUIBEMP-OAQYLSRUSA-N 348.446 5.051 30 20 EKED CC(C)CN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 726484023 AJKRVZFPRFERLM-UHFFFAOYSA-N 343.883 5.071 30 20 EKED Cc1ccc(C2CC(=NNc3ncnc4c3oc3ccccc34)C2)cc1 729816226 IIAZOKYDQXDQEA-UHFFFAOYSA-N 342.402 5.030 30 20 EKED Cc1sc2nc(-c3ccc(OCC#N)cc3)cc(C3CC3)c2c1C 731357917 VNMNMGXCGLPWDK-UHFFFAOYSA-N 334.444 5.360 30 20 EKED Cc1cscc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748536043 UVQIPYUYIUHGGF-SFHVURJKSA-N 347.443 5.356 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(N2CCCCCC2)cc1)c1ccncc1 766022881 YKHBHATWWWAYSO-XXBNENTESA-N 349.522 5.430 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccccc2Cc2ccccc2)cc1 770511265 TVRFSXVRJHFYBA-SFHVURJKSA-N 342.442 5.180 30 20 EKED COc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1OC1CCCC1 777639504 VWRZNBFVHAUHRL-HNNXBMFYSA-N 336.435 5.061 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc(C2CC2)oc1C1CC1)c1ccccc1 820479116 SEBLIAJYWVHHHV-LJQANCHMSA-N 348.446 5.199 30 20 EKED O=C(/C=C/c1ccc(-n2cccn2)cc1)c1cc(Cl)ccc1Cl 884003448 SXTASEYXXQRVBE-RUDMXATFSA-N 343.213 5.075 30 20 EKED CCCCCCCCCNC(=O)Nc1ccc(C)c(NC(C)=O)c1C 918047939 JOAKGRATQLHBOR-UHFFFAOYSA-N 347.503 5.134 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(Cl)c1Cl 62372963 JRLXLVBWIFAAOF-UHFFFAOYSA-N 349.261 5.256 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1 116609401 DYUDIGXZQWVPEP-PMDBQALLSA-N 346.213 5.180 30 20 EKED CC(C)Oc1cccc([C@H](C)NCc2ccccc2C(C)(C)C#N)c1 179680203 GWBCUSOCZVOGID-KRWDZBQOSA-N 336.479 5.126 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ncc(C(C)(C)C)o1)c1ccc(F)c(F)c1 187777556 ZSIPBFJWCCCNMJ-PXAZEXFGSA-N 334.410 5.218 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCn1ccc2ccccc21 188063861 AALLXHTVDUITOC-UHFFFAOYSA-N 346.474 5.522 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)=O)cs1 189878043 RFKZHSAOKLNZFM-UHFFFAOYSA-N 327.449 5.055 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(SC)c1 189884432 VENDMZIXVPEEQG-UHFFFAOYSA-N 343.467 5.652 30 20 EKED C[C@@H](S[C@H](C)c1nc(Cc2ccccc2)no1)c1cccc(C#N)c1 190891401 CLTCJNMPJXVIBB-HUUCEWRRSA-N 349.459 5.087 30 20 EKED OC(=Nc1cc(C(F)(F)F)cnc1O)[C@@H]1CCC[C@H]2CCCC[C@H]21 329026674 VRYYLGLIKLMVMZ-RAIGVLPGSA-N 342.361 5.001 30 20 EKED Cc1nc(-c2ccc([C@H](C)Nc3c(C#N)cccc3C#N)cc2)cs1 436311340 WVFHCVPLYUWCDT-ZDUSSCGKSA-N 344.443 5.035 30 20 EKED CC[C@H](CC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C)cc1 439671096 ZPYIGCYGFYVWRE-WIYYLYMNSA-N 334.463 5.040 30 20 EKED N#CCCCOc1cccc(N[C@@H](c2ccccc2)C(F)(F)F)c1 462814407 PSYRCXWICKBPQD-KRWDZBQOSA-N 334.341 5.085 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 467734592 SDPRYIRIPHAYNV-UHFFFAOYSA-N 349.434 5.038 30 20 EKED C=CCOc1ccc(CN[C@H](CC)c2ccccc2OC(F)F)cc1 518268004 SUNMEPOSQWQIJM-GOSISDBHSA-N 347.405 5.094 30 20 EKED N#Cc1ccc(CNc2cccc(CSC3CCCC3)c2)s1 537729402 MHQZUDHFZRLIGG-UHFFFAOYSA-N 328.506 5.408 30 20 EKED Cc1c(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)oc2ccccc12 570483581 XMKSTOGOYDDUQA-MRXNPFEDSA-N 343.386 5.031 30 20 EKED C=C(C)[C@@H](Cc1nc([C@@H](c2ccc(Cl)cc2)C(C)C)no1)OCC 578099274 LQLHFLIQQWNGCD-SJLPKXTDSA-N 348.874 5.035 30 20 EKED N#C[C@@H](Cc1ccccc1)Sc1ccc(Cl)c(C(F)(F)F)c1 603451644 UVAGTHGQYBOBLN-CYBMUJFWSA-N 341.785 5.586 30 20 EKED C=CCCCN(C)C(=O)Nc1cc(Cl)ccc1SC(C)C 605921580 AEMIPEDKFHHKHC-UHFFFAOYSA-N 326.893 5.270 30 20 EKED Cc1cccc2sc(C(=O)N[C@]3(C#N)CCC[C@@H](C)C3)c(Cl)c12 609736974 VMCBAMDENYGRFP-ADLMAVQZSA-N 346.883 5.065 30 20 EKED Cc1nc(C(F)(F)F)c(CSCc2ccc(C#N)cc2C)s1 614394886 YBYUSIBOBPIGNG-UHFFFAOYSA-N 342.411 5.084 30 20 EKED C[C@H](c1cccc(Cl)c1)N(C)Cc1cc(Cl)ccc1OCC#N 735308605 KUKGZJGPFOKJHU-CYBMUJFWSA-N 349.261 5.089 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCC(C)(C)C)n2)cc1 739156329 NQANPVBKTPRQFW-OAHLLOKOSA-N 326.465 5.121 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)CC(C)C)n2)cc1 753396882 VXNYSEGDVUEOBW-INIZCTEOSA-N 340.492 5.367 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Cl)cs1 758093008 LVSTWLSEUUGLFE-UHFFFAOYSA-N 344.848 5.254 30 20 EKED N#Cc1ccc(NC(=O)c2sc3ccccc3c2Cl)c(Cl)c1 768895638 BCGWHIPZBSJUFT-UHFFFAOYSA-N 347.226 5.332 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1cc(Cl)ccc1Cl 779713402 SHSCLHDJOYNVTA-VXGBXAGGSA-N 335.234 5.457 30 20 EKED CC(F)(F)c1cccc(NCc2c(F)c(F)c(F)c(F)c2F)c1 780308338 IBABTGKNMVYIQE-UHFFFAOYSA-N 337.238 5.106 30 20 EKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2c(Cl)cccc21 788352740 BTSQXIYICVGOOO-VURMDHGXSA-N 343.757 5.028 30 20 EKED CC1(C)C/C(=C/c2csc(-c3ccccn3)n2)C(=O)c2ccccc21 794967912 JEGFZMXCLLBULC-KAMYIIQDSA-N 346.455 5.153 30 20 EKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)nc1Cl 856778334 NAFBSGIBEDZLNV-LLVKDONJSA-N 347.812 5.124 30 20 EKED C=CCOc1ccc(CNc2cccc3oc(C(F)(F)F)nc23)cc1 864009398 SCYHHBJXTOMZGQ-UHFFFAOYSA-N 348.324 5.024 30 20 EKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 916134298 JSDXZIWQVJSRFZ-ZHACJKMWSA-N 325.820 5.360 30 20 EKED Cc1c(NN=C2CCC[C@@H]2c2ccccc2Cl)cccc1C(=O)O 1776087466 DMIDDFQOMYGKRQ-OAHLLOKOSA-N 342.826 5.082 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc2ccccc12 1776783771 IOALZTSAGWAKAX-LJQANCHMSA-N 327.468 5.133 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)o2)cc1C 118171174 HUFDYXMJADPWHH-CQSZACIVSA-N 335.432 5.078 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2ccc(C)nc12 189871715 GHJGXWPUICQEKA-UHFFFAOYSA-N 344.458 5.647 30 20 EKED CCc1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)C(C)C)cc1 236986831 AZDMOROEWPZMLL-HTAPYJJXSA-N 336.479 5.027 30 20 EKED N#CCCSc1ccccc1NC(=O)/C=C\c1ccc(Cl)s1 255571016 LCTXLEDDDWORJR-CLFYSBASSA-N 348.880 5.059 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 303316499 GXJORCILUVIAHD-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C#N)s1 421106795 KKAMFKDGUJWFRC-UHFFFAOYSA-N 341.480 5.017 30 20 EKED CC(C)Oc1ccc([C@H]2CCC[C@H]2NCC2CCC(C#N)CC2)cc1 442867710 MCKQOOSRZPCAMV-ODMAOCJESA-N 340.511 5.029 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2cccs2)o1)c1nccc2ccccc12 483228241 DAJMBYSTQMPQOX-HNNXBMFYSA-N 344.395 5.046 30 20 EKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCCC(C)(C)C#N)C1 483641249 JAOVBTAEMGZDSD-RHSMWYFYSA-N 338.417 5.418 30 20 EKED Cc1c([C@H](NCc2ccc(C#N)c(F)c2)C(C)C)oc2ccccc12 484085366 SMLGGMNETDHDSK-HXUWFJFHSA-N 336.410 5.239 30 20 EKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccc(C#N)cc1 514494493 QGAUKXSFHSGTCJ-NSHDSACASA-N 348.233 5.090 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 537948150 ZORFTFSJADMDDX-KBXCAEBGSA-N 334.385 5.459 30 20 EKED CCC[C@H](NCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 539261263 MRCMXRGJUIVVSW-INIZCTEOSA-N 326.406 5.466 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccccc1 539356864 NEHDHCROSMBVIC-LJQANCHMSA-N 336.410 5.278 30 20 EKED CC(C)[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 539609105 DXYBOXQCTRQLJL-HXPMCKFVSA-N 332.369 5.023 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)C1(C#N)CCC1 558299775 LGGFQOYJIJKSGE-UHFFFAOYSA-N 328.481 5.052 30 20 EKED N#CCCCCCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 588753258 IDRVIWOUNOUKAV-UHFFFAOYSA-N 344.817 5.559 30 20 EKED CCc1cc(C#N)c(NC(=O)c2oc3ccc(Cl)cc3c2C)s1 604029852 HVWFYOROPVQSLM-UHFFFAOYSA-N 344.823 5.143 30 20 EKED COc1ccc2cc([C@H](C)N[C@@H]3CCc4cc(C#N)ccc43)ccc2c1 618801817 BDDGLSVELKVGCQ-NPMXOYFQSA-N 342.442 5.058 30 20 EKED CC(=NNc1cccc(C(F)(F)F)c1)c1cnc2ccsc2c1 739402756 RGPWYCWMSLVNBM-UHFFFAOYSA-N 335.354 5.151 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1cccc(-c2ccncc2)c1 741472230 GLNATCMOJCILHD-PLNGDYQASA-N 339.316 5.062 30 20 EKED COCc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1 741841662 NUIVPQVWLSZMAQ-IZZDOVSWSA-N 334.387 5.044 30 20 EKED CCCCc1ccc(CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747198444 HKONIMOZKUQPKD-QGZVFWFLSA-N 340.492 5.028 30 20 EKED C=CC[C@H](N[C@@H](CC)c1cccc(Br)c1)c1ccncc1 766022583 XGVJHQDQEGAARV-ROUUACIJSA-N 345.284 5.202 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2cccc(-c3cccs3)c2)cc1 770515001 ZPXZMMFGDZLAOK-OAHLLOKOSA-N 334.444 5.318 30 20 EKED C=CC[C@H](NC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)c1ccncc1 770625314 KBRBSJMBGWOUAA-OALUTQOASA-N 349.478 5.058 30 20 EKED C=CCC[C@H](N[C@@H](C)C[C@H]1CCOC1)c1ccc(C(F)(F)F)cc1 773091680 JTPNGKQXVRLNNW-DAYGRLMNSA-N 341.417 5.117 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1c(F)cccc1Cl 809159904 ZBHWUYPNGPASAQ-VOTSOKGWSA-N 333.771 5.092 30 20 EKED C#CC[C@@H]1CCCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 831046539 BBZPBVBHWHUSJC-QGZVFWFLSA-N 326.484 5.201 30 20 EKED CC(C)(C)c1ccc(C=NOCc2coc(-c3cccs3)n2)cc1 849383808 MRGFTHVONWZLFN-UHFFFAOYSA-N 340.448 5.251 30 20 EKED Cc1cc(/C=C\C(=O)c2ccc(F)cc2F)cc(C)c1OC(F)F 916128328 ZDTGPJNNZMQENN-UTCJRWHESA-N 338.300 5.079 30 20 EKED Cc1cccnc1[C@H](NCc1ccccc1C(C)(C)C#N)C(C)(C)C 934288859 DKVDKIPOHBIXKX-FQEVSTJZSA-N 335.495 5.068 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCC)cc1C 1776784720 MTCYCKMVCVINJN-IBGZPJMESA-N 349.515 5.077 30 20 EKED CCCCCCCCCC(=O)N1CCc2[nH]c3ccccc3c2C1 102998092 HXGIQQRLXLWOOC-UHFFFAOYSA-N 326.484 5.193 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1 189894396 LAZSVANCTHYRLZ-LEWJYISDSA-N 349.474 5.289 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 193002351 UPCBFZVKQNRZTM-KGLIPLIRSA-N 348.368 5.020 30 20 EKED CCc1ccc([C@@H](C)CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303770323 JENQXROOKCRRSV-INIZCTEOSA-N 334.463 5.182 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1Oc1cccc(F)c1 439122987 IIRHJPQICHDORY-UHFFFAOYSA-N 346.361 5.050 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)cc1C 442912308 CZMJLQOQQASECO-CQSZACIVSA-N 335.432 5.078 30 20 EKED N#Cc1ccc(SCc2nc3cc(C(F)(F)F)ccc3o2)cc1 488793380 IHQLOGWQMCABIM-UHFFFAOYSA-N 334.322 5.011 30 20 EKED N#CC1(CCCSCc2cccc(C(F)(F)F)c2)CCOCC1 507509742 LTIVLYZPHQXITD-UHFFFAOYSA-N 343.414 5.039 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@H](C)c1cccc(C#N)c1 508998803 UZYLMUQDLIDIHL-QGZVFWFLSA-N 327.431 5.026 30 20 EKED CC(C)C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 525336392 OHNIUFBREGLHNK-FQEVSTJZSA-N 334.463 5.256 30 20 EKED C=C[C@H](CC(=O)N1CCCC[C@H]1c1ccc(F)cc1)c1ccccc1 533927622 GXDNGGVQOSMORR-UTKZUKDTSA-N 337.438 5.239 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 534751543 GWFBSXKKIZBVTC-NRFANRHFSA-N 347.462 5.359 30 20 EKED CCC(CC)[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccs1 538508419 LNEZUMMLKBKVSB-ORAYPTAESA-N 330.472 5.587 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 539495742 CDWCTOVPDRQJAO-SBUREZEXSA-N 344.433 5.332 30 20 EKED COc1ccc(Cl)cc1[C@H](C)Nc1cccc(OCCCC#N)c1 539627379 UWUNORPDQYLXIT-AWEZNQCLSA-N 344.842 5.204 30 20 EKED Cc1csc(NC(=O)CCCCCO[C@H]2CCC[C@H](C)C2)c1C#N 554774493 NBDDSUJENRKZMH-HOCLYGCPSA-N 348.512 5.022 30 20 EKED C=CCC[C@@H](NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccco1 556867306 GUYKZKIAMMMJNB-GHTZIAJQSA-N 338.495 5.102 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NC1(c2cccc(C#N)c2)CC1 575021112 QFXQZWIWMMWDMU-NRFANRHFSA-N 341.458 5.004 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1cccc(F)c1F 588386956 WKILLAKIPLMWQM-SREVYHEPSA-N 333.384 5.046 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(Sc3ccccc3)c2)CC1 601179296 DREIKJPVVMXAHP-UHFFFAOYSA-N 338.476 5.268 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1c(F)cccc1Cl 614178710 AVWBGXYYNJMQGE-ZDUSSCGKSA-N 330.834 5.131 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 620567951 ZADWVMSUTPEEHE-CQSZACIVSA-N 345.826 5.052 30 20 EKED N#Cc1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1Cl 726433450 IRBOYMOYUZZEBX-UHFFFAOYSA-N 337.835 5.174 30 20 EKED O=C1/C(=C/c2ccc3ncccc3c2)Cc2c1ccc(Cl)c2Cl 729150815 MWIVDRGQYMSRDT-UKTHLTGXSA-N 340.209 5.364 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C/c3cccs3)c2)cc1 729375841 UZCOSHMDQCGVQA-ZHACJKMWSA-N 346.411 5.064 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C/C1CCCCC1 735440107 DFYVHKAJYBMQRW-RUMSDORHSA-N 328.481 5.013 30 20 EKED Cc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1[N+](=O)[O-] 744868998 PKSGBTRVPNNZIN-SNAWJCMRSA-N 342.203 5.168 30 20 EKED COc1cc(/C=C\C(=O)c2oc3ccccc3c2C)cc(Cl)c1O 747144308 REWIPEJXDQAIBU-FPLPWBNLSA-N 342.778 5.005 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 755612807 XIAPDAXYMQFTRT-HOCLYGCPSA-N 340.492 5.449 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1nc(-c2ccccc2)cs1 755817473 ZBIIYXQCPFIINL-UHFFFAOYSA-N 348.349 5.242 30 20 EKED CC(C)(C#N)CC(=O)O[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 786456472 ZLEGMVIVZNJMLZ-GOSISDBHSA-N 345.801 5.052 30 20 EKED CC(=NNc1ncccc1F)c1ccc(Cl)c(Cl)c1Cl 794990526 OYJPWYXSKZONOL-UHFFFAOYSA-N 332.593 5.017 30 20 EKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Cl)c1 797568982 ZEZYNVBQLMCIJN-BXUZGUMPSA-N 346.883 5.074 30 20 EKED Cc1cccnc1[C@@H]1CCCC(=NNc2nccc3sccc23)C1 799108761 IVZLJVBADKREQK-CQSZACIVSA-N 336.464 5.125 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc(C3CC3)c2)c1 815593761 WHUZYTMBHYJNFS-HRAATJIYSA-N 334.463 5.096 30 20 EKED CCCC[C@](C)(F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 850770896 DKXYXLCOEVABIR-BZNIZROVSA-N 338.835 5.044 30 20 EKED C=CCCC[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccccc1 883209099 VOSFELLKQWTHFP-QATBIIFWSA-N 341.520 5.172 30 20 EKED N#Cc1ccccc1NC(=S)Nc1ccc2c(c1)oc1ccccc12 915999475 SJWFKCIKVFNQMJ-UHFFFAOYSA-N 343.411 5.267 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)n1 80458010 UDVSUHMNVZEJGE-GFCCVEGCSA-N 344.823 5.156 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 154186011 CHJMRZWZYFKVJG-UHFFFAOYSA-N 341.455 5.169 30 20 EKED OC1=Nc2ccccc2[C@@H]1CC/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329024353 UUGFBEXVEJFYKF-ONIAQPFYSA-N 340.467 5.325 30 20 EKED COc1ccc2c(c1)[C@@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340451754 OVIYIDKYQYQJCR-VXKWHMMOSA-N 334.463 5.097 30 20 EKED N#CCCCCN(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 347724863 WAFCYFQHGRQVSB-UHFFFAOYSA-N 348.277 5.084 30 20 EKED C[C@H](SCc1ncc(-c2ccccc2F)o1)c1ccc(C#N)cc1 437277294 QBKKFHDGGIBUGF-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED CCCCSc1nnc(S[C@@H](C)c2cccc(C#N)c2)s1 442906257 XCOZQRDHHRFECO-NSHDSACASA-N 335.523 5.155 30 20 EKED C=CCn1c(SCCCCC(F)(F)F)nnc1-c1cccs1 443522134 OCZYAFNTKOYENB-UHFFFAOYSA-N 347.431 5.017 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C1=CCC(C)(C)CC1 455518312 SYZMOFITFSOHSV-CQSZACIVSA-N 328.481 5.013 30 20 EKED C=CCCCCCS[C@H](C)C(=O)Nc1ccccc1C(F)(F)F 485575880 HGEQRFZVEVLKNZ-CYBMUJFWSA-N 345.430 5.512 30 20 EKED C=CCC[C@H](N[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 526982211 WFQGAVJMNIBYPP-KDOFPFPSSA-N 341.417 5.117 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc2cc(Cl)ccc2o1 551570314 MQUZLWGUCASESO-ZDUSSCGKSA-N 336.822 5.298 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(F)c2ccccc12 559837844 SCWAWMAUVUMOQA-UONOGXRCSA-N 336.385 5.401 30 20 EKED CC(C)(C1=CCCCC1)c1noc(CSc2ccc(C#N)cc2)n1 574632573 SMDFUIONHVHJJC-UHFFFAOYSA-N 339.464 5.012 30 20 EKED CC1=C(C)C[C@@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 581192296 KUTOSUSOSJBLTC-HOTGVXAUSA-N 328.481 5.156 30 20 EKED N#C[C@@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccccn1 642280772 KVWMTIFWDYQLJD-SECBINFHSA-N 347.226 5.093 30 20 EKED Cc1cc(C(=O)OCCCCC#N)sc1-c1cccc(Cl)c1 726655379 PAQKBWYVAOIIGJ-UHFFFAOYSA-N 333.840 5.228 30 20 EKED O=C(/C=C/c1cccc2ccccc12)c1c(Cl)nc2sccn12 741842745 BLVBQQBZMRMNSP-CMDGGOBGSA-N 338.819 5.099 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1c[nH]c2ccccc12 751513201 FSAJQPNCGYPSSK-BQYQJAHWSA-N 336.441 5.249 30 20 EKED C#Cc1cccc(NC(=S)Nc2cc(C(F)F)ccc2Cl)c1 767708280 PVKMOSLXIDDVNE-UHFFFAOYSA-N 336.794 5.068 30 20 EKED CCC(C)(CC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 767961702 ZEWMJWKOECSARP-CQSZACIVSA-N 346.883 5.466 30 20 EKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 776086432 GUNCBXLXKPPQKB-GXTWGEPZSA-N 332.444 5.218 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nc2ccccc2s1 796752804 JHFHWNUCUTZCBB-CAOSSQGBSA-N 338.476 5.079 30 20 EKED O=C(/C=C/c1cn(C2CCCC2)nc1-c1ccccn1)c1ccsc1 840715402 BBBZGWATGLQENB-CMDGGOBGSA-N 349.459 5.018 30 20 EKED N#CCCCOc1cccc(NCc2ccccc2-c2ccccc2)c1 917396807 IZKRQXIPTJGNHL-UHFFFAOYSA-N 342.442 5.648 30 20 EKED C=CCC1(C(=O)O)CCN(CCCCCCCCCC2CC2)CC1 1776160022 RSFSGPHBMSIDAB-UHFFFAOYSA-N 335.532 5.260 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 90665780 YWCDHEWNWSRGMW-WMLDXEAASA-N 341.524 5.445 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3cccc(C#N)c3)s2)cc1 107718483 UDCVVOCQEUIBLI-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccccc1CCC(F)(F)F 179679267 QLYYMARSCMATJM-CYBMUJFWSA-N 328.378 5.048 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)c1ccncc1 191431941 INFCBXAVRFMJKA-IBGZPJMESA-N 337.467 5.206 30 20 EKED Cc1ccccc1/N=C1\N=C(O)/C(=C/c2cc(F)ccc2F)S1 206954843 USEJVYDHBWGILN-DHDCSXOGSA-N 330.359 5.005 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)ccc2SC1 329024987 VCCFBYJSPQFLHV-AEGPPILISA-N 344.480 5.575 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 432854938 SZMXNBGVKVIFLQ-KRWDZBQOSA-N 343.377 5.181 30 20 EKED CC(C)(C#N)CCCCOc1ccccc1C(=O)Nc1ccccc1 436135056 FKLXJKVLWWJJDJ-UHFFFAOYSA-N 336.435 5.038 30 20 EKED C=CCN(Cc1cccs1)C(=O)C1CCC(c2ccccc2)CC1 463333078 CPOUMGAMXPGZFX-UHFFFAOYSA-N 339.504 5.237 30 20 EKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(C)sc1C 473766984 ROLMXRIXJZTZCN-UHFFFAOYSA-N 349.521 5.018 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)S(=O)(=O)CCCCC(C)(C)C#N 488999668 NYEIVCZNLUCACC-INIZCTEOSA-N 349.540 5.180 30 20 EKED CCCCOc1ccc(C(=O)Nc2scc(C)c2C#N)c(Cl)c1 521506327 RFOQXISOOKLKAX-UHFFFAOYSA-N 348.855 5.013 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccc3sccc3c2)cc1 572207161 UWQDIEMKTIALCI-UHFFFAOYSA-N 349.459 5.024 30 20 EKED CSCc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 589316940 NVALCYHAZVDESX-UHFFFAOYSA-N 336.382 5.052 30 20 EKED C=C(C)COc1cccc(NC(=O)N(Cc2cccs2)C(C)C)c1 589741638 MIAQMPCIAUYQRY-UHFFFAOYSA-N 344.480 5.146 30 20 EKED CC(C)(C)OCc1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1 594931980 KQECMKODAMCVIR-UHFFFAOYSA-N 334.463 5.169 30 20 EKED Cc1cc(C#N)ccc1CSCc1csc(-c2ccoc2)n1 614394785 SWOFNFJQJJUHFK-UHFFFAOYSA-N 326.446 5.017 30 20 EKED CC(C)Oc1ccc(CON=Cc2ccccc2C(F)(F)F)cc1 726595223 ZYBRYMIEAKFWIV-UHFFFAOYSA-N 337.341 5.043 30 20 EKED C=CCN(C(=O)Nc1cc(F)ccc1Oc1ccccc1)C(C)C 727936832 LSWKZUXSGJHWHE-UHFFFAOYSA-N 328.387 5.046 30 20 EKED C#Cc1cccc(N(C(=O)c2cccc(Cl)c2Cl)C(C)C)c1 728248301 QDPSCVKBXHZPNU-UHFFFAOYSA-N 332.230 5.030 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1 728694920 NEVKGCFTPWAVDW-REPPVQDKSA-N 346.213 5.180 30 20 EKED CC1=C(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 747205349 SYXMVYCKXDHXOG-HNNXBMFYSA-N 342.851 5.140 30 20 EKED CCCC(=CC(=O)Nc1ccccc1SC[C@H](C)C#N)CCC 770725467 CEMBRQHHXQJDHZ-OAHLLOKOSA-N 330.497 5.403 30 20 EKED C=CCC[C@@H](Nc1ccc(N2CCSCC2)c(C)c1)c1ccco1 796915374 CEKSBZSVIVYVIQ-GOSISDBHSA-N 342.508 5.261 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(cc1O)CCCC2 815636352 TTZMKNSKYMVHDD-VGSWGCGISA-N 348.490 5.357 30 20 EKED N#Cc1cccc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)c1 834709724 MEMHQSRNLJTOLH-DHZHZOJOSA-N 349.336 5.209 30 20 EKED CC(C)(C)C[C@@H](NC(=S)Nc1ccccc1C#N)c1ccccc1 916001410 XWPKMUGGONGPCN-GOSISDBHSA-N 337.492 5.022 30 20 EKED O=C(/C=C\c1ccsc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605601 XMYDURBWEOYKQU-WAYWQWQTSA-N 341.413 5.281 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C(C)(C)c1ccccc1C 58634872 ORHIAZDOKOPINC-UHFFFAOYSA-N 347.911 5.202 30 20 EKED CCN(Cc1ncc(-c2ccccc2C)o1)[C@@H](C)c1ccc(C#N)cc1 75645770 IBEHXJVZMGJJEY-KRWDZBQOSA-N 345.446 5.105 30 20 EKED Cc1ccccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 113570610 BZEOFKZBTFOQRX-CQSZACIVSA-N 325.437 5.033 30 20 EKED CC1(C)C(O)=Nc2ccc(/C(O)=N/[C@@H]3CCCc4sccc43)cc21 329795727 DCOPIZOTKTTXLG-CQSZACIVSA-N 340.448 5.010 30 20 EKED CSc1nc(C(C)(C)C)nc(C)c1C(O)=Nc1ccc(C)cc1C 330960599 BGDYQBWHHAMEKH-UHFFFAOYSA-N 343.496 5.058 30 20 EKED N#CCCCOc1cccc(NCc2cccc(-c3ccncc3)c2)c1 355313831 OAKAPOPTFNBMST-UHFFFAOYSA-N 343.430 5.043 30 20 EKED Cc1nc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 367805152 VYVXBIXQGVAYLI-HUUCEWRRSA-N 347.487 5.402 30 20 EKED C=CCN(CCC#N)C(=O)Nc1ccccc1Oc1c(C)cccc1C 432755755 BEXGXYVQLSSQJF-UHFFFAOYSA-N 349.434 5.029 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 438655862 LQBLFFWBVKWHET-UHFFFAOYSA-N 331.485 5.024 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1nc(-c2cccs2)no1 443156965 PVZUANCSQDRXQW-NEPJUHHUSA-N 341.461 5.225 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 466425846 PRPWFEXWHQWPKW-CQSZACIVSA-N 339.401 5.014 30 20 EKED CCCc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)sc1C 474424164 FWFFPVBCBIBDKX-CYBMUJFWSA-N 332.494 5.079 30 20 EKED C=CCCC1(C(=O)Nc2cccc(CSc3ccccn3)c2)CC1 475445595 QHYFQTLTUOHTSA-UHFFFAOYSA-N 338.476 5.059 30 20 EKED C=CCSc1ccccc1C(=O)N[C@H](C)c1cc(C)sc1C 485455456 LLQUXHSAHXAWLX-CYBMUJFWSA-N 331.506 5.134 30 20 EKED CCCc1ccc([C@@H](Nc2ncccc2C#N)c2cccs2)cc1 501942165 BMLRIQVBSDMFGC-LJQANCHMSA-N 333.460 5.169 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Cl)s1 511134757 LLOIUOMBZIJKSV-UHFFFAOYSA-N 344.848 5.254 30 20 EKED C[C@@H](SCc1ccc(C#N)cc1F)c1ccc(OC(F)F)cc1 524238578 RUBWZBALDHDHSO-LLVKDONJSA-N 337.366 5.293 30 20 EKED CC(C)[C@H](NCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 565105759 XUPFIZHMWCRPHF-INIZCTEOSA-N 326.406 5.322 30 20 EKED CCCOc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 582560554 MHEDHSWRLICLNC-AVRDEDQJSA-N 336.479 5.561 30 20 EKED CCCCc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 682993843 BOXDSUACYILUTF-FQEVSTJZSA-N 328.415 5.067 30 20 EKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 744119478 RXGZNWVBMQPUGS-GXTWGEPZSA-N 332.444 5.218 30 20 EKED N#Cc1ccc(F)c(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774465332 VTQFCHLYZVNECX-SFHVURJKSA-N 349.236 5.245 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792094771 GQIFIDOISAKPGO-KKSFZXQISA-N 342.442 5.167 30 20 EKED C=CC[C@H](OC(=O)[C@H]1C[C@@H]1C(F)F)c1ccc(Cl)c(Cl)c1 800971422 LRQHNMBJDWCMRP-KWBADKCTSA-N 335.177 5.055 30 20 EKED Cc1cc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)c(C)s1 915984799 OGDFOWBUYZZDII-VMPITWQZSA-N 349.455 5.235 30 20 EKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)Nc1ccc(CCC#N)cc1 932563060 XKIQAAKOPZVEJV-HXUWFJFHSA-N 347.462 5.129 30 20 EKED CCSc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776950892 HAKMEIOIFVIYKU-YFHOEESVSA-N 346.835 5.046 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc3cc(Cl)ccc3o2)cc1 25438983 HRWLBKODPPGBLW-UHFFFAOYSA-N 338.794 5.140 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(C2CCCC2)n1 63994606 QSMYCDRMWDTAOC-UHFFFAOYSA-N 339.508 5.085 30 20 EKED C=C(C)CN(CC)[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 152517773 ZADBZRBHKYXYLE-LLVKDONJSA-N 340.254 5.002 30 20 EKED C[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)C(O)=Nc1ccccc1 329193826 SQCOOUFDTGSNCN-UOVPBQLFSA-N 328.456 5.226 30 20 EKED CCCN(C(=O)CC(C)(C)C#N)[C@H](C)c1ccc(Cl)c(Cl)c1 447347111 IZEWOPMLVMEWPI-GFCCVEGCSA-N 341.282 5.233 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCc2ccccc21 475553972 GYKZUSLBNYOAES-OAQYLSRUSA-N 348.490 5.690 30 20 EKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1 483194843 HTDDGXHCSAHRKV-LJQANCHMSA-N 346.455 5.225 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 505029096 LFGOXYRBHJENKO-QFBILLFUSA-N 338.451 5.403 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 516984701 QTHRXQQXUCWSQL-KXBFYZLASA-N 344.405 5.374 30 20 EKED CC(C)(C)Oc1ccccc1NCc1cccc(OCCCC#N)c1 533217027 VYUMBXBFQGACBY-UHFFFAOYSA-N 338.451 5.159 30 20 EKED CC(C)c1cccc(C(C)C)c1NCCCC1(C#N)CCOCC1 537509923 VYVNKCUYIHNLQT-UHFFFAOYSA-N 328.500 5.446 30 20 EKED C[C@@H](NC[C@@H](C#N)CCC#N)c1ccccc1-c1ccc(Cl)cc1 538187145 VBLVVXYQVLPPJB-HZPDHXFCSA-N 337.854 5.101 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)cc1 538780711 MZHAYKFEWONGLN-INIZCTEOSA-N 330.406 5.215 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCCCC(C)(C)C#N)cc1 539359666 YIGFZBWHIGGFNE-KRWDZBQOSA-N 336.479 5.343 30 20 EKED CC(C)[C@@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 556205733 MGWJPAWDWVTICG-ZRBLBEILSA-N 332.491 5.896 30 20 EKED N#CCCCOc1cccc(CN2CC3(CCC3)[C@@H]2c2ccccc2)c1 560569574 GWKCXMQXDFDSHE-QFIPXVFZSA-N 346.474 5.096 30 20 EKED C=CCOc1ccc(CNc2cccc(OC(F)F)c2)cc1Cl 604064625 ZINHJPDCBHPFMA-UHFFFAOYSA-N 339.769 5.118 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC)c1ccc(Cl)cc1 612299669 QNOGVQDYOIKOBK-IBGZPJMESA-N 342.870 5.189 30 20 EKED CCOc1ccc([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cc1 619508237 YNQKZYNDWUUTOR-OPAMFIHVSA-N 334.463 5.075 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619755752 RFKAOWDCVLHANN-NSHDSACASA-N 338.760 5.081 30 20 EKED Fc1cccc(CNC(CCC(F)(F)F)CCC(F)(F)F)c1F 657707641 ZMJHSXOUOXAXCU-UHFFFAOYSA-N 349.265 5.108 30 20 EKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 736348165 OAUQUNMKECECOJ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@@H]1c1cc(C)on1 737790413 NCIWQJFFKXDIFC-KWRJMZDGSA-N 332.488 5.343 30 20 EKED O=C(/C=C\c1cc(Cl)ccc1OC1CCCC1)c1cncc(F)c1 742433804 AEJGXBKZEKVLCN-ALCCZGGFSA-N 345.801 5.092 30 20 EKED Cc1ccc(Oc2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2)nc1 743476580 LMYUNGTUHQVKRY-INIZCTEOSA-N 329.403 5.227 30 20 EKED CC(C)(C#N)CCCCSc1nc2ccc([N+](=O)[O-])cc2s1 767034281 UFSLZOAOIYIKCC-UHFFFAOYSA-N 335.454 5.017 30 20 EKED C[C@@H](CCC1CC1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 769223606 SRHJNXTYSQRVFY-KKSFZXQISA-N 347.462 5.042 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)s1 802833577 OOMMFVDNYKFMFS-ZJIFWQFVSA-N 344.524 5.223 30 20 EKED CC/C(=C/C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 817318638 FKPUXNDNKQCXAG-OGLOHFSISA-N 332.447 5.031 30 20 EKED C[C@@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)c(F)c1 864023177 OURBTUUSTGGQFK-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C=CCN(C(=O)CCCCCC)c1nc(-c2ccccc2)cs1 918552289 MKDAWQNRJRSXIU-UHFFFAOYSA-N 328.481 5.300 30 20 EKED CCCCc1nc(CON=Cc2cccc(Cl)c2Cl)cs1 920399279 PLPRGVBTDVKMLR-UHFFFAOYSA-N 343.279 5.343 30 20 EKED Cc1cc(C)cc(-c2ccc(C=NNc3ccccc3C(=O)O)cc2)c1 1776030179 NRBWJXZJIOBUSI-UHFFFAOYSA-N 344.414 5.115 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(-c2ccncc2)c1 90665484 XQCUSJLZYNRKKD-JPYJTQIMSA-N 341.458 5.444 30 20 EKED C[C@@H](Sc1nnc(-c2ccc(Cl)s2)o1)c1ccc(C#N)cc1 127069633 LEXGTSQWZVHKPG-SECBINFHSA-N 347.852 5.176 30 20 EKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 131163417 GZZDQJYAECZMAX-INDWDQIESA-N 344.867 5.200 30 20 EKED C[C@H](Sc1nnc(-c2ccc(Cl)s2)o1)c1cccc(C#N)c1 189849971 HTVXBENPFMXIQR-VIFPVBQESA-N 347.852 5.176 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(C)o2)cc1OCc1ccccc1 210438442 RETHSTKDJPAHSD-LUAWRHEFSA-N 348.398 5.072 30 20 EKED CC(C)(C)Cc1csc(N=C(O)[C@@H]2CCC(=O)c3ccccc32)n1 328809562 MCYBBMFRGOIJOI-OAHLLOKOSA-N 342.464 5.080 30 20 EKED N#CCCC[C@H](NCc1c(Cl)ccc2cccnc12)c1ccccc1 353918460 YFTVURVHGVWNQR-FQEVSTJZSA-N 349.865 5.413 30 20 EKED N#Cc1ccc(SCc2ncc(-c3cccc(Cl)c3)o2)cc1 509664592 BEAJLTUMJVZBFP-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1 591698992 OVDWLUKBDSSVKL-OAQYLSRUSA-N 325.427 5.022 30 20 EKED CSc1cccc(CNc2ccccc2SC[C@H](C)C#N)c1 594704314 AFCUEMDCZRHASQ-CQSZACIVSA-N 328.506 5.272 30 20 EKED Cc1cc(C#N)ccc1CN[C@H](Cc1ccccc1)c1cccs1 614405714 FJUXZONWPJAVES-HXUWFJFHSA-N 332.472 5.002 30 20 EKED N#Cc1c(NC(=O)c2ccoc2C2CC2)sc2c1CCCCCC2 619588159 BPBULKLTKIJQTE-UHFFFAOYSA-N 340.448 5.001 30 20 EKED CC[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)C 729316062 HGVQGLIBEHGQDL-DYESRHJHSA-N 334.463 5.353 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2cc(Cl)sc2Cl)s1 736433159 MFFOXILJZUIVAM-SNAWJCMRSA-N 346.304 5.705 30 20 EKED CC(C)CCC[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1 772957341 DUOGDVDEGSLNKO-JOCHJYFZSA-N 336.479 5.246 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc(-c2ccccc2)cc1F 775656690 ZHBWILKMDMGSDX-UHFFFAOYSA-N 341.426 5.194 30 20 EKED CCCC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 800387065 PWPVGLJLLXQWDV-HOCLYGCPSA-N 326.465 5.121 30 20 EKED CCCCCCCCN1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 805782230 WOCJDFKGJVZZPS-AWEZNQCLSA-N 347.425 5.062 30 20 EKED CC(=NNc1c(C)cccc1C(C)C)c1c(C)nn(C(C)C)c1C 812232831 MRYZVHIXBIGSCY-UHFFFAOYSA-N 326.488 5.349 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCC2CCCC2)cc1 915087790 XPNMGVKSPFIMBK-OAQYLSRUSA-N 332.447 5.251 30 20 EKED O=C(/C=C\c1ccc(N2CCCCC2)cc1)c1ccccc1Cl 916135196 IBIQDXHYNATVKM-RAXLEYEMSA-N 325.839 5.226 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccccc3F)cc2)cc1 1776131344 OYJUEDSEMCSNJR-AUWJEWJLSA-N 346.357 5.087 30 20 EKED O=C(/C=C/c1ccc(C(=O)O)s1)c1ccc(-c2cccs2)cc1 1777569737 GZRHLUBWCZQMEF-VQHVLOKHSA-N 340.425 5.071 30 20 EKED N#Cc1cccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)c1 14673752 POUKVAHKQVVXFM-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 41537675 NGXUOHCXMPKDOI-CRAIPNDOSA-N 346.455 5.180 30 20 EKED C=CCN(C(=O)c1ccc(SC(F)(F)F)cc1)c1ccccc1 58505114 UEOKZWXXFLVQPW-UHFFFAOYSA-N 337.366 5.131 30 20 EKED C=C(C)[C@@H](NCc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1 187785008 CNTYFBTYXMUGTN-MRXNPFEDSA-N 343.204 5.074 30 20 EKED C[C@H](SCc1nnc(-c2ccccc2)s1)c1cccc(C#N)c1 190827283 DNSKJRRAUWORKR-ZDUSSCGKSA-N 337.473 5.071 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C1CCC1 191427309 CSRIFMLAYRIIMN-LJQANCHMSA-N 326.484 5.335 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc3ccccc3c2)cc1 207991961 FVHKHUCKPYYEHB-LPDYGMJQSA-N 327.383 5.027 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2F)s1)c1cccc(C#N)c1 237431893 QJRHFZKMXZQGKW-CQSZACIVSA-N 336.435 5.277 30 20 EKED C/N=C(/O)c1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1Cl 328989930 HYQBWNHVTQEZMN-AEGPPILISA-N 348.874 5.469 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc2ccccc2c1)c1ccccc1 352216395 HNVSIHBRGMLBGB-OAQYLSRUSA-N 328.415 5.005 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cccc(N2CCCC2=O)c1)c1ccccc1 358325564 FIXWYWBUPYCFAR-PGRDOPGGSA-N 348.490 5.172 30 20 EKED Cc1cnc([C@H](C)SCc2ccc(-c3ccccc3C#N)cc2)cn1 427681388 XEMGGSGVSMRIHM-INIZCTEOSA-N 345.471 5.318 30 20 EKED C[C@H](c1ccc(C#N)cc1)N1CCC[C@H]1c1nc2ccccc2s1 433952853 HZZCZPLLUSFPOT-KDOFPFPSSA-N 333.460 5.066 30 20 EKED C=CC[C@H](CC)NC(=O)c1c(F)cccc1Sc1ccccc1 466541482 JUWOSQPSIFXIHP-AWEZNQCLSA-N 329.440 5.061 30 20 EKED Cc1cc(Cl)c(NC(=O)C[C@H](CC#N)c2ccccc2)cc1Cl 483807115 MEFCGRVDRAWCFA-AWEZNQCLSA-N 347.245 5.328 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccccc1 487182702 CHWKGBCBPBRBQP-WJMWBRGCSA-N 338.495 5.144 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520923525 QFSXMFMVLSWUEA-HNNXBMFYSA-N 338.476 5.457 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(-c2csc(C)n2)cc1 523560103 JTGGUUVUPHWDFN-UHFFFAOYSA-N 343.496 5.329 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCc2ccccc2C#N)cc1 539362150 MVMKBVMRNWHEMY-KRWDZBQOSA-N 342.442 5.085 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540127093 BXWZMTVDDVPLON-MAUKXSAKSA-N 349.434 5.145 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)o1 540807291 XCBYLWHALGTTMJ-QHCPKHFHSA-N 338.410 5.184 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)CCCCC#N)c1 594014746 ZPISBKTZGZXXSN-UHFFFAOYSA-N 326.827 5.338 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1cc(C#N)ccc1F 609235587 VWBMRLPHQKCDPV-UHFFFAOYSA-N 344.436 5.156 30 20 EKED C[C@@H]1CCC[C@@H](C)N(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 610184753 HVEMZRAHUZAXCY-IAGOWNOFSA-N 348.446 5.001 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1cc2c(ccc3ccccc32)o1 611438481 VNONYAMDRDPLQM-AWEZNQCLSA-N 344.389 5.448 30 20 EKED O=C(/C=C\c1ccc(Cl)c(F)c1)c1ccc(-c2ccncc2)cc1 745990644 VXIMVTVJWVJMBG-WAPJZHGLSA-N 337.781 5.437 30 20 EKED C[C@H](ON=Cc1ccccc1C(F)(F)F)c1ncc(C(C)(C)C)o1 756848055 FJQXUUJUEIXLGT-NSHDSACASA-N 340.345 5.103 30 20 EKED Cc1nc(NN=C[C@@H](C)CCC#N)c2cc(-c3ccccc3)sc2n1 765994387 FIIQLHUPJLJRMQ-ZDUSSCGKSA-N 349.463 5.004 30 20 EKED C#CC[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 773117336 VJKXBJYYAQRRLA-ZWKOTPCHSA-N 327.880 5.231 30 20 EKED C#CC[C@H](N[C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccccc1 774266876 RZEHIYNMBHJGDN-PXAZEXFGSA-N 334.246 5.114 30 20 EKED C[C@H](C#N)OCCSCc1cccc(SCc2ccccc2)c1 808368150 URCNOILKOHUTAA-MRXNPFEDSA-N 343.517 5.141 30 20 EKED Cc1cc(Cl)cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)c1O 808709628 YHIGRFMGCCIVMB-KDOFPFPSSA-N 328.843 5.050 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccs1 810194971 RMKVEYPSZZFPAZ-CLFYSBASSA-N 341.413 5.281 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cscc1C#N 839273098 XWBNMYRIIMQKIM-UHFFFAOYSA-N 330.478 5.071 30 20 EKED O=C(/C=C\c1cccs1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605626 YKPAGHQUDLSJLQ-FPLPWBNLSA-N 341.413 5.281 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)c1cc2c(ccc3ccccc32)o1 1776012041 VXVMMUKATGAMSH-UHFFFAOYSA-N 344.370 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cc(F)ccc1F 189905852 VZJWWBADABPJEG-UHFFFAOYSA-N 343.417 5.388 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 410367307 SXHYWJJTTFCFKM-FQEVSTJZSA-N 337.463 5.300 30 20 EKED Cc1c(CNCc2ccc(C#N)s2)sc2ccc(Cl)cc12 441338772 LKLRYEMKCOBUOF-UHFFFAOYSA-N 332.881 5.086 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCC[C@H]1OCC 455238045 BGFXNYZDTVEKSC-RTBURBONSA-N 344.499 5.008 30 20 EKED CC(C)C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cccs1 475113041 FOXLTTTYPGPLOK-ZWKOTPCHSA-N 340.492 5.039 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC(F)(F)F 475554688 JEIPCKSCHBGNNR-LBPRGKRZSA-N 328.378 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@@H]1c1ccccc1 475565105 WAQACGPZYRULLL-WOJBJXKFSA-N 334.463 5.216 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 480669534 BVEZLXPUWTZLBK-ORAYPTAESA-N 346.377 5.149 30 20 EKED C[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 480803136 HOLWUYKPTJEKGF-MRXNPFEDSA-N 349.434 5.004 30 20 EKED C[C@@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1cc2ccccc2o1 488140899 FUKCVEDPEAHGRL-LLVKDONJSA-N 349.340 5.304 30 20 EKED CC[C@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1OC(F)F 498812701 FTGZRIBZKVJEOO-AWEZNQCLSA-N 338.304 5.001 30 20 EKED C=C(C)CCc1noc(-c2ccc(Oc3ccncc3)c(Cl)c2)n1 508599312 LIPIHWNKWPSHKE-UHFFFAOYSA-N 341.798 5.086 30 20 EKED N#Cc1cnc(Oc2cc(C(F)(F)F)ccc2Cl)c(Cl)c1 513640723 REDVZCOHGDKSGX-UHFFFAOYSA-N 333.096 5.071 30 20 EKED Cc1ccccc1-c1cnc(CSc2cccc(Cl)c2C#N)o1 542102097 HJEUKEUOTHGVSJ-UHFFFAOYSA-N 340.835 5.467 30 20 EKED C=CCC[C@@H](NCc1cc(Cl)c(OCC)c(OC)c1)c1ccco1 556865129 DXHQRJKLDZYHAL-MRXNPFEDSA-N 349.858 5.137 30 20 EKED N#CCCCCC(=O)Nc1c(Cl)cc(C(F)(F)F)cc1Cl 594043452 NNCMNYVNEFDDJV-UHFFFAOYSA-N 339.144 5.035 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(Sc2ccccc2)c1 605928122 WFKRJLAEGWGWPL-UHFFFAOYSA-N 326.465 5.268 30 20 EKED CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 610142571 APKCOOFIOAQWAH-OAGGEKHMSA-N 345.512 5.171 30 20 EKED COc1ccc2cc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)ccc2c1 610343452 HOJHMPGVYRJPIM-HOTGVXAUSA-N 330.431 5.132 30 20 EKED COc1cc(-c2ccccc2)ccc1CN[C@H](C)c1cccc(C#N)c1 611585614 YHYBCXHRSOHKMO-QGZVFWFLSA-N 342.442 5.085 30 20 EKED C=CC[C@@H]1CC[C@H](NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C1 651672563 DUFQNKGQZKNEQY-VOAKCMCISA-N 343.355 5.230 30 20 EKED CC(C)c1cnc(CSc2nc(-c3ccccc3)ccc2C#N)o1 733904092 VDKACXYJHNLHEU-UHFFFAOYSA-N 335.432 5.024 30 20 EKED CC1(C)CCC[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 750588540 PLHXLFUVDRUTMA-VQTJNVASSA-N 347.462 5.042 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(C)c(C)c1O)c1ccc(F)c(F)c1 775556750 ACKNVTOLCVVZSS-IFXJQAMLSA-N 331.406 5.255 30 20 EKED N#Cc1cc(NC(=O)c2sc3ccccc3c2Cl)ccc1Cl 787094785 ZGAXZJJMZSLCBJ-UHFFFAOYSA-N 347.226 5.332 30 20 EKED FC(F)c1cccc(CON=Cc2ccccc2C(F)(F)F)c1 794713438 GIDYEZYXNOIAAK-UHFFFAOYSA-N 329.268 5.194 30 20 EKED CC[C@@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 796902986 HXFRKLQNEBTRNW-VXGBXAGGSA-N 348.418 5.091 30 20 EKED COc1ccc(C(=O)/C=C\c2ccccc2OC2CCCC2)c(F)c1 920064856 LUFGVCZTKDKZOT-RAXLEYEMSA-N 340.394 5.052 30 20 EKED O=C(/C=C\c1ccc(Oc2cc(F)cc(F)c2)cc1)c1cccnc1 921260968 JAVOAAOPIFLPMT-YVMONPNESA-N 337.325 5.048 30 20 EKED CCCCCCCCC[C@@H](C)CC=NNc1ccc(C(=O)O)nc1 1776070974 UPPDKXBDLYDFJS-MRXNPFEDSA-N 333.476 5.344 30 20 EKED Cc1nc(C)c(C#N)c(SCc2sc3ccccc3c2Cl)n1 29675151 IZXVANHRUKMFGX-UHFFFAOYSA-N 345.880 5.126 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)C1CCCCCC1 171743119 MIMRLBIUKBFFNV-OAHLLOKOSA-N 345.512 5.125 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccc(F)c(F)c1 186449933 MWEOEHREDZLURA-YVEFUNNKSA-N 336.451 5.513 30 20 EKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@@H]3CCC[C@H]3c3ccccc3)ccc21 328882567 LUOQCFXPMIPAGD-FUHWJXTLSA-N 348.446 5.207 30 20 EKED Cc1ccccc1-c1nnc(SCCC2(C#N)CCCCC2)o1 412982971 LTBHTQRYDFRATP-UHFFFAOYSA-N 327.453 5.001 30 20 EKED C[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1F 426288406 JEKMYPYXEVCQQW-BONVTDFDSA-N 334.847 5.140 30 20 EKED C=CCSc1ccccc1C(=O)N1CCC(c2ccsc2)CC1 485709610 KVCJWGUASJUWHT-UHFFFAOYSA-N 343.517 5.046 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 510810003 CHASSPCOHKHQKM-HRAATJIYSA-N 336.435 5.013 30 20 EKED CC(C)CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1CC1 518257069 ZPQRWIOOUPZDDR-UHFFFAOYSA-N 349.434 5.003 30 20 EKED COc1ccc(-c2ccc(CN[C@@H](C)c3cccc(C#N)c3)cc2)cc1 537305790 LFCHLKUCJZPJIT-KRWDZBQOSA-N 342.442 5.085 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 537408068 UKAPZCXLCACXST-LSDHHAIUSA-N 342.483 5.610 30 20 EKED Cc1cc(Cl)ccc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 553049648 FRSMSUWGEVHZEM-UHFFFAOYSA-N 332.856 5.131 30 20 EKED C=C(C)COc1cccc(NC(=O)c2cc(SC)ccc2Cl)c1 589382136 KTXWBFLHBXAZBH-UHFFFAOYSA-N 347.867 5.269 30 20 EKED Cc1ccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603968579 CUXRHLCMMXPKHJ-UHFFFAOYSA-N 346.455 5.167 30 20 EKED CCOc1ccccc1[C@H](CC)NCc1ccc(C(C)(C)C#N)cc1 614179052 AHCVXVHTKCBAET-FQEVSTJZSA-N 336.479 5.127 30 20 EKED C=CCC[C@@H](Nc1cccc(Cn2ccnc2C(C)C)c1)c1ccco1 671755700 HBWFCBXMFMTIQP-HXUWFJFHSA-N 349.478 5.767 30 20 EKED CCOc1cc(/C=C2/CCc3sccc3C2=O)cc(Cl)c1OC 726894399 YMNOPSZDGFBMQG-WQLSENKSSA-N 348.851 5.021 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)c(C)c1 728440370 WLUVJVQOSMDWAM-VURMDHGXSA-N 325.458 5.385 30 20 EKED C#Cc1cccc(N(CC)C(=O)c2ccc(-c3ccccc3Cl)o2)c1 728481346 YRICOLKPMDSWAC-UHFFFAOYSA-N 349.817 5.248 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)c1cncc(F)c1 737446315 QIBQYQRIUFWNEF-ALCCZGGFSA-N 343.810 5.499 30 20 EKED COc1ccc(CCC(C)=NOCc2cc(C)nc3ccccc23)cc1 742357239 SCEKEJILKWZYCG-UHFFFAOYSA-N 348.446 5.077 30 20 EKED C[C@H](CCC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 750313191 NXRZBXIGOPBKAI-ZBFHGGJFSA-N 334.444 5.056 30 20 EKED O=C(/C=C\c1cscc1Cl)c1ccc(-c2ccncc2)cc1 771857398 DJBKHCMEXXLYRK-WAYWQWQTSA-N 325.820 5.360 30 20 EKED CC[C@@H](CC#N)OC(=O)c1sc2cccc(Cl)c2c1Cl 787092111 MGLFGYSKTOQZPV-QMMMGPOBSA-N 328.220 5.057 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(SC(F)(F)F)cc2)cc1 796968702 BJTQFVSXJOUAKU-YHYXMXQVSA-N 333.334 5.066 30 20 EKED CCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211268 GZEUTGZOEPANHU-WMLDXEAASA-N 340.389 5.273 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 862720494 QORDFIOUGBDLHX-UHFFFAOYSA-N 344.455 5.049 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccccc1C(F)(F)F 915963812 MIJIQCKELBUBQY-UHFFFAOYSA-N 329.325 5.090 30 20 EKED CCCCCCC[C@H](C)CNc1nc(C(F)(F)F)ccc1C(=O)O 1776782300 DRGUMCFEFOKQEA-LBPRGKRZSA-N 346.393 5.207 30 20 EKED CC(C)c1noc([C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 60127431 NWFIOHGKPGOFKA-CQSZACIVSA-N 348.406 5.030 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(F)cc1F 71813665 XBJSGCUMEINSAL-SOFGYWHQSA-N 345.345 5.124 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(F)cc1F 212106123 XBJSGCUMEINSAL-VURMDHGXSA-N 345.345 5.124 30 20 EKED N#Cc1c(F)cccc1Sc1nnc(-c2cccc3ccccc23)o1 301460412 ZYKUSETWZBWUHW-UHFFFAOYSA-N 347.374 5.052 30 20 EKED C[C@H]1CCc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@H]1C 410978384 CVYJWNCUCOROET-QWRGUYRKSA-N 340.448 5.028 30 20 EKED C[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 429755698 HXHUANROCSPLGV-QAPCUYQASA-N 349.434 5.003 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCC(C)(C)C1 432073113 BLONMWUOYGLJML-GJZGRUSLSA-N 345.512 5.123 30 20 EKED CC(C)(C#N)CCCCN[C@H](Cc1ccccc1)c1cccs1 444688569 ZYTHDZLXDDIGAN-GOSISDBHSA-N 326.509 5.342 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 444795664 AQJWTSBVIIVJQI-ZDUSSCGKSA-N 336.760 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](CC2CC2)C1 455239628 CYYWYVNAFCKKHP-QGZVFWFLSA-N 326.484 5.192 30 20 EKED C=CC[C@@H](CC)NC(=O)c1c(F)cccc1Sc1ccccc1 466541483 JUWOSQPSIFXIHP-CQSZACIVSA-N 329.440 5.061 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 466548831 ULBDHTQBAHBVNI-AWEZNQCLSA-N 339.401 5.014 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 477622636 OGTZCBPWCWQNAF-QGZVFWFLSA-N 338.451 5.175 30 20 EKED COc1ccccc1[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 539214667 TYGOZIRNMJKINT-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)c(F)c1 540708560 ZLCKNHWKGHVFAX-BFUOFWGJSA-N 328.406 5.274 30 20 EKED C=CCC[C@@H](NCc1ccnc(OCc2ccccc2)c1)c1ccco1 552050094 PTOOJASZHFAHAH-HXUWFJFHSA-N 348.446 5.051 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H](CCC#N)c1ccccc1 572916485 FNJXTJHSMPBNDR-RBBKRZOGSA-N 343.474 5.488 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(F)cc1C(F)(F)F 599037885 ILFQRHNADXRVIA-LBPRGKRZSA-N 348.343 5.056 30 20 EKED C=CCN(C(=O)[C@H](C)c1ccccc1C(F)(F)F)c1ccccc1 607780721 JBRPQNUUTABBLU-CQSZACIVSA-N 333.353 5.028 30 20 EKED Cc1cccc2cc(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)oc12 609415135 ZOLSAUNZYHUHGO-GOSISDBHSA-N 346.430 5.033 30 20 EKED N#CCN(Cc1ccc(Oc2ccccc2F)c(F)c1)C1CCCC1 610003261 SXZUTKLSOFXPBF-UHFFFAOYSA-N 342.389 5.025 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 612264671 XDQIJIHWHADMPM-OAQYLSRUSA-N 348.446 5.130 30 20 EKED N#C[C@H](C(=O)c1cc2c(s1)CCCCC2)c1ccc2ccccc2n1 613291276 YZAJHLGKWRUOSE-INIZCTEOSA-N 346.455 5.055 30 20 EKED C=CCC[C@@H](N[C@H]1CCCn2ccnc21)c1ccc(C(F)(F)F)cc1 655734472 JAUHJQWYDHDOAU-SJORKVTESA-N 349.400 5.034 30 20 EKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)c2ccccc2)c1 726440590 XBBUHBCWXCNWAA-UHFFFAOYSA-N 342.467 5.072 30 20 EKED CC(C)(C)CC(=NNc1nncc2ccccc12)c1ccc(F)cc1 734296631 ABFHQRSFLGRQPY-UHFFFAOYSA-N 336.414 5.021 30 20 EKED CCCCCC[C@@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 741923999 BCBMSRSWDAERGR-CVEARBPZSA-N 332.513 5.626 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(-c2ccncc2)cc1 745989974 IMBRHSKCCIRBJX-MDZDMXLPSA-N 336.394 5.193 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccsc1 749104395 JZURNSJXWLVQIM-ALCCZGGFSA-N 341.413 5.281 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1cc(F)cc(F)c1 755704303 KWHQAYREAQOFIM-ARJAWSKDSA-N 333.384 5.046 30 20 EKED CCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCC1 756914535 NFGFEABQYJHWEM-HXUWFJFHSA-N 332.447 5.251 30 20 EKED O=C(/C=C\c1cc2ccccc2s1)c1c(Cl)nc2sccn12 758434462 RVYKFKJCRJQXQA-WAYWQWQTSA-N 344.848 5.160 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccncc1 766017374 ATEYUYDKGABYSI-HTAPYJJXSA-N 329.447 5.112 30 20 EKED C[C@@H](OC(=O)CCCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 770760060 BIHIZBOPRVVRKH-MRVPVSSYSA-N 346.242 5.181 30 20 EKED C[C@@H](Nc1ccc(OC(C)(C)C)c(C#N)c1)c1cc2cnccc2o1 826049548 VBISUOMZUHFRQI-CYBMUJFWSA-N 335.407 5.050 30 20 EKED N#C[C@@H](c1nccc2ccccc12)C(=O)[C@H]1CC[C@H](C2CCC2)CC1 850987151 VGXCGPDLOIVJOR-QRFRQXIXSA-N 332.447 5.018 30 20 EKED C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1cccs1 78080764 CSMYFAFUGODJEG-GFCCVEGCSA-N 338.457 5.090 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1occc1CSc1ccccc1 125740562 ANPGPIWCKMSWKS-UHFFFAOYSA-N 348.427 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc2c(c1)CCC2 189886699 IMTHSGNIWYFLPU-UHFFFAOYSA-N 333.475 5.208 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1cccc(F)c1C#N 195607966 TVBBOKHTETZISX-GFCCVEGCSA-N 337.423 5.302 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 537289417 AAQFEYFLNAFLGA-ZHRRBRCNSA-N 346.861 5.652 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2cccc(OC(F)F)c2)CC1 538822826 MTGFCUNHTVYOSO-UHFFFAOYSA-N 342.389 5.104 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 550827113 KIRLAAKPDHBVGA-BEFAXECRSA-N 344.405 5.374 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2cccs2)cc1 570168036 FMDYNFJREHOEQA-MRXNPFEDSA-N 344.483 5.627 30 20 EKED Cc1c([C@@H](NC(=O)CCCCCC#N)C(C)C)oc2ccccc12 588460331 DMUJPTLEESPPGN-IBGZPJMESA-N 326.440 5.029 30 20 EKED N#CC1(CC(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CC1 590202382 PUJTYYFFWUQYEG-UHFFFAOYSA-N 342.851 5.124 30 20 EKED CC(C)(C#N)c1ccc(CNc2cccc(C(F)F)c2Cl)cc1 614057768 CTWLCJSXQOCGMB-UHFFFAOYSA-N 334.797 5.691 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(C(C)C)c1 615481413 VWJAMQGKTIOPGZ-UHFFFAOYSA-N 326.415 5.169 30 20 EKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)Cc2c(Cl)cccc21 727267611 YMCKVVMUELMCGG-LCYFTJDESA-N 337.831 5.286 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 737502283 GDDBNTHJUSWXMR-DNVCBOLYSA-N 346.455 5.146 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccncc1 766017804 DRSRWACCIUSOAL-GXFFZTMASA-N 327.280 5.418 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(Cl)s1 789718762 JMTLNOWAADQCTR-ZRDIBKRKSA-N 345.895 5.905 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)nc1Cl 856778340 NAFBSGIBEDZLNV-NSHDSACASA-N 347.812 5.124 30 20 EKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)[C@@H](C)CC)cc1 1776788430 CXSDYSCUMJDZJG-FXAWDEMLSA-N 349.515 5.015 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2nc(-c3ccccc3)cs2)cc1 26040176 MPMROWANRKCDOL-QGZVFWFLSA-N 336.485 5.346 30 20 EKED C=CCn1c(S[C@@H](C)c2ccc(Cl)cc2)nnc1-c1ccco1 60428568 QHEUWRVFYIBMED-LBPRGKRZSA-N 345.855 5.231 30 20 EKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CCCCC12CCCC2)c1ccccc1 329729472 HPEWMJPRDIBSKR-RTBURBONSA-N 342.483 5.554 30 20 EKED CC1(C)[C@H]2CC[C@@]1(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C3CC3)CC1)C2 329976041 YKGFZGXWXIRBLJ-CDVYFQANSA-N 346.515 5.083 30 20 EKED Cc1nc(C2CC2)oc1/C(O)=N/[C@@H](C)C1(c2ccccc2)CCCC1 330039236 FGBHZUFUPCRTLR-HNNXBMFYSA-N 338.451 5.066 30 20 EKED CC[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1 447595654 AJJZDNQZQYIYLP-GOSISDBHSA-N 332.369 5.616 30 20 EKED C=CCCCCCN(C)C(=O)Nc1c(CC=C)cccc1C(C)C 475545264 AZEUHOLGRYTTGA-UHFFFAOYSA-N 328.500 5.749 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccc(C#N)c(F)c1 479499718 ICGMAOKESMRQCQ-UHFFFAOYSA-N 344.436 5.156 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)CCC3CC3)cc2Cl)cc1 609642740 IBVDAGNVOXQFHL-UHFFFAOYSA-N 340.810 5.133 30 20 EKED C=CCOc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1 741473457 PZLNVPJUDNXJBK-FLIBITNWSA-N 341.410 5.210 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792103688 LQYXDRBGEIXUDO-FIIODCPWSA-N 346.817 5.168 30 20 EKED CC(C)(CCC#N)COC(=O)c1occc1CSc1ccccc1 798877192 NTTCRJGINKKCQN-UHFFFAOYSA-N 343.448 5.059 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 799724427 MFEDGLNHFOBRIG-FRRDWIJNSA-N 341.307 5.077 30 20 EKED CCOc1ccc(N[C@@H](C)c2cccc(C#N)c2)c(C(F)(F)F)c1 864007577 LLNCCLSRAJWKOW-LBPRGKRZSA-N 334.341 5.149 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)/C=C\c1ccccc1C#N 914732122 BMMYWCKNSQSKGP-OWBHPGMISA-N 338.410 5.186 30 20 EKED O=C(O)c1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc1 1776126539 OJCARDYMAVHZLJ-NVNXTCNLSA-N 344.366 5.073 30 20 EKED CCCCCCCOc1ccc(CN[C@](C)(CCCC)C(=O)O)cc1 1776788289 XMRPKZIAUITXEC-OAQYLSRUSA-N 349.515 5.159 30 20 EKED N#Cc1cccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c1 5579085 MEYZFLGBNMCMGR-UHFFFAOYSA-N 348.789 5.256 30 20 EKED Cc1ccc(-c2cnc(CNc3ccccc3SCCC#N)o2)cc1 72912391 HNQCSZWDWCZCJX-UHFFFAOYSA-N 349.459 5.268 30 20 EKED C[C@H](Sc1cc(C#N)ccn1)c1ncc(-c2ccc(Cl)cc2)o1 119145818 CTUCQCWTGQVAGH-NSHDSACASA-N 341.823 5.115 30 20 EKED CCN(C(=O)[C@H](C)c1cc2ccccc2o1)[C@H](C)c1ccc(C#N)cc1 176162091 DAOBUAPZXGDFDY-HZPDHXFCSA-N 346.430 5.018 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H](C)c3cccc(C#N)c3)oc12 181418075 VCGCOPZXFIQRKZ-CABCVRRESA-N 334.419 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccccc1F 189889625 YQVZXRGIZJDMRC-MRXNPFEDSA-N 339.454 5.495 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(SC)cc1 189898103 GUHMJKRXTPHAPQ-UHFFFAOYSA-N 325.477 5.513 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C1CCC1 191427322 CSRIFMLAYRIIMN-IBGZPJMESA-N 326.484 5.335 30 20 EKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1cccc(Cl)c1 206946575 FVBDSBZGDXKTCY-KHPPLWFESA-N 349.817 5.210 30 20 EKED CC(C)c1cccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 432640221 DAPNQCQJCNPMFM-FQEVSTJZSA-N 335.451 5.367 30 20 EKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)CCCCC(C)(C)C#N 444625973 QUXJZTOVHATOQD-CQSZACIVSA-N 326.406 5.418 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 466873487 QFGYZNSINGNSMF-PBHICJAKSA-N 339.401 5.361 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 466874198 VQDAURSGBIPKDR-WMLDXEAASA-N 339.401 5.361 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Cl)cn1 480149204 OEZOHIDFYBEMNP-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=C(C)[C@H](N[C@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480692035 FKNYLEDFKJXSIK-MOPGFXCFSA-N 346.377 5.231 30 20 EKED CCC(CC)N(CC(C)C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 483445593 PCJCGINFBNECKR-UHFFFAOYSA-N 329.488 5.166 30 20 EKED C=CCN(C(=O)c1ccc(CCC(F)(F)F)cc1)c1ccccc1 508156242 CQJHLQSWGJNBTM-UHFFFAOYSA-N 333.353 5.014 30 20 EKED N#CCCCOc1cccc(CNC2CCC(c3ccccc3)CC2)c1 517538010 CNOUYWATKRSQTP-UHFFFAOYSA-N 348.490 5.185 30 20 EKED CCSc1ccccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 565764206 XUXMEBNRVDUHEC-YLJYHZDGSA-N 338.520 5.884 30 20 EKED CC[C@@H](NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 740000833 REEQZXYYYCFYIL-HXUWFJFHSA-N 332.472 5.528 30 20 EKED C[C@@H]1CCC[C@@H](CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C1 750667158 CHBBSXHSHUADHC-BFYDXBDKSA-N 338.476 5.203 30 20 EKED C[C@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 751924367 PDTZZKMRMHLZRN-QWHCGFSZSA-N 332.419 5.285 30 20 EKED C#CCCCCCC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 783474371 DXRJKEZPFFLPLW-LGHUBQEGSA-N 329.509 5.116 30 20 EKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(C)s3)cs2)cc1 797157775 SQTAIHNDMCNYCY-RMKNXTFCSA-N 341.457 5.085 30 20 EKED C=CC[C@H](OC(=O)C1CC(F)(F)C1)c1ccc(Cl)c(Cl)c1 797553197 FJYGAZXOKOQGFR-ZDUSSCGKSA-N 335.177 5.199 30 20 EKED COc1cc(/C=C\C(=O)c2c(F)cccc2Cl)ccc1SC 809158854 FAJYUQCXIUFITQ-VURMDHGXSA-N 336.815 5.106 30 20 EKED CC(C)c1scnc1C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 810526953 FWKJWCMFQMUIQP-UHFFFAOYSA-N 348.427 5.024 30 20 EKED C#Cc1cccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)c1 919903214 MQXVELYTODJCDY-QFIPXVFZSA-N 340.426 5.190 30 20 EKED C=C(C)c1cccc(NC(=O)N(C)[C@H](C)c2sc(C)nc2C)c1 934876064 IUNWUSONTYJDRM-CYBMUJFWSA-N 329.469 5.018 30 20 EKED C=CCN(CC1CCCCC1)[C@H](C(=O)O)c1cccc2ccccc12 1776177467 DEDJIRFPHOEYBH-NRFANRHFSA-N 337.463 5.034 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1Cl 37748906 OWZYNMYXQVTAQH-JTQLQIEISA-N 339.653 5.369 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1csc(-c2ccccc2)n1 63750990 DYQQZLADPTYSNS-UHFFFAOYSA-N 347.487 5.092 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 90665743 JMGSODLKEOHSLW-KSSFIOAISA-N 332.369 5.401 30 20 EKED C=CCOc1ccc(CN[C@H](CCC#N)c2ccccc2)cc1Cl 130602328 HWHQQHCMJHCNSN-LJQANCHMSA-N 340.854 5.039 30 20 EKED N#CCCCCN[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 178647679 HYHYAGXFKFEWGW-OAHLLOKOSA-N 345.899 5.124 30 20 EKED N#C[C@@H](C(=O)c1csc(Cl)c1)c1nc(-c2ccccc2)cs1 191375910 SOBKOQRJPLBJCS-LBPRGKRZSA-N 344.848 5.015 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 237850845 QWIUGCMJNDLEOM-QHCPKHFHSA-N 338.410 5.184 30 20 EKED C=CCN(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 429370473 DWFSYJGCAUHRNI-NSHDSACASA-N 346.418 5.246 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)C(C)(C)C 433132292 FVGYDMFZHZCYBZ-CQSZACIVSA-N 347.528 5.132 30 20 EKED COCCSc1ccc([C@@H](C)Nc2c(Cl)cccc2C#N)cc1 462812625 IFDBSFVAFAYRGZ-CYBMUJFWSA-N 346.883 5.123 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(-c2cnc(C)o2)cc1)c1ccccc1 487545658 ZKWHCLUDWJEDHM-HXUWFJFHSA-N 346.430 5.339 30 20 EKED COc1cc([C@H](C)Nc2ccc(C#N)c(Cl)c2)ccc1OC(C)C 609500249 XVRJEZMSRFLFDS-ZDUSSCGKSA-N 344.842 5.181 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1c(C)noc1C 682777221 IJGMFULSDOIQAO-CYBMUJFWSA-N 341.455 5.026 30 20 EKED CCCc1ccc([C@@H](NCc2ccc(OCC#N)cc2)C(C)C)cc1 726702866 LYVGLQMPLWSDLD-QFIPXVFZSA-N 336.479 5.028 30 20 EKED CCCCCC[C@@H](CC)C(=O)Nc1nc(C)c(SCC#N)s1 735002625 LEFDOBBPOYVDQP-CYBMUJFWSA-N 339.530 5.002 30 20 EKED C#CCCOc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1 735509123 VDQIFHVMOSFNHK-CQSZACIVSA-N 348.273 5.246 30 20 EKED CSc1cccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1C 774575802 JKCBGRPPWMOLLI-UHFFFAOYSA-N 347.896 5.051 30 20 EKED CC(C)Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc3ccccc3o2)c1 796815788 GFBGBGLOANEXAV-QAPCUYQASA-N 346.430 5.006 30 20 EKED CC(C)C[C@H](C)N(C(=O)CCCCCC#N)c1ccc2[nH]ccc2c1 808342963 BFNLRBCKIIWZBH-KRWDZBQOSA-N 339.483 5.410 30 20 EKED CC(=NNc1cccc(Cl)n1)c1sc(-c2ccccc2)nc1C 814939336 NJISUIADWSHZNG-UHFFFAOYSA-N 342.855 5.003 30 20 EKED C=CCN(C(=S)Nc1c(C(C)C)cccc1C(C)C)[C@H](C)COC 849276902 LKVLCHJZUQYZCR-MRXNPFEDSA-N 348.556 5.153 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccccc1F 1776784571 HYDPPXXPXUQFMN-LJQANCHMSA-N 337.479 5.414 30 20 EKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)C(C)(C)C)cc1 1776788228 SDDQDBKVDUDCFZ-LJQANCHMSA-N 349.515 5.015 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1Br 90665369 RDZYVNYNWQHKDL-KBXCAEBGSA-N 343.268 5.145 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc3ccccc3c2)c1 110424285 CYWMTUUYFFUERT-JLHYYAGUSA-N 341.410 5.418 30 20 EKED N#CCC[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccccc1 167248427 SHIZXPYNRVRKTG-QGZVFWFLSA-N 329.325 5.034 30 20 EKED N#CCCCOc1cccc(CNc2ccc(SC(F)F)cc2)c1 178810931 MBPMWWYVFXDREX-UHFFFAOYSA-N 348.418 5.296 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C[C@H]1C 191445874 XMQMPBJKJZXTRV-QGZVFWFLSA-N 348.490 5.517 30 20 EKED CC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 192985567 DWLBDGXVAVEDBK-KUHUBIRLSA-N 328.843 5.044 30 20 EKED C=CCOc1ccc(CN[C@H]2CCSc3ccc(Cl)cc32)cc1 320083769 YCESMCMUCKZOMO-SFHVURJKSA-N 345.895 5.232 30 20 EKED C=CCC[C@@H](N[C@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 353626027 WYGKXFXSZRULCK-SJORKVTESA-N 349.400 5.103 30 20 EKED N#CCCC[C@H](NCc1csc(Cl)c1Cl)c1ccccc1 353917185 STUZKQBOIQDNGG-AWEZNQCLSA-N 339.291 5.580 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)Nc3ccccc3C#N)cs2)cc1 409752198 HUNSIPXKZKWCMQ-UHFFFAOYSA-N 347.443 5.057 30 20 EKED N#CCC[C@H](NCc1ccc(F)c(Cl)c1Cl)c1ccccc1 432258899 PCLBRWXTNGHYHQ-HNNXBMFYSA-N 337.225 5.267 30 20 EKED C=CCC[C@H](NC(=O)c1ccoc1C)c1ccc(C(F)(F)F)cc1 441588761 LWZSUJLSEIBWDU-INIZCTEOSA-N 337.341 5.044 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 447559787 ASRYMZWWYOCKLF-FZKQIMNGSA-N 332.369 5.379 30 20 EKED CCN(Cc1ccc2ccccc2c1)C(=O)Nc1cc(C#N)ccc1C 476929190 OZAUZBIWNQDJHP-UHFFFAOYSA-N 343.430 5.074 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)c1ccc(C#N)cc1 487935560 NFKLUGIAYDUXDX-IAGOWNOFSA-N 343.430 5.157 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1ccc(C#N)c(F)c1 488803961 JDPZNDAMMAMNOF-SHACYNPGSA-N 343.467 5.005 30 20 EKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc(C#N)cc3)s2)cc1 505768253 IGNNZLFHXQQBGO-ZDUSSCGKSA-N 349.459 5.172 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1OC(F)F 512648049 LBDGHTYOUNKBPV-YVEFUNNKSA-N 348.368 5.101 30 20 EKED CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 525412326 SPQCBCJWZKGKFG-BZUAXINKSA-N 345.512 5.029 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1 544577688 HOANKFZBDNGRGH-HOTGVXAUSA-N 332.472 5.699 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 556197907 NPHJXLCORBDBBY-LIRRHRJNSA-N 330.834 5.565 30 20 EKED C[C@H](SCCC(=O)Nc1cccc(C#N)c1)c1ccc(Cl)cc1 557853990 CBJHUNDKZBMXCS-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED CCCN(CC1CC1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434567 YNXNAEHAYPAWNL-UHFFFAOYSA-N 349.434 5.004 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)c(F)c1 611366138 DUBBRMHEIBDQOF-GOSISDBHSA-N 349.236 5.245 30 20 EKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1ccccn1 673812005 MWGUJEAKTHPCIE-MRXNPFEDSA-N 348.789 5.017 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1 728695582 ZLXYXBRWTFCELK-TWLAMCEISA-N 346.213 5.180 30 20 EKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1csc2ccccc12 734479700 XTSJFKOHKYZAFI-JTQLQIEISA-N 347.365 5.360 30 20 EKED CCCCCC[C@@H](C)NN=C(C)c1sc(-c2cccnc2)nc1C 743450532 LKLZNLDFNVUIKP-CQSZACIVSA-N 344.528 5.186 30 20 EKED C=CC[C@H](N[C@H](CC)c1cc(Cl)ccc1OC)c1ccncc1 766021627 UVVLNHKGDLUTTI-MSOLQXFVSA-N 330.859 5.102 30 20 EKED N#Cc1cc(NCc2cc3ccccc3nc2Cl)ccc1Cl 788499500 UWXCUDGUTWNPGB-UHFFFAOYSA-N 328.202 5.025 30 20 EKED C#Cc1cccc(NC(=O)[C@@H](Sc2ccccc2)c2ccccc2)c1 817840819 HJQGDTAMXVOMOQ-NRFANRHFSA-N 343.451 5.140 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccc(Cl)nc1 853313196 KUTQPWIYCGGJRM-UHFFFAOYSA-N 347.690 5.188 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccc(Cl)cn1 853435931 UWGRIZHQGZLION-UHFFFAOYSA-N 347.690 5.188 30 20 EKED Cc1ccc(C(F)(F)F)cc1NCc1ccc(C2(C#N)CC2)cc1 864024841 FMRMXZSNRXAFRN-UHFFFAOYSA-N 330.353 5.181 30 20 EKED N#Cc1ccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1 14908511 UZYZOHDPWUCNGQ-UHFFFAOYSA-N 347.226 5.332 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)s1 90664489 MIXGBDJZJJBIOY-OCCSQVGLSA-N 349.297 5.206 30 20 EKED CCCCCCCCC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 128814620 XGLXQAWFRYNYGO-INIZCTEOSA-N 341.480 5.132 30 20 EKED CC(C)[C@@H](NCc1cc(C#N)cs1)c1ccc(C(F)(F)F)cc1 130359436 FRNUYSWMVSUMHN-MRXNPFEDSA-N 338.398 5.125 30 20 EKED COc1ccc2oc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)c(C)c2c1 153714290 VWHYEVRIRWLLLZ-LSDHHAIUSA-N 334.419 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C(C)=O)c1 194592993 WHMQEVLSQNOHCI-UHFFFAOYSA-N 335.447 5.302 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 303925533 WNKXWIWMPUYXDK-CQSZACIVSA-N 348.427 5.154 30 20 EKED CC(O)=Nc1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329000157 KXUGLSSISGDMQF-NUEKZKHPSA-N 348.874 6.142 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cnn(C2CCCC2)c1 340446352 NGXVQNUQGGWRNY-DYESRHJHSA-N 336.483 5.084 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCc1ccc(C#N)s1 421031580 GDVUOOYLAFVIGQ-UHFFFAOYSA-N 341.480 5.188 30 20 EKED C[C@H](CC1CCCCC1)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431915798 GBYAXMSJEWFDSQ-XLIONFOSSA-N 341.499 5.080 30 20 EKED C=CCC[C@@H](NC(=O)Nc1ccc(COCC)cc1)c1ccccc1 435605197 RNRLSMXWVOKPDF-HXUWFJFHSA-N 338.451 5.052 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@@H](C)c1cccc(C#N)c1 447557045 KLDUWQMGYJOZRQ-KSSFIOAISA-N 332.369 5.211 30 20 EKED CC[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 457489826 MFEPNZZTTGUNEN-LEWJYISDSA-N 349.478 5.181 30 20 EKED CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H]1CCc2ccccc21 475386774 JXPGJKSWVLPXPU-OAQYLSRUSA-N 346.474 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCc2ccccc2C1 476086654 ZHCQTLRHQYXTJI-SFHVURJKSA-N 347.502 5.672 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(CC(F)(F)F)cc1 486576064 QFETUINYRWFVLJ-UHFFFAOYSA-N 332.369 5.205 30 20 EKED CCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512624066 HOVQVYCIXAJENO-KGLIPLIRSA-N 328.456 5.221 30 20 EKED Cc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 520557712 HYIGRRLKSZDNSO-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CC(C)(C#N)c1ccccc1CSCc1nc(C2CC2)cs1 542223560 YTYNASXIBDZJAC-UHFFFAOYSA-N 328.506 5.255 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2ccccc2)c1 589741240 WMQRMMHSRRFHGS-FQEVSTJZSA-N 336.435 5.011 30 20 EKED C=CCN(Cc1ccccc1F)Cc1nc(-c2cccs2)oc1C 615352729 LFCWWYDEZMHGNY-UHFFFAOYSA-N 342.439 5.039 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1c(C)cc(C)cc1Cl 642419188 WSZQJDUJHHGXKM-UHFFFAOYSA-N 328.843 5.177 30 20 EKED N#Cc1c(Cl)nsc1NCc1ccc(Oc2ccccc2)cc1 725789509 GNTPHALUUALODH-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CCOc1ccc(O)c(/C=N/[C@H](C)c2ccc(-c3ccncc3)cc2)c1 746393866 LRCAWNIXTAHUGW-DTVDJLOLSA-N 346.430 5.033 30 20 EKED C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772960043 QEVLLJBXWGFOFR-ZIAGYGMSSA-N 348.368 5.020 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)c(F)c1 776741866 KELXVNYXOUMVSL-CWTRNNRKSA-N 346.396 5.414 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2ccccc2)cc1 779992414 IZJNSLXESTVADY-KRWDZBQOSA-N 328.415 5.257 30 20 EKED CC(C)c1ccc(C=NOCc2cc(-c3ccc(F)cc3)no2)cc1 915213229 UGBUYQMEZZZFRJ-UHFFFAOYSA-N 338.382 5.155 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1 915985499 MIMYZLTVUWTSPA-KHPPLWFESA-N 334.444 5.225 30 20 EKED N#CCOc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1 917516815 GEAPHDJXTUKUEL-KHPPLWFESA-N 345.423 5.214 30 20 EKED CC[C@H](CC(=O)Nc1ccccc1SCCC#N)c1ccccc1 108199258 VHHFAUURCPAUSV-MRXNPFEDSA-N 338.476 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCC(F)(F)C1 281144024 WAGKNZWFLQBOMX-AWEZNQCLSA-N 336.426 5.095 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCC1CCCCC1 303288392 LWYYLYRZQWSTTG-INIZCTEOSA-N 344.524 5.627 30 20 EKED OC1=N[C@@H](C(O)=Nc2cccc(CSC3CCCCC3)c2)CCC1 328774368 DZEYKAQLXGTTTR-QGZVFWFLSA-N 346.496 5.350 30 20 EKED CC[C@H](NCc1ccc(C#N)s1)c1ccc(Cl)c(Cl)c1 421867395 BYSOXZBKAFGUFY-HNNXBMFYSA-N 325.264 5.167 30 20 EKED C[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1 443155558 QGMYDNVUMAFSSB-STQMWFEESA-N 344.867 5.033 30 20 EKED N#Cc1csc(CNC2(c3c(Cl)cccc3Cl)CCC2)c1 447060775 RSEBSIQDERAEHW-UHFFFAOYSA-N 337.275 5.096 30 20 EKED Cc1cc(C)c2ncc(C#N)c(N3CCC[C@H]3c3cccs3)c2c1 461465729 UYDICUUEFUZIND-KRWDZBQOSA-N 333.460 5.126 30 20 EKED C=CCOCCCC(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 463351722 WVGRDOLUJYBQFK-UHFFFAOYSA-N 335.403 5.021 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 466667866 XPNFITRCBSSXRB-JKIFEVAISA-N 339.401 5.217 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1 469912696 ABVRCZPIDLWTGR-UHFFFAOYSA-N 345.446 5.292 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2[C@@H]1C 475559186 NUTDFJWDHBEAGG-INIZCTEOSA-N 334.463 5.647 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H](C)[C@@H]1C 475572867 ZZNZKGYQCXQNDM-IKGGRYGDSA-N 328.500 5.437 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1nc2c(s1)CCCC2)c1ccc(F)c(F)c1 480679729 JNIPTYBNIBPCRJ-KZULUSFZSA-N 348.462 5.268 30 20 EKED CSc1cccc([C@H](NCCCCC#N)c2cc(F)ccc2F)c1 491010615 TWDSEYPMKPGUMO-IBGZPJMESA-N 346.446 5.060 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1cccc(-c2cccnc2)c1 507171639 WNGXUNNBCKSCHQ-UHFFFAOYSA-N 341.458 5.031 30 20 EKED CCN(Cc1cccc(OCCCC#N)c1)[C@H](C)c1ccc(F)cc1 510454545 IWWCHEIYNRCPLD-QGZVFWFLSA-N 340.442 5.091 30 20 EKED C[C@H](c1ccccc1Cl)N(Cc1cc(C#N)ccc1F)C1CC1 517901842 VAZVBBCELUCCPI-CYBMUJFWSA-N 328.818 5.076 30 20 EKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)c(F)c1 537400194 NIOWIUKONFPHQS-HXPMCKFVSA-N 328.818 5.153 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc1 590675852 CJZVYEWIGGWKGL-QEEYODRMSA-N 336.460 5.028 30 20 EKED CC(C)(C)c1cc(NC(=O)c2cc3cccc(F)c3o2)c(C#N)s1 611359812 UTBRGKLESIHHQP-UHFFFAOYSA-N 342.395 5.055 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1SCC(F)(F)F 675150536 XDOMKSGBZZIZJA-UHFFFAOYSA-N 329.387 5.048 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(SC(C)C)cc1)c1ccncc1 766022567 XECVEJWIMBMODN-OXJNMPFZSA-N 326.509 5.550 30 20 EKED C=CCC[C@H](Nc1ccc(OCCOC)c(Cl)c1)c1ccco1 796870921 DWRPLBQBPKQNAM-INIZCTEOSA-N 335.831 5.078 30 20 EKED N#C[C@H](c1nccc2ccccc12)C(=O)[C@H]1CC[C@H](C2CCC2)CC1 850987152 VGXCGPDLOIVJOR-YVWKXTFCSA-N 332.447 5.018 30 20 EKED N#CCCC[C@@H](N[C@H]1CCCc2c(Cl)ccnc21)c1ccccc1 926482060 XIDUQSIRZBGDMI-MOPGFXCFSA-N 339.870 5.137 30 20 EKED CSc1ccsc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66800093 OHKNESJWHKBWKN-LLVKDONJSA-N 348.518 5.117 30 20 EKED CC(C)[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccnc1 91412249 RGLJIZFAODTQKS-QHCPKHFHSA-N 341.458 5.107 30 20 EKED C[C@@H](Nc1ccc(Cl)cc1Br)c1cccc(C#N)c1 131453039 SMVFYUDEQXWJRR-SNVBAGLBSA-N 335.632 5.147 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2)[nH]n1 188063899 RNTWVNCGINYZDQ-UHFFFAOYSA-N 345.446 5.181 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(C#N)c1 189972858 IWWLVPIDCKBPMA-UHFFFAOYSA-N 349.478 5.298 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2)nnc1-c1cccs1 216443073 FXNSDLHENVQXTA-ZDUSSCGKSA-N 327.478 5.046 30 20 EKED N#Cc1ccc(CN[C@@H](CCCc2ccccc2)c2ccccc2)o1 237843270 VSEBIZOMZHDQDB-QFIPXVFZSA-N 330.431 5.005 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C#N)cc1Cl 426136745 BOBBOVCLDDDWAP-GOSISDBHSA-N 341.842 5.217 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(SCCCCC(C)(C)C#N)n1 436131839 YXCHMXSKEXVLIH-UHFFFAOYSA-N 341.402 5.093 30 20 EKED C[C@@H](NCCCCC(C)(C)C#N)[C@H](C)c1ccccc1C(F)(F)F 444677164 VWDFTLPUVHABST-LSDHHAIUSA-N 340.433 5.507 30 20 EKED C=CCN(C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccccc1 471130724 XXFVPADHIIWGOQ-UHFFFAOYSA-N 346.405 5.084 30 20 EKED N#CC[C@H](CC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1 474957071 XHCOTSAYFWPOLE-GOSISDBHSA-N 348.446 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C12CC3CC(CC(C3)C1)C2 476135000 GOJBALHVCHVMLY-UHFFFAOYSA-N 337.507 5.693 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1C 505016820 MNLRNMGWZBDJGT-NRFANRHFSA-N 334.463 5.483 30 20 EKED Cc1ccc([C@H]2CCCN2c2ccc(C#N)c(C(F)(F)F)c2)s1 513748306 DFIASLNELNTWGB-OAHLLOKOSA-N 336.382 5.289 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(CC#N)cc1 541660603 OEAAYBYIMWYDEI-OAHLLOKOSA-N 347.487 5.035 30 20 EKED CC(C)c1cccc(-c2ccc(C(=O)Nc3ccccc3CC#N)o2)c1 558016040 GPCAHSZOMBFGQT-UHFFFAOYSA-N 344.414 5.388 30 20 EKED C=CCn1c(SCCCc2cccc3ccccc23)nnc1C1CC1 566584858 JRHUAAKVMUSHIL-UHFFFAOYSA-N 349.503 5.220 30 20 EKED C=C(C)COc1cccc(NC(=O)N(C)[C@H](C)c2ccc(F)cc2)c1 589740798 ADWSIPWQBARSID-OAHLLOKOSA-N 342.414 5.006 30 20 EKED C=C(C)COc1cccc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)c1 606944377 RURJIDHVCGBOIE-PMACEKPBSA-N 334.419 5.065 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1oc2ccc(Cl)cc2c1C 609186966 JWHFHZKHTOCGDA-UHFFFAOYSA-N 346.858 5.187 30 20 EKED C[C@@H](NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 610356813 APPPDTUPTJJRQY-UZLBHIALSA-N 349.478 5.096 30 20 EKED CCn1nc(C)c(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c1C 727975304 CTLZMXDGSACLQG-PFONDFGASA-N 346.430 5.208 30 20 EKED CCc1c(C(=O)/C=C/c2cccc(OCC#N)c2)oc2ccc(C)cc12 730150578 BLWXRHGIZDWLNE-CMDGGOBGSA-N 345.398 5.102 30 20 EKED CCCCCC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 731400887 XGADOQSKTRZIFY-CVEARBPZSA-N 347.528 5.561 30 20 EKED CC1CCC(=CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 734101041 BWCGQKGHMKDMKR-IVAFLUGOSA-N 344.458 5.417 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1cccc(N(C)C)c1 735478787 OLXSVXVGPDQFQR-FQEVSTJZSA-N 330.516 5.167 30 20 EKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 744037705 CCYYXIFULJZTFA-KBPBESRZSA-N 347.409 5.214 30 20 EKED C[C@@H]1C/C(=C\c2ccc(Oc3cnccn3)cc2)C(=O)c2ccccc21 751535898 NGZSDMCEDXPIAU-OVGFGYAMSA-N 342.398 5.042 30 20 EKED Cc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)cnc1Cl 760265022 UFMCSVHFZCSNSX-NSCUHMNNSA-N 332.639 5.308 30 20 EKED C[C@H](N[C@H](C)c1csc2ccccc12)c1ccc(OCC#N)cc1 776157089 PEXPVKQOLVHWAK-LSDHHAIUSA-N 336.460 5.215 30 20 EKED O=C(/C=C\c1cc(F)ncc1F)c1ccc(Cl)c(Cl)c1Cl 806565204 JWPLASQIBMEARF-RJRFIUFISA-N 348.563 5.216 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1ccccc1F 917711267 AAUCXTVOKUQXKA-ZHACJKMWSA-N 348.402 5.078 30 20 EKED C[C@H]1C(=Nn2c3ccccc3c3ccccc32)CC[C@@H](C(=O)O)C1(C)C 1776113016 SRZLIOSLFWFPRL-YOEHRIQHSA-N 348.446 5.156 30 20 EKED CC[C@H](c1ccccc1)c1nnc(S[C@H](C)c2ccc(C#N)cc2)o1 118176881 CEDRRVYLKSVTHF-RDTXWAMCSA-N 349.459 5.336 30 20 EKED C=CCCCN(C)[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 129653756 MRFAJNBDNHLJPH-NSHDSACASA-N 340.254 5.002 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)Nc1ccccc1O[C@H](C)C#N 183542674 PMMXQBUHSCCCTN-OAHLLOKOSA-N 337.423 5.053 30 20 EKED CCc1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)C(C)C)cc1 236967945 AZDMOROEWPZMLL-VGSWGCGISA-N 336.479 5.027 30 20 EKED CC[C@@H](C)c1ccc([C@@H](Nc2ccc(C#N)nn2)c2cccs2)cc1 301931041 OORPVSAIARSOKE-JLTOFOAXSA-N 348.475 5.125 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 358329129 OEEBOPUFPBLQEU-MBSDFSHPSA-N 341.458 5.444 30 20 EKED CC(C)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 391934349 OCEVRENZBMULDF-YWZLYKJASA-N 342.870 5.290 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(F)ccc1Cl 438294705 KHVAKOAUSDIDLB-LBPRGKRZSA-N 334.847 5.485 30 20 EKED N#C[C@@H](NC(=O)CCCC1CCCC1)c1cccc(Cl)c1Cl 463745752 OHOBEJJFLGXJFG-OAHLLOKOSA-N 339.266 5.035 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cc2cccc(F)c2o1 475698921 GGZHZLMODBLSKC-CQSZACIVSA-N 336.410 5.224 30 20 EKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 481906844 LXSPUTFXVCTBBD-UHFFFAOYSA-N 342.398 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCCCC(=O)C1 487313479 UIKFKCLIIHQRDA-KRWDZBQOSA-N 327.468 5.017 30 20 EKED CC(C)C[C@@H](Nc1ncccc1C#N)c1cccc(C(F)(F)F)c1 498942552 VNRDDKNHQBYRSF-MRXNPFEDSA-N 333.357 5.171 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C 505058690 YYMIUFVLUGCKHK-XLIONFOSSA-N 334.463 5.215 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)cc1 508065137 ZQXZFGOWEOYJFD-QGZVFWFLSA-N 328.415 5.201 30 20 EKED C[C@@H](SCc1ncc(-c2cccs2)o1)c1ccc(C#N)cc1 522840556 RHIRQDYGNVXBMB-GFCCVEGCSA-N 326.446 5.269 30 20 EKED CC(C)N(CCC#N)C(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)o1 525711251 XQLIPFKXEJZIQO-UHFFFAOYSA-N 338.451 5.008 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@H](CC(F)(F)F)c1ccccc1 539276842 LLHYBJIVUHLJGS-GOSISDBHSA-N 346.396 5.271 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 551209453 CIUNAAYRHGRTMF-QFBILLFUSA-N 334.488 5.987 30 20 EKED N#CCCC[C@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccccc1 556203264 IXIUWIZXEHZDOT-PMACEKPBSA-N 342.433 5.278 30 20 EKED CC[C@H](C#N)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 593447351 DEGJUJUSVAKIJV-UONOGXRCSA-N 341.842 5.001 30 20 EKED C[C@H](Sc1ccc(Cl)cc1C#N)c1nnc(-c2cccs2)o1 610654662 OPBDXWDAYADBDD-VIFPVBQESA-N 347.852 5.176 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@@]1(C)CC1(F)F 666866349 NHGRMCWTZHXTIT-SFHVURJKSA-N 336.426 5.095 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccccc2-c2cccs2)c1 726451601 YGQPUDRQTRYLNX-UHFFFAOYSA-N 334.469 5.205 30 20 EKED C[C@@H](Nc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1 743473729 QIMXXMSSQFJUIO-MRXNPFEDSA-N 346.405 5.449 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)cn1 746686475 GMTQLGMFUTYFPJ-UTCJRWHESA-N 343.641 5.320 30 20 EKED CC(=NO[C@H](C)c1ncc(C(C)(C)C)o1)c1cc2ccccc2o1 756851000 ZYUKTSBXCKBJCE-CYBMUJFWSA-N 326.396 5.220 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C\c2ccc3cnccc3c2)cc1Cl 782348624 TZTHVISOVMVOLG-RQOWECAXSA-N 343.213 5.020 30 20 EKED N#CCCn1cc(-c2csc(-c3cccc(O)c3)n2)c2ccccc21 72097466 IIMODJJXBSUNTQ-UHFFFAOYSA-N 345.427 5.051 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(C#N)c(F)c2)cc1 192156075 WTEYVOCFIQTVCL-CQSZACIVSA-N 328.456 5.049 30 20 EKED CCN(Cc1cc(-c2ccc(C)cc2)no1)[C@@H](C)c1ccc(C#N)cc1 195594385 NAHYIYKDXDDCFU-KRWDZBQOSA-N 345.446 5.105 30 20 EKED CC1(C)CCCC[C@H]1CC(O)=Nc1cccc([C@@H]2CN=C(O)C2)c1 328643404 FHXXVSFFMCZPAM-HOTGVXAUSA-N 328.456 5.325 30 20 EKED N#CCCC[C@@H](NCc1cccc(C(F)(F)F)c1)c1ccccc1 353911411 BXHLVDHDSYHKOU-GOSISDBHSA-N 332.369 5.230 30 20 EKED N#CC1CCC(CN[C@H](Cc2ccccc2F)c2ccccc2)CC1 442851717 GECQPCAPNRDPLV-RWWKDMOOSA-N 336.454 5.029 30 20 EKED CC[C@H]1CC[C@H](C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 473581906 JMUWPGRMSGALDT-JYJNAYRXSA-N 330.497 5.093 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2ncccc2c1 483151088 LEIRKBVXWJEFHD-UHFFFAOYSA-N 349.393 5.026 30 20 EKED Cc1ccc(Cl)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1C 484243610 IMNSNWUNMYVOQU-UHFFFAOYSA-N 326.827 5.010 30 20 EKED C=CCn1cccc1C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 489052522 OSDCJLFHGBZNEV-QGZVFWFLSA-N 345.446 5.100 30 20 EKED CCC[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 500891266 LTWGPPMCJRZFDN-GOSISDBHSA-N 333.262 5.496 30 20 EKED CC(C)(CNC1CCC(C#N)(c2ccccc2)CC1)c1cccs1 507597724 FWDOVAHVSAIXEH-UHFFFAOYSA-N 338.520 5.019 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc(Cl)c1 511138494 YYNMGSAQGFSFQA-UHFFFAOYSA-N 338.819 5.192 30 20 EKED Cc1ccccc1[C@@H](C)N(CC(C)C)C(=O)NCC(C)(C)CCC#N 513150357 PXFONWNNMAPFDJ-GOSISDBHSA-N 343.515 5.054 30 20 EKED C[C@H]1CCCC[C@H]1CC(=O)Nc1ccccc1SC[C@H](C)C#N 519423851 GKAHRTFMUIAGAI-PMPSAXMXSA-N 330.497 5.093 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1cc(C)ccc1C)c1ccccc1 534725333 GJZDVRCRJAMPIA-UGKGYDQZSA-N 333.475 5.327 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1sccc1Br 537948838 HGCHLDLDOBASHL-IUODEOHRSA-N 349.297 5.206 30 20 EKED C=CCC[C@H](NCc1ccncc1C)c1ccc(C(F)(F)F)cc1 565285191 MDZPBEGKUDSMDY-SFHVURJKSA-N 334.385 5.206 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 586795009 TZCZHLIDXXTSBJ-QCSYZSNVSA-N 336.401 5.013 30 20 EKED CC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 608891834 NPIBAUPKVJQSGA-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H]1CCCC[C@@H]1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609436678 CTWGEKSPRFYZJE-ARFHVFGLSA-N 345.512 5.029 30 20 EKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1cc(C)sc1C 726425930 MAGHPKSWPYBMDD-UHFFFAOYSA-N 337.370 5.092 30 20 EKED O=C1/C(=C/c2csc(-c3ccc(F)cc3)n2)CCc2sccc21 726892804 OSAVBLJAIHPGSD-FMIVXFBMSA-N 341.432 5.223 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1cccc(-c2ccncc2)c1 741451609 KIJBAJWEEQEVBD-UHFFFAOYSA-N 338.414 5.133 30 20 EKED O=C(/C=C\c1cc2ccccc2o1)c1ccc(-c2ccncc2)cc1 745990119 KSODOQGWPUFXFU-KTKRTIGZSA-N 325.367 5.391 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(COC)c1)c1ccccc1 773074419 FYKFVXKBALFSIA-UTKZUKDTSA-N 339.479 5.200 30 20 EKED C[C@H](c1cccc(C#N)c1)N(C)Cc1ccc(SC(F)F)cc1 782180987 NMFNRPJTXNOAFO-CYBMUJFWSA-N 332.419 5.066 30 20 EKED C=CCN(CCC#N)C(=S)Nc1c(C(C)C)cccc1C(C)C 793247863 SFCPUNCWGNPUOJ-UHFFFAOYSA-N 329.513 5.032 30 20 EKED N#Cc1sc(N[C@@H](c2ccccc2)c2cccc(F)c2)nc1Cl 804543366 UBUXZBRRVNQLSC-HNNXBMFYSA-N 343.814 5.009 30 20 EKED CCCCCCCCC[C@H](C)CCN1CCC[C@@](CC)(C(=O)O)C1 1776785095 CEJPQKUSLFIKNC-PZJWPPBQSA-N 339.564 5.730 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 340451043 ZIBRONUASFSQFZ-VQTJNVASSA-N 337.423 5.071 30 20 EKED CC(C)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 391934342 OCEVRENZBMULDF-MGPUTAFESA-N 342.870 5.290 30 20 EKED N#CCCC[C@H](NC1CCC(OC2CCCC2)CC1)c1ccccc1 449337139 AAARTADWXIRUCI-VTLFHKLASA-N 340.511 5.282 30 20 EKED C=CCC[C@H](N[C@H]1C[C@@H](C)n2ccnc21)c1ccc(C(F)(F)F)cc1 453175627 QIGBBUJGSQYYTF-COXVUDFISA-N 349.400 5.205 30 20 EKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2cccs2)o1 465387370 HGGJFYULIXXGHI-VIFPVBQESA-N 347.852 5.176 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 466667865 XPNFITRCBSSXRB-GRDNDAEWSA-N 339.401 5.217 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 477622635 OGTZCBPWCWQNAF-KRWDZBQOSA-N 338.451 5.175 30 20 EKED C=CCC1(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)CCC1 480030098 OMEPGTYJWRZGRS-QGZVFWFLSA-N 334.463 5.545 30 20 EKED CC(C)CCc1ccccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 521220725 GSEINSGMAVSMQI-INIZCTEOSA-N 335.451 5.030 30 20 EKED C[C@H](N[C@@H](C)c1cc2c(ccc3ccccc32)o1)c1ccc(C#N)cc1 537296008 QJEGMFWKNYMPDT-HOTGVXAUSA-N 340.426 5.869 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCCCC1CCOCC1 538611020 DCDHHSXEKPLJOG-MRXNPFEDSA-N 332.513 5.090 30 20 EKED CC#CCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 547337443 ARLKWMHBYKDMLA-UHFFFAOYSA-N 334.444 5.155 30 20 EKED C[C@H](NCc1cc2c(s1)CCCC2)c1ccc(C#N)cc1Cl 555783920 ZSNRLHVHBHXUAJ-LBPRGKRZSA-N 330.884 5.003 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 588942798 JJOJATJXBAPMCN-UHFFFAOYSA-N 344.361 5.170 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(CCC#N)CC(C)(C)C)sc2c1 609191874 ZXZRQEQZMYYEAP-UHFFFAOYSA-N 348.899 5.265 30 20 EKED COCCCC[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 619465940 LRLOOBIXWWBYEO-DHIUTWEWSA-N 348.490 5.083 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)CC(C)C)n2)cc1 727953449 BDZKYPBFGPHSKQ-DOTOQJQBSA-N 340.492 5.367 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1SC(F)F 740429435 FCUSLIKSLQEKLN-UHFFFAOYSA-N 328.428 5.211 30 20 EKED CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745989846 CPFGFWRPTQNCHS-IZZDOVSWSA-N 329.399 5.043 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1ccc(O)c(Cl)c1 768752103 JOIIJLWIBLPXOO-VQHVLOKHSA-N 341.819 5.065 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3ccccc3)n2)cc1 773982929 NEUWHQRNXFYFFR-QAPCUYQASA-N 346.455 5.099 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1cn(C)nc1C 775183494 VROZJBPABJVJBK-YLJYHZDGSA-N 347.547 5.169 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1ccc(N2CCCC2)cc1 795810919 LGTASWHSBRXHTG-JOCHJYFZSA-N 331.463 5.038 30 20 EKED N#Cc1ccccc1NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 841284144 DVYCTDULRDDAGE-ZRDIBKRKSA-N 348.402 5.078 30 20 EKED CCC[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 72591323 VNWQBCOAHWJNIW-BXUZGUMPSA-N 332.856 5.076 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)n1 80449276 SSUFZYLGFBAXLY-JTQLQIEISA-N 339.247 5.063 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc(C)c1F 154331952 XLJHIDXBURRBFX-CQSZACIVSA-N 342.439 5.089 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2(C#N)CC2)cc1 189879504 PHAYUZGFIMKTGE-UHFFFAOYSA-N 344.458 5.346 30 20 EKED COc1ccc(Br)cc1S[C@H](C#N)C1CCCCC1 303940386 XFBJCBFWZFDSQN-OAHLLOKOSA-N 340.286 5.022 30 20 EKED N#CCCC[C@H](NCc1c(Cl)cccc1Cl)c1ccccc1 433014378 DJMPLCIXSMEGEV-SFHVURJKSA-N 333.262 5.518 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 468772582 BCQBCJBNIJILPM-UHFFFAOYSA-N 330.790 5.024 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccco1 505059896 BYMSKAQTGZXUHY-IBGZPJMESA-N 338.451 5.547 30 20 EKED C=CCN(Cc1ccc(Cl)s1)Cc1cccc2cccnc12 507553298 RKVQJZVBUOUSKT-UHFFFAOYSA-N 328.868 5.138 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(C(F)(F)F)cc1 512618902 KLHCTDUXXQHPQS-NWDGAFQWSA-N 336.332 5.128 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CCCC(C)(C)C1 535155235 AOJZOEMDZGZROD-LSDHHAIUSA-N 330.497 5.093 30 20 EKED Cc1cc2cc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)oc2cc1C 556204384 GDSFBKZARPMNAP-NQIIRXRSSA-N 346.474 6.135 30 20 EKED N#Cc1c(NC[C@@H]2CCCO[C@@H]2c2ccccc2)cccc1C(F)F 570610335 UDOLNXSFIMOAMG-HNAYVOBHSA-N 342.389 5.076 30 20 EKED Cc1cc(C)c(C#N)c(SCc2c(Cl)ccc3cccnc23)n1 603722155 ORHKQTAHOBIIQS-UHFFFAOYSA-N 339.851 5.064 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCC1CCCCC1 609403088 RUTJSUMNZPWLFC-OAHLLOKOSA-N 345.512 5.030 30 20 EKED C[C@@H](SCc1csc(Br)c1)c1ccc(C#N)cc1 609825593 HMKOUOABTJHYCC-SNVBAGLBSA-N 338.295 5.377 30 20 EKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(C3CCC3)cc2)c(Cl)c1 618883445 NASMOJHKMPGZGD-UHFFFAOYSA-N 345.229 5.385 30 20 EKED C=CCC[C@H](NCc1ccnc(C)c1)c1ccc(C(F)(F)F)cc1 621274597 RPGTYDBXQYHXOR-SFHVURJKSA-N 334.385 5.206 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1 666304527 WDOULEZFCLOFET-HNNXBMFYSA-N 340.389 5.002 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccc(Cl)c([N+](=O)[O-])c1 741840188 JSDFMPQRQHXCOC-HYXAFXHYSA-N 345.713 5.030 30 20 EKED O=C(/C=C/c1cc(Cl)ccc1Br)c1ccsc1 742435004 QFTHPYLTNXECRL-DAFODLJHSA-N 327.630 5.060 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1O)c1ccccc1 756774864 DOSPGFGHLBEPQL-MLGOLLRUSA-N 334.246 5.114 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc2cc(O)ccc2c1 789144672 WQQQLGCXYYLXQV-BQYQJAHWSA-N 347.395 5.158 30 20 EKED CC(C)(CC(=O)[C@@H](C#N)c1nccc2ccccc12)C1CCCCC1 796900392 OZDLIOGMUFHELJ-LJQANCHMSA-N 334.463 5.408 30 20 EKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1cccc(Cl)c1Cl 804464295 SQXQOIMAACAAMR-LURJTMIESA-N 332.643 5.148 30 20 EKED CC[C@@H](NCc1ccc(CC#N)cc1)c1cc(Cl)cc(Cl)c1O 842888461 RUXUNOYKSBTHLY-QGZVFWFLSA-N 349.261 5.006 30 20 EKED N#Cc1ccc(Br)c(CNc2cccc3ccsc23)c1 864020197 JLAOJNSJRSTGFU-UHFFFAOYSA-N 343.249 5.148 30 20 EKED CCCCCCCC(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1 914767925 WGNLZWIUDDNXPU-UHFFFAOYSA-N 343.511 5.085 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1c(C)cccc1C(C)C 43313433 MVYMKXIVISHMTO-UHFFFAOYSA-N 328.481 5.400 30 20 EKED CCOc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1 63276833 VGYMESOJYPDHTQ-VMPITWQZSA-N 341.457 5.166 30 20 EKED CCN(Cc1csc(C2CCCC2)n1)[C@@H](C)c1ccc(C#N)cc1 63994602 KTKVRTPXIXYRDD-HNNXBMFYSA-N 339.508 5.255 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1c(C)noc1C1CC1 191435163 VSSIVXJJFVYASB-UHFFFAOYSA-N 339.439 5.356 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1 268810458 NZWUVQHETQQKQL-QWHCGFSZSA-N 327.497 5.033 30 20 EKED O/C(=N\C1CCC(/C(O)=N\C[C@@H]2C[C@H]2C2CCCCC2)CC1)C1CC1 329356261 WCLARNYQCKMJFY-UIDNRLJLSA-N 346.515 5.085 30 20 EKED Cc1nc(N[C@@H](CCCC#N)c2ccccc2)c2c(C)csc2n1 431498919 ZCOTUKDHUXJFEE-INIZCTEOSA-N 336.464 5.155 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cc2cccc(F)c2o1 475698920 GGZHZLMODBLSKC-AWEZNQCLSA-N 336.410 5.224 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 516781085 JYAUDRLOHRDACN-UHFFFAOYSA-N 348.789 5.256 30 20 EKED N#CCCSc1ccccc1NCc1cc(Cl)cc(Cl)c1 579696009 HWAYRMGFKXMAQW-UHFFFAOYSA-N 337.275 5.611 30 20 EKED CC[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(Cl)s1 594927717 XSMLVEGLCPZKRB-OAHLLOKOSA-N 330.884 5.198 30 20 EKED Cc1cc([C@H](NCc2ccc(C(C)(C)C#N)cc2)C2CC2)ccc1F 614182839 JCJZFVPOUIYPMK-OAQYLSRUSA-N 336.454 5.176 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3=CCCCC3)n2)cc1 730395144 BVDJUDOGWCSVPA-QGZVFWFLSA-N 336.460 5.185 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1c[nH]c2cc(Cl)ccc12 742433097 OTDBGJBZYCANBL-CLFYSBASSA-N 347.805 5.108 30 20 EKED Oc1ccc2ccccc2c1C=Nc1cccc(CC(F)(F)F)c1 743043801 ADXRAUHNDUCECW-UHFFFAOYSA-N 329.321 5.401 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2cccc(-c3cccs3)c2)cc1 770515000 ZPXZMMFGDZLAOK-HNNXBMFYSA-N 334.444 5.318 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1cc(-c2ccccc2)cs1 779989443 SERJXHDAWIHYMY-HNNXBMFYSA-N 334.444 5.318 30 20 EKED Cc1cc(N=Cc2cc3ccccc3nc2O)ccc1-c1ccncc1 793657910 ZDUFQMKPQUDIDW-UHFFFAOYSA-N 339.398 5.061 30 20 EKED N#C[C@H](C(=O)CCCC1CC1)c1nc(-c2ccc(Cl)cc2)cs1 813060870 MORMLQBGVFGBEV-OAHLLOKOSA-N 344.867 5.220 30 20 EKED N#CCCC[C@@H](NCc1cc2ccccc2c(Cl)n1)c1ccccc1 814658871 HSFWMUYVXWHLTF-HXUWFJFHSA-N 349.865 5.413 30 20 EKED CC(C)c1ccc(C=NOCc2coc(-c3cccc(F)c3)n2)cc1 914572225 IFKSYPQFMLEQNP-UHFFFAOYSA-N 338.382 5.155 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)CC(C)(C)C 917041571 VNKMDOFTZIAMGN-CHWSQXEVSA-N 347.409 5.070 30 20 EKED CCC/C(C)=C/C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920805491 LPKCHZHAQGTIDT-JATZPVMKSA-N 346.402 5.011 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)c2ccc3ccccc3c2)n1 84695992 XAIBETWTKWQCOH-KDOFPFPSSA-N 348.471 5.400 30 20 EKED CCCCCCCCC[C@H](CBr)CCCCCCC 117718299 HQILOMHBUXBHBX-GOSISDBHSA-N 333.398 7.499 30 20 EKED CC(C)c1ccc(SCc2nnc(-c3ccc(C#N)cc3)o2)cc1 150869601 QROWSLOBXUYDTB-UHFFFAOYSA-N 335.432 5.024 30 20 EKED Cc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1NC(=O)C(C)(C)C 174077467 MPIQEBLAEQEEHS-HNNXBMFYSA-N 335.451 5.024 30 20 EKED C[C@H](OC1CCCCCC1)C(O)=Nc1cc2c(cc1F)CCC(O)=N2 329930686 ZUNQDIYEELUXCW-LBPRGKRZSA-N 348.418 5.076 30 20 EKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1C(C)(C)C 340449684 VSNVNKUWSKSAQW-UZLBHIALSA-N 338.499 5.032 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 410346092 SUBJGCKYYAGOLB-MRXNPFEDSA-N 332.447 5.039 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@@H](C)[C@@H]1c1ccccc1 430810835 MUSHTDHWWMRMAU-ZLGUVYLKSA-N 333.475 5.527 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1ccccc1 432662791 BBBSXKLXKMLQPV-QGZVFWFLSA-N 345.805 5.036 30 20 EKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 432906986 OXVFABYDILSWNF-UHFFFAOYSA-N 349.434 5.029 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)SCCCCC(C)(C)C#N)n1 435891740 BHUWWZHKNMBPQX-OAHLLOKOSA-N 343.496 5.559 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C2CC2)[C@H]1C1CC1 455242729 HPHQDOKOCKDIGY-TZIWHRDSSA-N 338.495 5.191 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCc2sccc21 476123980 RCWLDAXMPBUUQT-GOSISDBHSA-N 339.504 5.659 30 20 EKED C[C@@H](Nc1cccc(Cl)c1OCC(F)F)c1cccc(C#N)c1 487487902 SZNJNZCJXLBDAS-LLVKDONJSA-N 336.769 5.029 30 20 EKED N#CCCCCN(Cc1ccccc1OC(F)(F)F)C1CCCC1 519201308 HBPSSKVLYBUQRS-UHFFFAOYSA-N 340.389 5.024 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 560546343 ZTEQWRPLKJGQOT-CRAIPNDOSA-N 348.412 5.767 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@@]3(C#N)CCC[C@@H](C)C3)sc2c1 609736839 RDUZLZSSRHOUCN-XIKOKIGWSA-N 346.883 5.065 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1O)c1ccccc1 756774865 DOSPGFGHLBEPQL-WBMJQRKESA-N 334.246 5.114 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@H]1C[C@@H](O)c1ccccc1 769735614 ZBLHQSOEKYBCBX-LEWJYISDSA-N 342.527 5.075 30 20 EKED Cc1csc(-c2ccc(N[C@H](C)c3ccc(C#N)c(F)c3)cc2)n1 777659552 OCGVYIDDSHRPGI-CYBMUJFWSA-N 337.423 5.302 30 20 EKED CCCCCCCC[S@](=O)Cc1coc(-c2ccc(F)cc2)n1 790139321 LFTRVXTWOVMEKM-QHCPKHFHSA-N 337.460 5.090 30 20 EKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792095040 SSQCGHINQIIABZ-GOSISDBHSA-N 348.833 5.042 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccccc1 796844562 DQQLMDWLTNEMEE-KXBFYZLASA-N 327.855 5.072 30 20 EKED C=CC[C@@H](OC(=O)c1oc(C)nc1C)c1ccc(Cl)c(Cl)c1 797555521 XDHCLVGTRUUOFQ-CQSZACIVSA-N 340.206 5.072 30 20 EKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)OC[C@H]2CC[C@@H](C#N)CC2)C1 809090452 MGPKUYSFEGVWFM-YSTOQKLRSA-N 349.515 5.015 30 20 EKED N#C[C@H](C(=O)c1ccc(Cl)c(Cl)c1)c1ccc2ccccc2n1 47376088 BPXPESZIHOLQTR-ZDUSSCGKSA-N 341.197 5.032 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(OCC#N)cc1 193013848 RUVSBALTDVWLKH-QRWLVFNGSA-N 340.442 5.166 30 20 EKED C[C@@H](c1ccccc1)N(Cc1cccc(C#N)c1)Cc1ccccc1O 216487242 FYSKSXOVVBBKGT-SFHVURJKSA-N 342.442 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn([C@H](C)CC)c1C 359847963 GPWGFCKOJVYBHO-OAHLLOKOSA-N 339.483 5.267 30 20 EKED N#Cc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c(Cl)c1 430366085 HBIDJMZYKPDJDO-MSOLQXFVSA-N 346.817 5.107 30 20 EKED C=CCOc1ccccc1CN[C@H](C)c1cccc(-c2ccncc2)c1 482867990 JRHVJLUPSJQCDL-GOSISDBHSA-N 344.458 5.164 30 20 EKED CCc1ccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 503227627 XEPVYFJPUVVARG-CQSZACIVSA-N 339.464 5.145 30 20 EKED CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1SC[C@H](C)C#N 521259902 SOIPRNHCLHXPCH-OAGGEKHMSA-N 345.512 5.029 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2ncc(C(C)C)n2C(C)C)cc1 523500306 OSIPJALLHZOMOU-QGZVFWFLSA-N 327.497 5.123 30 20 EKED CC(C)c1ccc(-c2nc(CN(C[C@H](C)C#N)C3CC3)cs2)cc1 533139038 IFCHYYUYMJVLCN-OAHLLOKOSA-N 339.508 5.058 30 20 EKED C[C@@H](NCCCSCC#N)c1ccccc1-c1ccc(Cl)cc1 539316675 IEBWJOOXKZCAPJ-OAHLLOKOSA-N 344.911 5.304 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCc1cccc(F)c1F 542233458 NFBOKHCOFDWQMX-CYBMUJFWSA-N 332.419 5.014 30 20 EKED N#CCCC[C@H](NCc1ccc(Oc2ccccc2)o1)c1ccccc1 552312145 SRXYURZGKKMWLB-NRFANRHFSA-N 346.430 5.597 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1Cl 554357715 KXAUNAMVACAYDG-SNVBAGLBSA-N 333.690 5.627 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1nc(-c2ccccc2)cs1 560260723 FIVPJQUBQURXPC-HNNXBMFYSA-N 345.471 5.022 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1Cl 585764828 OVXPYEJCEDYOTK-GJZGRUSLSA-N 342.870 5.411 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(C#N)c(Cl)c2)c(C)c1 604083462 WKXKQVJABHUTEJ-AWEZNQCLSA-N 341.842 5.053 30 20 EKED C[C@H](NC(=O)CCCc1ccc(C(C)(C)C)cc1)c1ccc(C#N)cc1 608934944 DBRSIZCYHXEADD-KRWDZBQOSA-N 348.490 5.056 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 626633605 DMQVBIGSLYEJIK-PCCBWWKXSA-N 331.459 5.063 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc(CCC(F)(F)F)cc2)C1 666290825 SUVPYLJZKVZKPV-OAHLLOKOSA-N 340.389 5.002 30 20 EKED CCC(=NNc1ncccc1C(F)(F)F)c1ccc(Cl)s1 733203648 UHNJRKZQFSMEGB-UHFFFAOYSA-N 333.766 5.042 30 20 EKED CC1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCCC1 734929701 OJNUNVJHGWIXLN-HXUWFJFHSA-N 347.462 5.186 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1coc(-c2ccccc2)n1 749894558 SGOYFWZIBWRSNT-GPILYODUSA-N 339.441 5.164 30 20 EKED COc1ccc(NN=Cc2c(Cl)cccc2SC(C)C)cc1 786035484 ABSQGTZXDYQQKN-UHFFFAOYSA-N 334.872 5.295 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccoc2C2CC2)cc1 798394368 HLOVBEADRIPJCR-HXUWFJFHSA-N 342.398 5.065 30 20 EKED C[C@@H](CCc1ccc(C(F)(F)F)cc1)Nc1cccc(OCC#N)c1 802648721 PAMMLZDFABACOZ-AWEZNQCLSA-N 348.368 5.041 30 20 EKED CC(C)c1ccc(-c2nc(CSCCO[C@@H](C)C#N)cs2)cc1 802749717 LDGJCNYSYWROBC-AWEZNQCLSA-N 346.521 5.095 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N(C)C)cc1 815635460 DARPLTIZQZXLNX-VXKWHMMOSA-N 335.495 5.228 30 20 EKED CC(C)(C)C(C)(C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 815913482 SQSOWTHESSUGNO-NSHDSACASA-N 334.872 5.198 30 20 EKED CCC[C@@H](CC(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 835074389 RIJMSXJZWMLFFO-UONOGXRCSA-N 347.409 5.070 30 20 EKED C=C(C)C(C)(C)c1nc(-c2ccccc2OCc2ccccc2)no1 904467021 UBFSKCVDZXXWGJ-UHFFFAOYSA-N 334.419 5.169 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccsc2)cc1 915179214 BFCDFGNJVOBRBE-QLQLNADESA-N 344.439 5.055 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)o1)c1cc(F)ccc1F 916134994 WOLZILYCYOVTGO-RMKNXTFCSA-N 328.289 5.260 30 20 EKED FC(F)(F)c1ccc(NN=Cc2ccccc2-c2ccccc2)nc1 917534519 RRFYNKOQIHUXPX-UHFFFAOYSA-N 341.336 5.213 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)c1cc2c(ccc3ccccc32)o1 1776036788 QVTLAGLHSMJBHJ-UHFFFAOYSA-N 344.370 5.120 30 20 EKED CC1(C)CCC/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C1=O 1776550862 LCWFNKNYUMSHCM-WYMLVPIESA-N 340.444 5.276 30 20 EKED Cc1cc(C(=O)/C=C/c2ccccc2OCc2ccccn2)c(C)s1 25198534 NOUBANUHSMKWOK-ZHACJKMWSA-N 349.455 5.235 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)n1 80458007 UDVSUHMNVZEJGE-LBPRGKRZSA-N 344.823 5.156 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC(=O)c2ccccc21 284565457 FIKKOYCFLMSSNP-FQEVSTJZSA-N 347.458 5.237 30 20 EKED CCCCCCCC(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 303332942 UBICSVVRDVXUOC-HNNXBMFYSA-N 330.497 5.348 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2ccc3nc(C(C)(C)C)sc3c2)CCC1=O 328897376 CQMQIBAHFUZNSU-VXGBXAGGSA-N 344.480 5.187 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1Cl 329032970 XSJYXVLRMHPHPM-NUEKZKHPSA-N 348.874 6.142 30 20 EKED Cc1cccc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c1C 330018445 SUPFASBFFSKPSR-ZLPCBKJTSA-N 342.483 5.246 30 20 EKED Cc1ccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 440771667 RVBDQFFEIZPMKB-UHFFFAOYSA-N 349.415 5.365 30 20 EKED N#Cc1ccc(SCc2ncc(-c3ccccc3)o2)c(Cl)c1 465389628 UCEFQNVAEUNKRB-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 467706774 YKRDTMNQYSVULB-YJBOKZPZSA-N 349.434 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC(C)(C)C1 475571860 NVPHPCIVYULILD-UHFFFAOYSA-N 328.500 5.583 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(CSC)cc1 485464504 JMLSNZHLBXRQAS-UHFFFAOYSA-N 329.490 5.080 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)CC(C)(C)CCC#N 508743352 MOVHIPSEJHIWCC-KRWDZBQOSA-N 326.509 5.641 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1F 512620979 UMJVSDMFAZXYBW-BFUOFWGJSA-N 328.406 5.274 30 20 EKED C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 514231934 FMCRQRQXSQXUSA-MRXNPFEDSA-N 330.406 5.138 30 20 EKED N#C[C@H](C(=O)c1cc2sccc2s1)c1nc2ccccc2s1 516465217 PPIDHUIKTLDFAA-SECBINFHSA-N 340.454 5.063 30 20 EKED CC(C)(C)[C@H](NCCCSCC#N)c1cccc(C(F)(F)F)c1 537098383 FOMPNBSWLZUUSY-OAHLLOKOSA-N 344.446 5.029 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(CCC(F)(F)F)c1 537251633 YSLPENUFJGRREC-CYBMUJFWSA-N 328.378 5.048 30 20 EKED Cc1cccc(C(NCc2ccc(C#N)s2)c2cccc(C)c2)c1 537308950 VRIMBCMRBXJKAE-UHFFFAOYSA-N 332.472 5.116 30 20 EKED C[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)cc1 539692477 VBCYYXGNVTXEPY-GFCCVEGCSA-N 331.246 5.205 30 20 EKED C=CCC[C@@H](CC)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 545189544 DQKKZGROLCYIOK-YKSBVNFPSA-N 341.520 5.292 30 20 EKED Cc1ccccc1C(NCc1cc(C#N)cs1)c1ccccc1C 546880201 LDQVCDBOVZERCE-UHFFFAOYSA-N 332.472 5.116 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 560546346 ZTEQWRPLKJGQOT-YJBOKZPZSA-N 348.412 5.767 30 20 EKED C[C@@H](NCc1cccc(Cl)c1Cl)c1ccc(C#N)cc1Cl 562413196 DZFZBEYKTCXYEZ-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C=CCCCCCN(C)C(=O)c1csc(-c2ccc(Cl)cc2)n1 606816499 BOAZOFXHOFKVPN-UHFFFAOYSA-N 348.899 5.282 30 20 EKED C=CC[C@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 609741559 OKDXFBHFIOTGRG-ZDUSSCGKSA-N 346.814 5.095 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H]3CCc4cc(C#N)ccc43)oc12 618801424 AUZUJSXBBMVKMV-AUUYWEPGSA-N 346.430 5.041 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)C1CCCCC1 726317819 DUCOKKVRSIVPJE-UKRRQHHQSA-N 326.465 5.079 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(N2CCCC2=O)cc1)c1ccccc1 773077030 PRMDSWWGINNNQE-GCJKJVERSA-N 348.490 5.172 30 20 EKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1cccc(F)c1F 776268729 TZTJZKFUAMETDQ-SREVYHEPSA-N 339.316 5.062 30 20 EKED CCSCc1cccc(N[C@H](C)c2ccc(OCC#N)cc2)c1 777697852 WVOMSGWVKGMFRO-OAHLLOKOSA-N 326.465 5.015 30 20 EKED CC(C)(CCC#N)CNc1ccc(OCc2ccccc2F)cc1 779592896 JRFQJNNFFDIHRE-UHFFFAOYSA-N 326.415 5.147 30 20 EKED CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2ccccc2SCC#N)CC1 781461090 WMWCCAIIWGHHJM-HOTGVXAUSA-N 344.524 5.027 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1ccc2ccccc2n1 796744950 CPPREINIBKFZKN-LULLPPNCSA-N 332.447 5.018 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1nccc2ccccc12 811699752 XCOHBYMMMBFURI-BQYQJAHWSA-N 348.452 5.316 30 20 EKED N#CC1(CCCC[S@](=O)Cc2ccc(Cl)c(Cl)c2)CCC1 899379524 ALYUBJZRVDCWKG-NRFANRHFSA-N 344.307 5.106 30 20 EKED O=C(O)c1ccc(NN=C2CCC[C@@H](c3cccc(Cl)c3)C2)cc1 1776013265 RPOMJNODRRDIKI-OAHLLOKOSA-N 342.826 5.164 30 20 EKED C=CCOc1ccc(C(=O)Nc2ccccc2Cc2ccccc2)cc1 43740184 DUAUASJJJIIILN-UHFFFAOYSA-N 343.426 5.095 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 166828323 YDJIHSAUYKLCBJ-BCNIOPEESA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCCCSC 191511620 ZDXYIBVJLZJFFM-UHFFFAOYSA-N 334.529 5.193 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(F)c(Cl)cc1Cl 315389157 FHYCOWMVRWEGCL-MNOVXSKESA-N 337.225 5.416 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1Cl 320934105 GDXJTFDFRYNLPH-ZDUSSCGKSA-N 349.261 5.849 30 20 EKED C[C@@H]1CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)c2ccccc21 356760954 GJSWZEPWTSSDAJ-IEBWSBKVSA-N 332.447 5.004 30 20 EKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(C#N)cs1 437157285 YCNGRJLEZSVTRE-INIZCTEOSA-N 346.455 5.023 30 20 EKED C=CCCCC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 462765909 VABKSONADYMOKN-UHFFFAOYSA-N 326.267 5.056 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3ccccc3)cc2)n1 474443302 COUXNJCDPGVUBZ-GOSISDBHSA-N 346.455 5.424 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC2(CCCC2)C1 475549140 DLEQZSPFXYOWBA-UHFFFAOYSA-N 340.511 5.727 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2[C@H]1C 475559188 NUTDFJWDHBEAGG-MRXNPFEDSA-N 334.463 5.647 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n([C@@H](C)CC)n1 476090822 MSVNJHZBJWSACU-HNNXBMFYSA-N 339.483 5.267 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc2ccccc2n1)c1ccc(F)c(F)c1 480680166 KLGRHTZQTGGUNA-SZNDQCEHSA-N 338.401 5.481 30 20 EKED C=CCC[C@@H](NC(=O)N(C)Cc1cccc2[nH]ccc12)c1ccccc1 494814389 USCNWPAMTYZZIL-HXUWFJFHSA-N 347.462 5.017 30 20 EKED C[C@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccc(C#N)cc1 513004422 NZQOOKPTHKRCMW-NSHDSACASA-N 338.760 5.081 30 20 EKED Cc1ccc([C@@H]2CCCN2c2ccc(C#N)c(C(F)(F)F)c2)s1 513748305 DFIASLNELNTWGB-HNNXBMFYSA-N 336.382 5.289 30 20 EKED C=C(C)COc1cccc(NC(=O)c2cc(Cl)ccc2Cl)c1 524300579 ABCAWHUMOLRKPP-UHFFFAOYSA-N 336.218 5.201 30 20 EKED C=CCC[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccccc1 538256605 ABVDEDNFFNJDGB-IBGZPJMESA-N 336.410 5.278 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 540149469 PNVCWXVCIJXNKT-DNVCBOLYSA-N 348.412 5.767 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccc(Sc2ccccc2)cc1C 574074521 SZWBTUNASZRONZ-HNNXBMFYSA-N 326.465 5.232 30 20 EKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cccc2ccccc12 609669451 MTHUOHGAYXQXTK-LBPRGKRZSA-N 341.336 5.298 30 20 EKED COc1ccc([C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 611438521 AHEUIQSXYYUUCS-SBUREZEXSA-N 342.442 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)[C@H]1CCCCO1 654047736 UWDPNXKQCCBLBX-RBUKOAKNSA-N 344.499 5.008 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 669727327 GPEVFUDLXFBVGA-FQEVSTJZSA-N 334.463 5.420 30 20 EKED C=C(C)[C@H](CO)Sc1nc(-c2ccccc2)c(-c2ccccc2)o1 677132231 YZXUNODILOUXMT-KRWDZBQOSA-N 337.444 5.038 30 20 EKED C=C(C)CCNc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 685199452 WFRSLPFDVPHQSL-UHFFFAOYSA-N 332.806 5.110 30 20 EKED Cn1cc(C(=O)/C=C\c2csc(-c3ccccc3)n2)c2ccccc21 726740761 PJVHEFFLARSFFY-QXMHVHEDSA-N 344.439 5.198 30 20 EKED Cn1cc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)c2ccccc21 727267501 WDGCCPHQZPHALI-QXMHVHEDSA-N 344.439 5.198 30 20 EKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 743445320 OVIUTYGLGHERSJ-UHFFFAOYSA-N 341.383 5.213 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccccc1C(F)(F)F 775654908 RBHDYPVSBLWCHL-CQSZACIVSA-N 346.396 5.357 30 20 EKED CC(C)CCOc1cccc(N[C@H](C)c2ccc(OCC#N)cc2)c1 776887148 VGBHRQAIQSXPDR-QGZVFWFLSA-N 338.451 5.187 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1cccc2cnccc12 782889747 LKSMQZBRFIAGQT-CMDGGOBGSA-N 336.460 5.193 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1ccc(C(F)(F)F)cc1 782889755 LUKZFDIPSWHFTM-RMKNXTFCSA-N 327.305 5.150 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(F)c(Cl)c1 788096953 DHPHJCVAVGXASZ-XQRVVYSFSA-N 333.771 5.092 30 20 EKED CCCCCCCC[S@](=O)Cc1csc(-c2cccs2)n1 790134145 HBAWCPXOWNWZMK-NRFANRHFSA-N 341.567 5.481 30 20 EKED CC(C)(CCC#N)COC(=O)Cc1coc2ccc3ccccc3c12 798877897 NKEHXERHJWNRIG-UHFFFAOYSA-N 335.403 5.002 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211154 FFRBGVJBJHAJSJ-UKRRQHHQSA-N 340.389 5.273 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccccc1Cl 77687474 WKVWKUBBQAULRR-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#CCC[C@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 90666022 JPZGUJJRZSAEGW-PMACEKPBSA-N 332.447 5.068 30 20 EKED CC(C)C[C@H](NCc1ccc(C#N)o1)c1cccc(C(F)(F)F)c1 174336995 VQXSWNCHZLCYOM-KRWDZBQOSA-N 336.357 5.047 30 20 EKED CCN(C(=O)[C@H](C)c1cc2ccccc2o1)[C@@H](C)c1ccc(C#N)cc1 176162077 DAOBUAPZXGDFDY-CVEARBPZSA-N 346.430 5.018 30 20 EKED C=C(C)[C@@H](NCc1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 187791692 BWYQFKZUJMFWFY-HXUWFJFHSA-N 340.373 5.027 30 20 EKED CCCCc1nc(CN[C@@H](CCCC#N)c2ccccc2)cs1 433017625 ZNOSCLNYRJZVKT-SFHVURJKSA-N 327.497 5.010 30 20 EKED C[C@H](CC1CCCCC1)C(=O)N[C@H](CCCC#N)c1ccccc1 487156037 LSYDUUKKMHVRJW-YLJYHZDGSA-N 326.484 5.144 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2sccc2[C@@H]1CC 505016244 DJZNACKTZNAVEX-SFHVURJKSA-N 340.492 5.408 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1OC(F)F 537407290 JRFISVNVAQZWFZ-SJCJKPOMSA-N 348.368 5.101 30 20 EKED N#CCc1ccnc(NCc2ccc(-c3cccc(Cl)c3)s2)c1 545219893 IVIXKGGYZQZDHV-UHFFFAOYSA-N 339.851 5.142 30 20 EKED CC(C)CN(C(=O)c1ccc(C(C)C)s1)c1ccc(C#N)cc1 546859771 SZJVSKKQRHJMSJ-UHFFFAOYSA-N 326.465 5.046 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(Cl)c1Cl 561129787 BCXGBEYYFCXZKZ-QGZVFWFLSA-N 331.246 5.032 30 20 EKED CC[C@](C)(C#N)C(=O)N[C@H](C)c1ccc(-c2ccc(Cl)cc2)s1 567376045 UCSNQFRIWHCJGL-KZULUSFZSA-N 346.883 5.186 30 20 EKED C[C@@H](N[C@H]1CCCc2c1sc1ccccc21)c1cccc(C#N)c1 610829626 BPHSGIQGRZYMTA-KUHUBIRLSA-N 332.472 5.501 30 20 EKED CC(C)c1ccc([C@@H](NCc2ccnc(C#N)c2)c2cccs2)cc1 610956683 PXPJCCPZIYTTAV-OAQYLSRUSA-N 347.487 5.017 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc2nc(C3CC3)oc2c1 611476092 ZHYVQHIYVHRLOX-SFHVURJKSA-N 329.403 5.066 30 20 EKED C=CCCOCC(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 674522501 CXLZKQKCQWLRAO-MRXNPFEDSA-N 341.476 5.071 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(O)c(F)c2)cc1 741468198 UTIGPSHNLJXHQF-WQLSENKSSA-N 348.373 5.103 30 20 EKED Cc1ncsc1/C=C1/CC(C)(C)C/C(=C/c2scnc2C)C1=O 742434117 DVNCXKCFHRKKOK-GFIWHYBVSA-N 344.505 5.073 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1coc2ccccc12 747706327 UPQPZKKJYQVYJA-AATRIKPKSA-N 337.425 5.514 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2csc(-c3ccsc3)n2)c1 763288831 JGGMFGMEVJWSMM-HWKANZROSA-N 329.421 5.215 30 20 EKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1ccc(O)c(Cl)c1 768753545 YHJBPHUXNJZFRP-CMDGGOBGSA-N 341.819 5.065 30 20 EKED CSc1ccc(C(=O)/C=C/c2cccc3cnccc23)c(Cl)c1 782890419 YOKQNWJMCQHSQG-VMPITWQZSA-N 339.847 5.506 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(SC(F)F)cc1 787026654 NFOVLBYFOFRPFE-KZULUSFZSA-N 344.430 5.211 30 20 EKED C=CCC[C@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792099850 ANBOIDDEGGYYOO-LEWJYISDSA-N 340.426 5.161 30 20 EKED CC(=NNc1cccc2ncccc12)c1cc(Cl)ccc1Cl 915964554 CMXTVFVVQWJTAV-UHFFFAOYSA-N 330.218 5.378 30 20 EKED Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 286498929 MFTHBZMUISWCIU-CYBMUJFWSA-N 342.464 5.358 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H]1CCSc2ccccc21 360655865 FFEKVSUXSXFRJB-PMACEKPBSA-N 334.488 5.152 30 20 EKED CCCCCN(C(=O)c1cccc(SCC#N)c1)[C@@H](C)CCC 429828233 FEJBTBCSJKYCIL-INIZCTEOSA-N 332.513 5.123 30 20 EKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C(C)C)C2CCC2)cc1 464966517 YGYUHZBKYKXWDV-UHFFFAOYSA-N 348.446 5.062 30 20 EKED C=CCCC1(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)CC1 475471361 MJKPEHFTESLNOP-QGZVFWFLSA-N 334.463 5.545 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 524882546 YPMYCFKEJDJYFN-UZUQRXQVSA-N 344.433 5.332 30 20 EKED N#CC1(c2ccc(CNc3ccc(COC4CCCC4)cc3)cc2)CC1 594923650 UQGJOFIULMOVOE-UHFFFAOYSA-N 346.474 5.313 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(C)c1 596710127 ICKYBBPCFCZCCV-CVEARBPZSA-N 345.512 5.043 30 20 EKED N#CCCC[C@@H](NCc1csc(C(F)(F)F)c1)c1ccccc1 598981498 YEKVWQXTRVMMKA-OAHLLOKOSA-N 338.398 5.292 30 20 EKED N#Cc1cnc(N2CCC(c3cccc4ccccc34)CC2)c(Cl)c1 608885171 CNRZKPFNVAUYBV-UHFFFAOYSA-N 347.849 5.144 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cccc2ccccc12 609387076 JSEIWCWECRSRCE-DLBZAZTESA-N 346.499 6.265 30 20 EKED C=CC[C@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1ccncc1 766023010 ZEEOVUQTJZNYEX-JTSKRJEESA-N 329.447 5.112 30 20 EKED N#C[C@H](C(=O)C1=CCCCCC1)c1nc2cc(Cl)ccc2s1 773984184 SCHIFKUQLJEMIY-CYBMUJFWSA-N 330.840 5.016 30 20 EKED CCc1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)C(C)C)cc1 776154020 KRRLLUJJBRGSKZ-VGOFRKELSA-N 336.479 5.199 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1sc2ccccc2c1Cl 779741822 DQTAGIQYQIVDQW-GFCCVEGCSA-N 342.851 5.458 30 20 EKED CCCCCCCCC(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1 839856789 KLASEICNDVASMV-OAQYLSRUSA-N 343.511 5.117 30 20 EKED Oc1nc2ccccc2cc1C=Nc1cccc(Nc2ccccc2)c1 912776475 FUMUSIIESMOGQL-UHFFFAOYSA-N 339.398 5.435 30 20 EKED CCCOc1ccc(/C=C/C(=O)c2ccc(F)cc2F)cc1OCC 916128286 UVSPJJMIMRETPE-WEVVVXLNSA-N 346.373 5.048 30 20 EKED CC(C)(NCc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 67011181 JDWSKSQJVCHQJB-UHFFFAOYSA-N 342.870 5.047 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(CCC#N)CC1CC1 78540637 YOHXVQKCJHPXDB-UHFFFAOYSA-N 345.512 5.043 30 20 EKED Cc1ccc2c(c1)OCCC[C@@H]2Nc1cccc(OCCCC#N)c1 179825169 CKVMGOYJEDCJJK-FQEVSTJZSA-N 336.435 5.003 30 20 EKED CC(C)c1cnc(CNCc2ccc(-c3ccccc3C#N)cc2)s1 184094118 ANGMLVDHVWOVFN-UHFFFAOYSA-N 347.487 5.095 30 20 EKED C[C@H](S[C@H](C)c1nc(Cc2ccccc2)no1)c1cccc(C#N)c1 190891385 CLTCJNMPJXVIBB-LSDHHAIUSA-N 349.459 5.087 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCCC[C@H]1C 246207051 AEGXNIRHAVQKHB-BFYDXBDKSA-N 345.512 5.123 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2ccc(Cl)cc2)o1 277504619 DWHNGQGSGYGXNE-UHFFFAOYSA-N 335.860 5.202 30 20 EKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CCCCC1 303191143 MCYGWTMNHTUDEE-UHFFFAOYSA-N 348.446 5.145 30 20 EKED CCc1ccc2c(c1)[C@@H](CC/N=C(/O)CC1CCCCC1)C(O)=N2 328766961 PRKOVAAQSVRBJR-MRXNPFEDSA-N 328.456 5.251 30 20 EKED N#CCCC[C@H](N[C@H]1CCCc2c(Cl)cccc21)c1ccccc1 340431032 BOCZPGWNIVJUQE-SFTDATJTSA-N 338.882 5.742 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@@H](N[C@H](CCCC#N)c2ccccc2)C1 340439007 BFBGEINYRUACAC-YPAWHYETSA-N 347.506 5.441 30 20 EKED C[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)c(F)c1 427884501 IQEUSFHHEWFAJC-GHMZBOCLSA-N 337.225 5.416 30 20 EKED N#C[C@@H]1CC[C@H](N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)C1 429696286 IKMRMHMZPZLGTF-PBHICJAKSA-N 335.278 5.165 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(C#N)cc1 447586626 OLZYLOGYYCIAHH-UGSOOPFHSA-N 348.368 5.259 30 20 EKED CC[C@H](Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(C#N)cc1 447590938 BALWYBJLOBRVES-FQEVSTJZSA-N 331.419 5.393 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(-c2ncc(C)o2)c1)c1ccccc1 488315601 OQIWRIUTANUWCS-FQEVSTJZSA-N 346.430 5.339 30 20 EKED C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 497385940 HIVAWTYFSXYEHQ-WZUUISITSA-N 345.446 5.023 30 20 EKED CC[C@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)CC(C)C 499537900 KILUQGCPKDUDFV-OAQYLSRUSA-N 342.527 5.196 30 20 EKED Cc1nc(SCCCCC#N)c2cc(-c3ccccc3)sc2n1 514586500 NWAMGMOABYEFIM-UHFFFAOYSA-N 339.489 5.453 30 20 EKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518255925 KANVQTGXNAQYIB-FQEVSTJZSA-N 349.434 5.003 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(CC#N)cc3)co2)cc1 543154161 VDCRXFJOEXXQCQ-UHFFFAOYSA-N 334.444 5.150 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(Br)cn1)c1ccccc1 568702100 PWJYYPHPOBORKP-KDOFPFPSSA-N 345.284 5.202 30 20 EKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C2CCC2)cc1 581880946 MVHKAXRSMOKWET-OAHLLOKOSA-N 333.435 5.051 30 20 EKED C[C@H](Nc1ccc(NC(=O)CCCCCC#N)cc1)c1ccccc1 588304092 PCHKWFMBKZSZIR-KRWDZBQOSA-N 335.451 5.272 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)s1 609407971 KLAVFNTUEKXDPB-RTBURBONSA-N 346.455 5.078 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@]3(C#N)CCC[C@@H](C)C3)sc2c1 609736837 RDUZLZSSRHOUCN-KZULUSFZSA-N 346.883 5.065 30 20 EKED Cc1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1 731321759 RNIPMCGVCSJVMB-CQSZACIVSA-N 341.505 5.198 30 20 EKED C=CCN(C(=S)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 745992615 TUUDGZWUPVBBAA-UHFFFAOYSA-N 337.275 5.383 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCCc3occc32)cc1 764881061 QSLSZZOXCDEWAI-KBXCAEBGSA-N 331.843 5.139 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1O 775513123 NVYOLURGBGYYEM-MEDUHNTESA-N 349.261 5.373 30 20 EKED C[C@@H](C#N)OCCSCc1cccc(SCc2ccccc2)c1 808368149 URCNOILKOHUTAA-INIZCTEOSA-N 343.517 5.141 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1c(F)cccc1Cl 809159182 KASSEQNLNUGZGT-SREVYHEPSA-N 349.839 5.560 30 20 EKED Cc1ccc(CNc2ccccc2S[C@@H](C)CC#N)c(Cl)n1 841695928 XUILWYMQERHWSK-ZDUSSCGKSA-N 331.872 5.050 30 20 EKED CC(C)(C)[C@H]1CCc2sc(C(=O)Nc3sccc3C#N)cc2C1 908091518 FVBFVEGERLDSLZ-ZDUSSCGKSA-N 344.505 5.085 30 20 EKED N#CCCCCOC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 914617979 LLOLFRLZQZQTLR-UHFFFAOYSA-N 347.336 5.223 30 20 EKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)s1 917142922 DZPBEWKCWYNIHS-SREVYHEPSA-N 341.413 5.281 30 20 EKED CCC[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 185223456 XLUHYFYPDSIJBU-CVEARBPZSA-N 345.512 5.267 30 20 EKED CCO[C@H](C)c1nc(CS[C@@H](C)c2cccc(C#N)c2)cs1 190801797 FKQRJFZLPFDYQL-OLZOCXBDSA-N 332.494 5.107 30 20 EKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/C2CCC3(CC2)CC3)CC1 329908846 UOXRJNYPHJXKKR-UHFFFAOYSA-N 334.504 5.227 30 20 EKED C=CCC[C@@H](NC(=O)C[C@H](C)c1ccccc1OC)c1ccccc1 435300147 FRSYZPBAIUVUMG-FXAWDEMLSA-N 337.463 5.013 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1C(C)(F)F 455770772 LIWTWERTHACKLG-UHFFFAOYSA-N 344.405 5.409 30 20 EKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)[C@H](C)c1cccc(C#N)c1 462152221 ARMUCCJGCRFXTC-MSOLQXFVSA-N 346.474 5.052 30 20 EKED CCN(c1ccccc1)c1ccc(CNCC(C)(C)CCC#N)cc1 462734397 ARIXLFVHXNXQHI-UHFFFAOYSA-N 335.495 5.264 30 20 EKED CC[C@@H](CC#N)NC(=O)Nc1cccc(CSC2CCCCC2)c1 475012872 KNSQREGKLLAMEJ-INIZCTEOSA-N 345.512 5.066 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(SC)ccc1C 486435928 POEAOEWFVVNWMG-UHFFFAOYSA-N 329.490 5.247 30 20 EKED C=CCC[C@@H](C(=O)Nc1cc(-c2ncco2)ccc1C)c1ccccc1 489623138 VNKVJZFPIXRKQG-LJQANCHMSA-N 346.430 5.339 30 20 EKED CCN(Cc1ccccc1C(F)(F)F)[C@H](C)c1ccc(C#N)cc1 497619314 RUVNMJCQHPQXHU-CQSZACIVSA-N 332.369 5.160 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1cccs1)C(C)C 505016633 KDBFDEOFEKLMLX-UHFFFAOYSA-N 328.481 5.309 30 20 EKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1F 512664581 AIPUHSIEWPAWSI-BUXKBTBVSA-N 328.818 5.153 30 20 EKED N#Cc1ccc(CN[C@H](c2cccc(Cl)c2)C2CCCC2)s1 540622048 CKRRIDTZOBNMGH-SFHVURJKSA-N 330.884 5.294 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(C(F)F)c2Cl)c1 556984897 UNQBEMOXGVCLEU-UHFFFAOYSA-N 341.144 5.055 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C3CCCC3)cc2)n1 558549211 IUSSOOOJVKPLBB-KRWDZBQOSA-N 338.476 5.414 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)CCCCCC#N)C1CC1 588892645 ACOWYHWMMHDXHM-KRWDZBQOSA-N 334.463 5.366 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)ccc3C)n2)cc1 612894679 HMGPWGYZONTTJK-GOSISDBHSA-N 346.455 5.225 30 20 EKED C#Cc1cccc(N(C(=S)Nc2cccc(C(C)C)c2)C(C)C)c1 728227061 UWYXDRKIGAYBJY-UHFFFAOYSA-N 336.504 5.403 30 20 EKED C[C@@H](OC(=O)C1(C#N)CCCC1)c1ccc(Cl)c(C(F)(F)F)c1 759587007 XZLZGDXHGUGZED-SNVBAGLBSA-N 345.748 5.047 30 20 EKED C=C[C@@H](CC(=O)Oc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 759910579 KOTJKNFPYRUFCJ-KRWDZBQOSA-N 347.414 5.224 30 20 EKED CC[C@H](Nc1cc(F)c(OC(C)C)c(F)c1)c1ccc(C#N)cc1 774355349 RLLRWCANRUNEMC-SFHVURJKSA-N 330.378 5.187 30 20 EKED CCOc1cc(/C=C\C(=O)c2csc(Cl)c2)cc(Cl)c1O 787185845 JMTFSHDVWSRBFR-ARJAWSKDSA-N 343.231 5.055 30 20 EKED C[C@H](OC(=O)CCCCCC#N)c1cc(Cl)ccc1OC(F)F 805891936 HSBDUKNYZPDLKX-NSHDSACASA-N 345.773 5.020 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(N)cc1 916539615 ACXNFPGWSXYMCA-UHFFFAOYSA-N 328.630 5.065 30 20 EKED CCCC[C@H](CC)CNC(=O)Nc1ccccc1SC[C@H](C)C#N 78573355 PBVWNJIQLSTJMX-CVEARBPZSA-N 347.528 5.276 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 410348426 JQCUGMMMRRAKPW-HUUCEWRRSA-N 325.374 5.112 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C)CCC#N 411526243 DCZRISJURNDLQC-VXGBXAGGSA-N 333.888 5.115 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(COC(C)(C)CC)c2C)CC1 428768767 VTXAQKTVLONOPY-UHFFFAOYSA-N 344.499 5.130 30 20 EKED Cc1c(CNCc2ccc(C#N)cc2F)sc2ccc(Cl)cc12 441362953 VTXYCCYKSPGODO-UHFFFAOYSA-N 344.842 5.164 30 20 EKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3ccccn3)o2)cc1 442641846 BARYABPCEAHKPH-QGZVFWFLSA-N 344.414 5.129 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(C#N)cc1 447586624 OLZYLOGYYCIAHH-FZKQIMNGSA-N 348.368 5.259 30 20 EKED C=C(C)C[C@H](C)C(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 464558354 GEZNLVSYAIMTON-UONOGXRCSA-N 327.390 5.217 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 466873489 QFGYZNSINGNSMF-WMLDXEAASA-N 339.401 5.361 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480673658 SBUMZDOJLIKNIM-DJJJIMSYSA-N 346.377 5.149 30 20 EKED C[C@@H](NCc1ccncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 543869730 CRSNJEQMJGBFEU-OAHLLOKOSA-N 347.849 5.124 30 20 EKED Cc1ccccc1CN(CCCCC(C)(C)C#N)Cc1ccccn1 563216822 LMTRZENBJHCZQS-UHFFFAOYSA-N 335.495 5.112 30 20 EKED N#CCCC[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccccc1 566046743 MPOQCYIRGWZRQD-LJQANCHMSA-N 349.409 5.005 30 20 EKED CC(C)Oc1cccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)c1 611390963 XPKGQHSVTXIRNO-OPAMFIHVSA-N 334.463 5.074 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccc(O)c3)s2)cc1 727654610 OMADWGDZAOAGGZ-FLIBITNWSA-N 335.428 5.029 30 20 EKED CC(=NNc1cccc2ccccc12)c1c(Cl)nc2sccn12 741839219 CIMXCWZGDZIICH-UHFFFAOYSA-N 340.839 5.039 30 20 EKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1c[nH]c2ccccc12 741844822 UGNBTYHRNWDMRY-MDZDMXLPSA-N 345.320 5.005 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 744037706 CCYYXIFULJZTFA-KGLIPLIRSA-N 347.409 5.214 30 20 EKED C=C(C)[C@H](NCc1nc(Cl)ccc1Cl)c1ccc(F)c(F)c1 775725674 WYLRVWFQDRGGCO-INIZCTEOSA-N 343.204 5.074 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1csc(Cl)c1 787185548 CZUHADMTXNUDKH-OWOJBTEDSA-N 337.878 5.483 30 20 EKED COc1ccc(-c2nc(/C=C3\CCc4ccccc4C3=O)cs2)cc1 796983478 GSEVLXWFKXXNES-FOWTUZBSSA-N 347.439 5.031 30 20 EKED CC(/C=C\C(=O)c1ccnc(F)c1)=C\c1cccc(C(F)(F)F)c1 806574405 ONXAUAHCQHPINH-ZCRLHDOISA-N 335.300 5.082 30 20 EKED N#CC1(CSc2nnc(-c3cccc4ccccc34)o2)CCCC1 806589233 BETXGRIXISFOGN-UHFFFAOYSA-N 335.432 5.066 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC(C)(C)C3CC3)n2)cc1 815911129 RYVQRFKGNXQFLT-INIZCTEOSA-N 338.476 5.121 30 20 EKED CC[C@@H](C#N)[C@@H](OC(=O)c1sccc1C(F)F)c1cccs1 873550519 CGNJZNXZFJGJCN-JOYOIKCWSA-N 341.404 5.195 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(F)(F)F)ccn1 890165739 MEATZECACLJNFN-UHFFFAOYSA-N 348.368 5.205 30 20 EKED CC(C)[C@H](N[C@@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902785226 CABRTXLQGQZCEM-UGSOOPFHSA-N 347.384 5.020 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1sccc1Br 915114050 ANBULAIZSOUUOT-IWQZZHSRSA-N 333.659 5.122 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cc(F)c(C(=O)O)cc2F)cc1 1776699956 KFYOJMSXPAEQBT-JLVNDZCYSA-N 344.357 5.073 30 20 EKED CCCCCCCOc1cccc(CN[C@](C)(CCCC)C(=O)O)c1 1776787924 GHTFYXPBDVLWQK-OAQYLSRUSA-N 349.515 5.159 30 20 EKED CC(C)c1sc(NC(=O)c2cccc(C#N)c2)nc1-c1ccccc1 32742997 YIMYUJHZDYREMW-UHFFFAOYSA-N 347.443 5.057 30 20 EKED CCCCn1c(SCCCC#N)nc2cc(C(F)(F)F)ccc21 61427423 UPRFMCCMMFQSLJ-UHFFFAOYSA-N 341.402 5.251 30 20 EKED CCC(CC)CN(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108528830 DRUFJVMPFCOOQQ-HNNXBMFYSA-N 347.528 5.228 30 20 EKED N#C[C@H](Sc1nnc(-c2cc3ccccc3o2)o1)C1CCCCC1 176798578 XOCVUXLTYIJYMB-INIZCTEOSA-N 339.420 5.047 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccccc1CC 189892806 XBBPNMWNKKCKFL-UHFFFAOYSA-N 337.463 5.118 30 20 EKED N=C(O)[C@@H]1CCC[C@@H](C(O)=Nc2ncc(C3CCCCC3)s2)C1 329971550 XSFQDAGUYHOMLD-CHWSQXEVSA-N 335.473 5.120 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 430601555 DHLNNUKXBKRNRY-NSHDSACASA-N 332.494 5.116 30 20 EKED C=CCCN(C)C(=O)Nc1ccccc1Oc1ccccc1Cl 466371614 AZPGMTLJPFUFTB-UHFFFAOYSA-N 330.815 5.172 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(-c2ccccc2OC)cc1 466659316 YDIIJWWNSGPQBK-DLBZAZTESA-N 337.463 5.142 30 20 EKED C/C=C\c1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 497385907 HIVAWTYFSXYEHQ-CWHLVPTKSA-N 345.446 5.023 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H](C)Cc1cncc2ccccc12 510138648 FZASPBNIDNBSGO-QGZVFWFLSA-N 344.458 5.171 30 20 EKED C=CCCCCS[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F 591400991 IKEGUEFSVJDMQQ-LBPRGKRZSA-N 331.403 5.122 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H](C)CC(C)(C)C 609377887 QJVNXHUBDVWQOY-LSDHHAIUSA-N 332.513 5.339 30 20 EKED C=CCC(CC=C)C(=O)N(C)c1ccc(Cl)c(C(F)(F)F)c1 685248117 QYUVVCJDUNVNHS-UHFFFAOYSA-N 331.765 5.090 30 20 EKED C#Cc1cccc(NC(=O)N[C@H](C)c2ccc(SC(C)C)cc2)c1 729033889 VMYYJIPAUUFJCT-OAHLLOKOSA-N 338.476 5.051 30 20 EKED CCOc1ccc(C=Nc2cccc(C3SCCS3)c2)c(O)c1 743334474 YKWFVKAIYPJNDC-UHFFFAOYSA-N 345.489 5.020 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=S)Nc1cccc(C(C)C)c1 745019124 LMMJVNQCJRXAHP-UHFFFAOYSA-N 349.503 5.067 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1ccc(N2CCCCC2)cc1 772798269 UGEVNJWPRBGCER-RAXLEYEMSA-N 342.442 5.121 30 20 EKED C=C(C)[C@H](NC(=S)Nc1cccc(C)c1C)c1ccc(F)c(F)c1 774203463 CILVKDLCYUFIEA-SFHVURJKSA-N 346.446 5.185 30 20 EKED CC(C)Oc1ccccc1C=NOCc1ccccc1C(F)(F)F 836498311 NGCSRDDMIVMBMM-UHFFFAOYSA-N 337.341 5.043 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCO2 850471895 UFGIIANDTDEHNS-UWJYYQICSA-N 334.463 5.097 30 20 EKED Cc1ccc(-c2nnc(SCCCCC3(C#N)CCC3)o2)cc1 901403916 SHGYOAMVHLAKTM-UHFFFAOYSA-N 327.453 5.001 30 20 EKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3ccccc3)cc2)s1 917880472 FOZLOULMNZBUDO-UHFFFAOYSA-N 332.428 5.101 30 20 EKED Cc1cc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c(C)s1 1776133379 VJWXXRCJJSCTRO-HYXAFXHYSA-N 342.441 5.174 30 20 EKED CCCCCCCCSc1nnc(-c2ccncc2)n1C1CC1 60296539 KFMIDSYQYMJOLR-UHFFFAOYSA-N 330.501 5.128 30 20 EKED C=CCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OC)cc1 60364750 LMIPBRJOQRXKPR-UHFFFAOYSA-N 331.799 5.046 30 20 EKED C=CCN(Cc1csc(-c2ccc(C)o2)n1)Cc1ccccc1F 71996775 YLUZKNOCMBZIJI-UHFFFAOYSA-N 342.439 5.039 30 20 EKED C[C@H](c1ccccc1)N(Cc1cccc(C#N)c1)Cc1ccccc1O 216487282 FYSKSXOVVBBKGT-GOSISDBHSA-N 342.442 5.027 30 20 EKED Cc1c(C(=O)N[C@@]2(C#N)CCC[C@H](C)C2)oc2c1ccc1ccccc12 303638803 HJMSQAXXGXQHGM-FPTDNZKUSA-N 346.430 5.097 30 20 EKED Cc1c(C(=O)N[C@@]2(C#N)CCC[C@@H](C)C2)oc2c1ccc1ccccc12 303638808 HJMSQAXXGXQHGM-PEBXRYMYSA-N 346.430 5.097 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(C)c1C1CCC1 349563400 OGJRXWSOIMJRBY-UHFFFAOYSA-N 336.479 5.397 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 358329127 OEEBOPUFPBLQEU-JPYJTQIMSA-N 341.458 5.444 30 20 EKED C[C@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 429760973 AAEDZOCVJMUKAQ-YJBOKZPZSA-N 349.434 5.003 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2CCC2)cc1Cl 463391030 JWYPKFRCBGYMCB-SFHVURJKSA-N 338.838 5.124 30 20 EKED C[C@@H](c1cccs1)N(CCCC(C)(C)C#N)Cc1ccccc1 472440236 QFVMHVXMHVZGQT-KRWDZBQOSA-N 326.509 5.641 30 20 EKED N#CC[C@@H](CC(=O)N[C@@H](c1ccccc1)C1CCCC1)c1ccccc1 475028987 HOVMCBHVVMPRFZ-GMAHTHKFSA-N 346.474 5.122 30 20 EKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 480549893 FRZQZUXSQOXJSA-MGPUTAFESA-N 349.434 5.003 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OC)c(F)c1)c1ccc(F)c(F)c1 480682335 NZWIONQIPKKHCI-HXPMCKFVSA-N 335.369 5.081 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCC(C)(C)CCC#N)s2)cc1 515343990 OAEWWKPYYAREME-OAHLLOKOSA-N 341.524 5.408 30 20 EKED CCc1ccc([C@H](C)CC(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1 523111255 IBFZWOABKBGRMD-QZTJIDSGSA-N 348.490 5.224 30 20 EKED C[C@@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccc(C#N)cc1 531695882 QDOXIOUDQVLONO-IAGOWNOFSA-N 327.431 5.032 30 20 EKED C[C@@H](N[C@@H](COc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 539510969 QPVWTZRWXWBZFW-JPYJTQIMSA-N 342.442 5.029 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCCc2nc(-c3ccccc3)sc21 558235415 JKDKOXWBVPMZEL-INIZCTEOSA-N 339.508 5.107 30 20 EKED COc1ccc([C@H](C)[C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 563671530 YWNOZGHCXQWQJZ-FGSXEWAUSA-N 336.479 5.212 30 20 EKED C[C@H](Sc1cccc(C#N)c1)c1nc2ccccc2n1C(F)F 570181858 FIESNKRQNUDZCR-NSHDSACASA-N 329.375 5.156 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H](Cc1ccccc1)c1cccs1)CC2 575841199 SRZDVCCMXVWGFM-LEWJYISDSA-N 344.483 5.181 30 20 EKED CC(=NNc1ccc(C)cn1)c1ccc2c(c1)Nc1ccccc1S2 727259611 IDZYENBAHWLVIZ-UHFFFAOYSA-N 346.459 5.434 30 20 EKED Cc1ccc(-c2nc(/C=C3\CCOc4ccccc4C3=O)cs2)cc1 728441405 JLYZLYVZHURYEL-FOWTUZBSSA-N 347.439 5.167 30 20 EKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1cccc(F)c1 735318305 KDNGTDUHFBEWJW-LBPRGKRZSA-N 335.831 5.376 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc(OC(F)F)cc1 742437555 VJYNIFDAGXUKIL-ITTMYVLYSA-N 338.400 5.110 30 20 EKED N#CCCCOc1cccc(/C=C2\C(=O)c3cccc4c3[C@@H]2CCC4)c1 763291479 XPPQNARCIBISOS-CBAAQYGVSA-N 343.426 5.069 30 20 EKED Clc1cc(Cl)c(NN=Cc2scnc2C2CC2)c(Cl)c1 782097646 LRNYRJQVTCQDEJ-UHFFFAOYSA-N 346.670 5.427 30 20 EKED C[C@H](NCc1ccc(Cl)nc1)c1ccc(-c2cccc(C#N)c2)cc1 782382153 QGHRSATUCKEGTL-HNNXBMFYSA-N 347.849 5.124 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1cnn(C2CCCC2)c1 799896251 DZMAEJGFXGAICV-KHPPLWFESA-N 349.459 5.018 30 20 EKED COc1c(O)cccc1/C=C/C(=O)c1ccc(-c2cccs2)cc1 818260521 HUKLIYUXPOIMKW-VAWYXSNFSA-N 336.412 5.025 30 20 EKED CCCCCCCCC(=O)Nc1cc(NC(=O)C2CC2)ccc1C 915650456 GUXHCMWBJOXPFR-UHFFFAOYSA-N 330.472 5.033 30 20 EKED CCC(=NNc1nncc2ccccc12)c1ccc(Cl)cc1Cl 915909957 WWWRNIPCADICAN-UHFFFAOYSA-N 345.233 5.163 30 20 EKED Cc1sc(NC(=O)Cc2ccc(-c3ccccc3)cc2)c(C#N)c1C 14595994 MJRGRVXHDURWND-UHFFFAOYSA-N 346.455 5.085 30 20 EKED C=CCCC(=O)N(Cc1cccc(F)c1)[C@@H](CC)c1ccc(F)cc1 60365035 GXBOPBMOSZJJOG-FQEVSTJZSA-N 343.417 5.411 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)CCCC(C)(C)C#N 119472655 CLOJGSKKNOPOGJ-INIZCTEOSA-N 341.524 5.441 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1 173990890 XROZWPNIHDXZGE-HUUCEWRRSA-N 347.487 5.402 30 20 EKED C[C@@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(OCC#N)cc1 181623219 XBJQNQPSPNJGED-VGOFRKELSA-N 334.463 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(C(C)(C)C)c1 191426525 XOEJXIJDRQYSBZ-UHFFFAOYSA-N 340.471 5.134 30 20 EKED C[C@H]1C(=O)CC[C@H](C(O)=Nc2ccc3c(Cl)cccc3n2)C1(C)C 329335990 XWSMIDCTJNVLQX-WCQYABFASA-N 344.842 5.118 30 20 EKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2s1 475753171 GQYYKDFQDLJJGP-AWEZNQCLSA-N 348.471 5.193 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCSc2ccccc21)c1ccc(F)c(F)c1 480670023 VXUJMPMIVYVUBM-IEBWSBKVSA-N 331.431 5.409 30 20 EKED C=C(C)[C@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480692036 FKNYLEDFKJXSIK-OALUTQOASA-N 346.377 5.231 30 20 EKED CCN(C(=O)C[C@@H](C)C1CCCCC1)[C@@H](C)c1ccc(C#N)cc1 508941056 HBKQWMQZXXSUQF-SJORKVTESA-N 326.484 5.074 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 537165021 BGONGCGMDPSEMM-UHFFFAOYSA-N 349.780 5.060 30 20 EKED C[C@@H]1C[C@@H]1[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 564426564 CPQQNVSKNCQWLH-MNSWYVGCSA-N 336.866 5.186 30 20 EKED C=CCOc1ccc(CN[C@H](c2cccnc2)C2CCCCC2)cc1 590798488 YTQUMJCMFUAVAJ-QFIPXVFZSA-N 336.479 5.058 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3ccc(F)c(C#N)c3)sc2c1 609149696 WFWPJFVWOSJQOH-UHFFFAOYSA-N 344.798 5.126 30 20 EKED COc1ccc2cc([C@@H](C)N[C@H]3CCc4cc(C#N)ccc43)ccc2c1 618801812 BDDGLSVELKVGCQ-CMJOXMDJSA-N 342.442 5.058 30 20 EKED C[C@H](Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc(C#N)cc1 743465710 QJPFMCGRVMDGOZ-HNNXBMFYSA-N 334.419 5.163 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 766022910 YRVQUXMLVXTMAK-FDDCHVKYSA-N 344.458 5.842 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(F)nc2C)cc1 782340320 AQZVPZAZFHUFKH-QBFSEMIESA-N 347.389 5.101 30 20 EKED CC(CCCC(F)(F)F)=NNc1ccc(C#N)cc1C(F)(F)F 799491386 FGCDSUSGAIRJLP-UHFFFAOYSA-N 337.267 5.097 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2CCC[C@@H]2c2ccccc2)n1 835201795 ZOUUUSXQRHPEAD-IXDOHACOSA-N 338.476 5.027 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1O 841755542 IUHYZOLVYNMQMZ-RDTXWAMCSA-N 328.843 5.131 30 20 EKED CC(C)=CCC[C@@H](C)CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 842803016 LOAXFLGYXRLFQT-HIFRSBDPSA-N 338.373 5.049 30 20 EKED CCSc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1 1776950922 OIKUGHLBODGSHP-JXMROGBWSA-N 340.444 5.010 30 20 EKED C[C@@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(OCC#N)cc1 179960116 VYXNYDJMFQNZOX-GOSISDBHSA-N 349.478 5.142 30 20 EKED CCN(Cc1cccc(C#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 195732726 PMWNRFVDUXXTPR-CQSZACIVSA-N 332.369 5.160 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1F 303436998 ABOZSNFPCQYYMR-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C/N=C(/O)c1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c(Cl)c1 329630532 HWTGQDPAXKIWRU-NWANDNLSSA-N 348.874 5.469 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1cccc(C(F)(F)F)c1 410366471 QRIQXTSINVXAGD-UHFFFAOYSA-N 333.353 5.005 30 20 EKED C=CCC[C@H](NC(=O)N(C1CC1)[C@@H](C)c1ccco1)c1ccccc1 435760195 KGRBUCXUJLGHOR-LPHOPBHVSA-N 338.451 5.222 30 20 EKED Cc1cc(Cl)c(NC(=O)N(CCC#N)CCC(C)C)cc1Cl 443940900 JCWLMRIYFHZVRN-UHFFFAOYSA-N 342.270 5.096 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(COCc2ccccc2)cc1 467359675 TYMJKBJHFNYRTJ-UHFFFAOYSA-N 335.447 5.110 30 20 EKED C=CCC[C@@H](N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 467737635 MFZCXLRPOXEOGJ-TZMCWYRMSA-N 340.414 5.520 30 20 EKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C(C)(C)C1 472706316 CJUTWZQCGWOPPT-OAHLLOKOSA-N 349.434 5.003 30 20 EKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1c(Cl)cccc1Cl 483852276 DMNVLSTYEHKDNU-AWEZNQCLSA-N 347.245 5.044 30 20 EKED N#Cc1ccsc1NC(=O)CC1(CCc2ccccc2)CCCC1 497543197 RLJQGXPXDCAQKX-UHFFFAOYSA-N 338.476 5.142 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(C#N)cc1F 520174218 ZBMFHOQGXCQDSN-NSHDSACASA-N 337.225 5.197 30 20 EKED Cc1ccccc1-c1ccc(CN(CCCCC#N)C(C)C)s1 524112925 MRDWCIZTNWBTBF-UHFFFAOYSA-N 326.509 5.628 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C)CC1 524151817 ZPODWNCZVAFTSE-HNNXBMFYSA-N 332.513 5.316 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccccc3F)n2)c(F)c1 524987865 RIDBVQAEQKSYLJ-UHFFFAOYSA-N 344.411 5.252 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cc(OC)c(OC)cc1F)c1ccccc1 539045907 BZHWAQXFUVLGEO-DNVCBOLYSA-N 343.442 5.201 30 20 EKED Cc1cc2cc([C@@H](C)N[C@H](CCC#N)c3ccccc3)oc2cc1C 540149568 VTPRHHTZRDXLPQ-YLJYHZDGSA-N 332.447 5.745 30 20 EKED C[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 541111432 QRPQMYPDAZIAQN-QGZVFWFLSA-N 341.414 5.167 30 20 EKED Cc1nc(C)c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542014981 DFSRNYDLWXBZJQ-AWEZNQCLSA-N 347.487 5.149 30 20 EKED Cc1cc(C)c(-c2nnc(SCc3ccc(CC#N)cc3)o2)c(C)c1 542212689 JIOVKGVEMZAWPS-UHFFFAOYSA-N 349.459 5.020 30 20 EKED C=C(C)COc1cccc(NC(=O)c2scnc2C2CCCC2)c1 544712284 WBLQEGZHYYWPBP-UHFFFAOYSA-N 342.464 5.008 30 20 EKED CCCC(C)(C)N(Cc1cccs1)C(=O)c1ccc(CC#N)cc1 549021968 NVQPWJIJMTVUGM-UHFFFAOYSA-N 340.492 5.035 30 20 EKED CC[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(Cl)s1 594927708 XSMLVEGLCPZKRB-HNNXBMFYSA-N 330.884 5.198 30 20 EKED CCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@H](CC)c1ccccc1 610356851 BAEVREWCIFTCFB-LAUBAEHRSA-N 349.478 5.192 30 20 EKED Cc1ccc(Cl)cc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611093304 WXJSGCSKULJUBO-UHFFFAOYSA-N 339.609 5.079 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)c(Cl)c1 618807788 WQZBKRICOVGLPJ-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2ccccc2c1 727222738 ZFZYGMHOGNGYHA-UHFFFAOYSA-N 343.430 5.154 30 20 EKED COc1cccc(-c2nc(/C=C/C(=O)c3sccc3C)cs2)c1 733748600 DNYBPYYSNJFPKC-VOTSOKGWSA-N 341.457 5.085 30 20 EKED COc1ccccc1-c1ccc(/C=C2\COc3ccccc3C2=O)cc1 741468166 FZIDFMDZPWCEMY-NBVRZTHBSA-N 342.394 5.021 30 20 EKED CCCCCCN(Cc1ccc(C)o1)C(=O)Nc1cccc(C#N)c1 746376672 LGIWYVXIHBVFLF-UHFFFAOYSA-N 339.439 5.074 30 20 EKED FC(F)(F)c1cccc(C=NOc2ccccc2C(F)(F)F)c1 754712218 GPHUOFJXUGAHMJ-UHFFFAOYSA-N 333.231 5.137 30 20 EKED C=C(C)[C@H](NC(=S)Nc1cc(C)ccc1C)c1ccc(F)c(F)c1 774205633 LYWDZQJIVOQKRL-SFHVURJKSA-N 346.446 5.185 30 20 EKED Cc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(OCC#N)cc1 776159231 WCAFFJLKNOZROF-AVRDEDQJSA-N 336.479 5.335 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccnn2C(C)C)cc1 794942879 RNDZANAOSJBILS-SEYXRHQNSA-N 346.430 5.036 30 20 EKED C=CCC[C@H](Nc1ccc(O[C@H]2CCCC[C@H]2O)cc1)c1ccco1 796895327 BSVGOJFUZBCDIC-ZVDOUQERSA-N 341.451 5.081 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2csc3cc(C)ccc23)cc1 797714495 CJTUBSRNWGTSOB-UHFFFAOYSA-N 334.444 5.079 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cc(Cl)ccc1Cl 921262771 YYEPGVYSEJGSFV-KTAJNNJTSA-N 327.594 5.249 30 20 EKED C[C@@H](Sc1nnc(-c2cccc(Cl)c2)o1)c1ccc(C#N)cc1 118173610 ZVVLPCYTERTVRM-LLVKDONJSA-N 341.823 5.115 30 20 EKED CC(C)Oc1c(Cl)cccc1NCc1ccc(O[C@H](C)C#N)cc1 118452293 KPPDBWVHJOCHKV-CQSZACIVSA-N 344.842 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccccn1 191441058 QLRSYDVVZLPMBX-INIZCTEOSA-N 337.467 5.158 30 20 EKED OC(=Nc1cccc(C/N=C(/O)C[C@H]2C[C@H]3CC[C@H]2C3)c1)C1CCC1 329537071 MCROUURRENKPJW-JCGIZDLHSA-N 340.467 5.358 30 20 EKED Cc1sc([C@H](C)N[C@H](C)CCC#N)nc1-c1ccc(Cl)cc1 411545345 WYOHAXMXRSAKPB-NEPJUHHUSA-N 333.888 5.115 30 20 EKED Cc1c(C(=O)Nc2ccc(Cl)cc2F)sc2ccc(C#N)cc12 429923391 KGDGYLMVBQWWEU-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CC(C)(C#N)CCCCN[C@H](COc1ccccc1)c1ccccc1 444690620 UTPBHTAMZRGRHT-OAQYLSRUSA-N 336.479 5.116 30 20 EKED CC[C@@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1 447573776 JHBZNNSUNYCLJX-MRXNPFEDSA-N 338.501 5.512 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCCCC[C@H]1c1ccccc1 476743989 VYFOOSXYQHDYMH-FQEVSTJZSA-N 333.435 5.016 30 20 EKED N#Cc1ccc(CNc2ccccc2COCc2ccccc2)cc1F 479462830 RLUYLHAUFLSZAU-UHFFFAOYSA-N 346.405 5.026 30 20 EKED N#Cc1ccc(NC(=O)Nc2csc3ccccc23)c(Cl)c1 493921291 UXLDWENXYDJEHX-UHFFFAOYSA-N 327.796 5.070 30 20 EKED Cc1sc(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)c(C#N)c1C 503132307 CAAGYWRVORNVIR-MSOLQXFVSA-N 346.455 5.132 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](C)CCCC(F)(F)F 505058179 QPZXZOLLXOBTKG-ZDUSSCGKSA-N 328.378 5.048 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccs1 541133935 MGJBLDCUACVEDB-CVEARBPZSA-N 332.472 5.699 30 20 EKED CSC[C@@H](NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 554079527 VXRRGHIOGPGBJJ-OAHLLOKOSA-N 344.446 5.029 30 20 EKED Cc1cnc(N[C@H](CCC#N)c2ccccc2)nc1-c1ccccc1F 555169128 CLLDZUJVCDOVNZ-LJQANCHMSA-N 346.409 5.048 30 20 EKED N#CCc1ccc(CN[C@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 599051167 GXCQSJXGKJBOFQ-FQEVSTJZSA-N 349.865 5.055 30 20 EKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCC(C)(C)C)cc1 729070379 UUIGWUMDPGFKOM-QAPCUYQASA-N 342.483 5.064 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)CC(C)(C)C 730421777 PKGQLNZTZCPYAX-AAEUAGOBSA-N 332.444 5.074 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1Cl 739422866 ZXWYEPGCIRGMHW-UHFFFAOYSA-N 348.155 5.243 30 20 EKED CC(C)C[C@H](C)N(C(=O)c1ccc(C#N)cc1)c1ccc2[nH]ccc2c1 750825419 GBYHCFPWFQEHHB-INIZCTEOSA-N 345.446 5.121 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 756227069 NVCNMJCOXKIKKL-CJNGLKHVSA-N 334.444 5.300 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1ccc(O)c(Cl)c1 768752102 JOIIJLWIBLPXOO-CLFYSBASSA-N 341.819 5.065 30 20 EKED C#CCCCCCC(=O)Nc1cccc(Cl)c1Oc1cccnc1 779860027 QWMXSMOGQKFHQU-UHFFFAOYSA-N 342.826 5.050 30 20 EKED CC[C@H](C(=O)OCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 784067451 YXMSFEVNIJSCJB-HNNXBMFYSA-N 341.373 5.072 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)n1 797096238 FZHVSQIKYJMYLK-ZJIFWQFVSA-N 330.497 5.049 30 20 EKED CC(C)Cc1ccc(CSCCCC2(C#N)CCOCC2)cc1 798400518 IGEMHBBRQQSATB-UHFFFAOYSA-N 331.525 5.219 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(F)c2ccccc12 1776784243 XKXPZXPYMNXBMM-KRWDZBQOSA-N 345.458 5.272 30 20 EKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc2ccccc12 25364075 JKVRRTYNHJYNHW-GOSISDBHSA-N 343.474 5.040 30 20 EKED N#CCc1cccc(C(=O)Nc2ccccc2Sc2ccccc2)c1 97366060 LYKPBSUCUODJLM-UHFFFAOYSA-N 344.439 5.156 30 20 EKED CC[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177750234 MMZWWMQWHCZHLZ-ZBFHGGJFSA-N 344.505 5.014 30 20 EKED CC(C)c1nnc(C/N=C(/O)C2(c3cccs3)CCCCC2)s1 329818836 OXQJYLQASGZPEK-UHFFFAOYSA-N 349.525 5.082 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnn([C@H](C)CC)c1C1CC1 410394330 XQRYJGWTUSYNFY-OAHLLOKOSA-N 337.467 5.102 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1cc(F)ccc1Oc1ccccc1 439077897 MNAYOTBWZTUBMO-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(C#N)c1 442794427 RZVTVNZLAIQEEU-INIZCTEOSA-N 339.398 5.395 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccc(Cl)c2ccccc12 462640761 MZNXKAMAJPAYJC-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC2(CCC2)C1 470131333 HBXQEEGWBQQFOM-UHFFFAOYSA-N 326.484 5.337 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cnc2ccsc2c1)c1ccc(F)c(F)c1 480678144 SHZIDDSVKSEWPO-BUXKBTBVSA-N 344.430 5.543 30 20 EKED Cc1ccccc1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 490667592 JCRKUUNYMXCELI-HXUWFJFHSA-N 347.462 5.069 30 20 EKED CCCc1cc(C(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)sc1C 509597377 AHGCAQUYTUUWEL-AWEZNQCLSA-N 340.492 5.104 30 20 EKED N#Cc1cc(CNc2ccc(Oc3ccc(Cl)cc3)cc2)ccn1 589570698 DQEATPGZIICJRZ-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(C#N)CCCCC1 596865396 GVLKXTRMQVVAQO-UHFFFAOYSA-N 339.483 5.134 30 20 EKED CC(C)c1ccc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 609414752 VVXIHSWNDZWLCB-MRXNPFEDSA-N 347.245 5.111 30 20 EKED C[C@H](Oc1ccccc1NCc1ccccc1C#N)c1ccccc1 609671173 GMUKNNAKHDYSLU-KRWDZBQOSA-N 328.415 5.310 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610089501 YQUFBIHHMINYAK-MRXNPFEDSA-N 346.861 5.729 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CCCCCC2)cc1 726141967 KGLRRVZGQQPEEQ-OAQYLSRUSA-N 332.447 5.251 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(-c2ccccc2F)s1 728698464 JZHIPMVRCCMJGH-BQYQJAHWSA-N 343.810 5.499 30 20 EKED CC(=NNc1ccccc1C(F)(F)F)c1cnc2ccsc2c1 739402782 SGOJJNGZLCAFIV-UHFFFAOYSA-N 335.354 5.151 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792094765 GQIFIDOISAKPGO-HRAATJIYSA-N 342.442 5.167 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C/c1cc(C)c(C)cc1C 1776783290 MSEMAKCZFMFRSX-ZJVMWOEPSA-N 345.527 5.418 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccc(F)cc1 1776785106 CVSLYIYJWPDOBM-IBGZPJMESA-N 337.479 5.414 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776805969 KVZXBVONHUQBEK-BENRWUELSA-N 347.414 5.105 30 20 EKED Cc1cccc(Oc2ccc(NC(=O)C3(C#N)CCCCC3)cc2)c1 72029877 JZIKXAZRGRQAEX-UHFFFAOYSA-N 334.419 5.200 30 20 EKED C[C@@H](Nc1ccc(COCc2ccccc2)cc1)c1ccc(C#N)cc1 174179607 IGFQQZDHBSYPRP-GOSISDBHSA-N 342.442 5.448 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 281411919 ADMOHDIGKDXVNI-UHFFFAOYSA-N 346.474 5.592 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1O 287616896 JOTOQGGRPSXPAM-QZTJIDSGSA-N 328.843 5.131 30 20 EKED CC(C)[C@H](CC1CCCCC1)/C(O)=N/[C@@H]1CCC(O)=NC12CCC2 328729137 FHDUMYAUOQJVBE-DLBZAZTESA-N 334.504 5.227 30 20 EKED COc1cc(N=C(C)O)ccc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@H]21 329209887 ZGHXRSUVQYAEBO-DJIMGWMZSA-N 344.455 5.498 30 20 EKED C=CCc1cccc(C(C)C)c1NCc1nnc(-c2ccccc2)o1 352562511 JMMQLFKEDUDIKE-UHFFFAOYSA-N 333.435 5.201 30 20 EKED CC(C)c1ccsc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430636633 YYVHHVZHRDKAEK-GFCCVEGCSA-N 332.494 5.116 30 20 EKED C=CCN(C(=O)C(c1ccccc1)c1ccccc1)c1ccccc1 484287847 WMFRMDNOIYYJDJ-UHFFFAOYSA-N 327.427 5.038 30 20 EKED CC(C)c1ccc(-c2nc(CN3CCC(C)(C#N)CC3)cs2)cc1 506013040 QAGRJZGKOYENKG-UHFFFAOYSA-N 339.508 5.059 30 20 EKED CCN(C(=O)CC(C)(C)c1ccc(C)cc1)[C@@H](C)c1ccc(C#N)cc1 509562461 XBZTUPAFCGFERE-SFHVURJKSA-N 348.490 5.144 30 20 EKED Fc1ccc([C@H](CC(F)(F)F)NCCCCC(F)(F)F)cc1 537078890 VVIMLWYIUNBVMD-LBPRGKRZSA-N 331.275 5.141 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H]1CCc2cc(C#N)ccc21 588958821 VLUDHFXCZSXBDH-IRLDBZIGSA-N 341.458 5.003 30 20 EKED CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609046896 KTOPSGMADCOSQA-HXUWFJFHSA-N 349.478 5.021 30 20 EKED Cc1cc(Cl)cc2nc(S[C@@H](C#N)Cc3ccccc3)oc12 609750894 MJWOCVRKQUJWDA-CQSZACIVSA-N 328.824 5.017 30 20 EKED Cc1cc(C)c(NC(=O)N[C@H](CCC#N)c2ccccc2)c(Cl)c1 610973033 KOEMZMYQRUVPTD-QGZVFWFLSA-N 341.842 5.123 30 20 EKED CCCN(CC1CCCCC1)C(=S)Nc1ccc(C#N)c(Cl)c1 726476317 ZECBGKIMHNCDFY-UHFFFAOYSA-N 349.931 5.201 30 20 EKED Cc1cccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)c1C 734305228 MTPCGGRGTYPLRQ-VOTSOKGWSA-N 325.458 5.385 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cccc(CC#N)c1 751251284 GYDVUPLVFIZIOX-UHFFFAOYSA-N 338.476 5.204 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1cc(F)ccc1F 757473672 FWCHDQBQKNKNBR-XQRVVYSFSA-N 333.384 5.046 30 20 EKED CC(C)CN(C(=S)Nc1ccccc1C#N)c1ccc(Cl)cc1 761822263 ZOVBBOWBVIGTEZ-UHFFFAOYSA-N 343.883 5.071 30 20 EKED FC(F)(F)C1CCC(=NNc2nc(-c3ccccc3)cs2)CC1 766016927 ZEDRNJPCLGINFM-UHFFFAOYSA-N 339.386 5.331 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1ccc(Cl)cc1Cl 779712564 JESDPCFHBWQJCT-RYUDHWBXSA-N 335.234 5.457 30 20 EKED C[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1cccc(C#N)c1 780527773 DADNYGNNLGDWJC-LLVKDONJSA-N 338.760 5.081 30 20 EKED CC1(C)C/C(=C/c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 794967537 FGIOWBLMQVQNAC-KAMYIIQDSA-N 346.455 5.153 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)NCC1(C#N)CCCC1 844526293 RWKVCGGXYIURSC-UHFFFAOYSA-N 345.512 5.091 30 20 EKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)cc1 845553403 RMLCLSUXHCVUAT-FZMZJTMJSA-N 346.883 5.074 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cc2cccc(CC)c2o1 1776782729 CKJXANQORXUTJW-GOSISDBHSA-N 345.483 5.289 30 20 EKED CC(C)c1csc(NC(=O)c2ccccc2-c2ccccc2C#N)n1 28778520 LRMWGEOJFATQJF-UHFFFAOYSA-N 347.443 5.057 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCOCc1ccccc1 189870330 TUEYBPSBUCBXML-UHFFFAOYSA-N 337.463 5.084 30 20 EKED CCOc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 214020982 VGYMESOJYPDHTQ-YVMONPNESA-N 341.457 5.166 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2coc3ccccc23)c1 255658333 KUNBQPCBMPNSGG-KHPPLWFESA-N 331.371 5.011 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)c(N)c(Cl)c1 271767522 UGDMXEVDXCCQJN-PXAZEXFGSA-N 348.277 5.271 30 20 EKED CC1(C)CCC[C@@H](CC(O)=Nc2cccc([C@H]3CN=C(O)C3)c2)C1 328855131 JVAFBWSYIIMVEX-GOEBONIOSA-N 328.456 5.325 30 20 EKED CC[C@H](C#N)Sc1nc(-c2cccs2)c(-c2cccs2)[nH]1 436041318 UMSAWBPEJJCJHR-SNVBAGLBSA-N 331.491 5.261 30 20 EKED CC[C@@H](Nc1cccc(OCc2cscn2)c1)c1ccc(C#N)cc1 447594717 HUEYMROJPQCIFC-HXUWFJFHSA-N 349.459 5.157 30 20 EKED COc1cc(CN[C@H](CCCC#N)c2ccccc2)cc2ccccc12 449341675 VRZKRVABRHCWKW-JOCHJYFZSA-N 344.458 5.373 30 20 EKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl 464156495 FBFYDJLLHMVMQU-HXUWFJFHSA-N 340.854 5.065 30 20 EKED C[C@H](NCc1cc(C#N)n(C)c1)c1ccccc1-c1ccc(Cl)cc1 480352050 COOCFGUYQJIQQT-HNNXBMFYSA-N 349.865 5.068 30 20 EKED COc1ccc([C@H](N[C@H]2CCCCc3cc(C#N)ccc32)C2CC2)cc1 481636261 ATFSUXACGAPQMR-XZOQPEGZSA-N 346.474 5.075 30 20 EKED C[C@H](NCc1ccncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 543869729 CRSNJEQMJGBFEU-HNNXBMFYSA-N 347.849 5.124 30 20 EKED N#Cc1cc(Cl)ccc1SCc1ncc(-c2ccccc2)o1 610654765 CDNQVMWJRXCPFU-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C[C@H](NCc1ccnc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 611396389 OIYIPECIGYYPKI-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=CCN(C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C)C(C)C 726716895 UOLTXPSVDVWOLS-INIZCTEOSA-N 342.405 5.009 30 20 EKED N#CCOc1ccc(COc2cc(Cl)c(Cl)cc2Cl)cc1 729241398 ZVERSPITCAVFNK-UHFFFAOYSA-N 342.609 5.128 30 20 EKED CCCCCCCC(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1 746547479 NBDAGWWLWJMVOF-UHFFFAOYSA-N 341.455 5.221 30 20 EKED CC(=NOCc1ccc(F)cc1)[C@H](C)c1nc2ccccc2s1 758142880 MRGUDCFHYVACAB-LBPRGKRZSA-N 328.412 5.132 30 20 EKED C=CC[C@@H](N[C@H](C)c1sc(C(C)(C)C)nc1C)c1ccncc1 766018816 JAFITRZUOMUELP-CZUORRHYSA-N 329.513 5.112 30 20 EKED FC(F)Oc1ccc(NN=CC2CCC(C(F)(F)F)CC2)cc1 767378110 PCTDRHZFOLKSJH-UHFFFAOYSA-N 336.304 5.054 30 20 EKED CC(C)(CCC#N)CNc1cccc(CC[C@@H](O)c2ccccc2)c1 770559761 OCYWPLGODCPRCF-OAQYLSRUSA-N 336.479 5.095 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2cc(Cl)c(N)c(Cl)c2)s1 773163869 ZYHGESPFDHXWTD-ARJAWSKDSA-N 341.263 5.052 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(C)cc1 842942412 NYIFLRWYSLLNEZ-YOEHRIQHSA-N 338.476 5.089 30 20 EKED Cc1c(NC(=O)OC(C)(C)C)cccc1N[C@@H](C)CC(C)(C)C#N 895574822 MAUMTUMPFUWKSP-ZDUSSCGKSA-N 331.460 5.082 30 20 EKED Cc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 915086135 HOZQPIVKILCGCC-JOCHJYFZSA-N 340.426 5.211 30 20 EKED CCCCCCC[C@H](C)CNC(=O)Nc1cc(NC(C)=O)ccc1C 918035297 PXMIVPSHMUNWHW-HNNXBMFYSA-N 347.503 5.072 30 20 EKED CCCCCCCOc1ccc(CN[C@H](CC(C)(C)C)C(=O)O)cc1 1776787886 CTHPDWMKZWYMMX-LJQANCHMSA-N 349.515 5.015 30 20 EKED N#CCC[C@@H](NCc1cnc(-c2cccs2)s1)c1ccccc1 130494546 AAWDIDHHFJQNPJ-MRXNPFEDSA-N 339.489 5.006 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cccc2cccnc12 178387763 XEGBDVZZNOEGAY-HNNXBMFYSA-N 333.460 5.099 30 20 EKED Cc1scc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 180741892 JDIGSYUCYGJLQA-LLVKDONJSA-N 346.864 5.118 30 20 EKED CC(C)c1ccc2occ(/C(O)=N/[C@@H]3CCOC4(CCCC4)C3)c2c1 329390633 RIYYKHZBXWQDIG-MRXNPFEDSA-N 341.451 5.353 30 20 EKED C[C@@H](NCc1cccc(C#N)c1F)c1ccc(Cl)c2ccccc12 462452381 QCQOQCWIGRCZGC-CYBMUJFWSA-N 338.813 5.355 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C/c1ccc(C)cc1 476127478 BBSCABUORCSIES-RMKNXTFCSA-N 333.475 5.889 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@H](c1ccccc1)C(C)C 481942559 GVGGRHJWZMPKPG-IBGZPJMESA-N 327.493 5.093 30 20 EKED Cc1c(C(=O)Nc2ccc(Cl)c(C#N)c2)sc2cccc(F)c12 494738089 JQXVTABGKQTJNE-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(Cl)cc1 505000797 KHBUBCCWBQMFOU-UHFFFAOYSA-N 328.843 5.123 30 20 EKED N#Cc1c(Cl)cccc1NCc1nc2cc(Cl)ccc2s1 512868047 XNEQKTVSHXMVIJ-UHFFFAOYSA-N 334.231 5.087 30 20 EKED CC(C)N(CCCCC#N)Cc1ccc(-c2ccc(F)cc2)s1 524370387 HVDPKBGUEKDSMD-UHFFFAOYSA-N 330.472 5.458 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-c2ccccc2F)o1 557508187 LJBFVNMGWJELGF-OAQYLSRUSA-N 346.405 5.125 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(Cl)c1 570067717 YRUITUZDESYGFV-BLVKFPJESA-N 328.818 5.079 30 20 EKED Cc1cccc(N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 572659846 RBMQQVNNJNIXCC-HNNXBMFYSA-N 339.464 5.058 30 20 EKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 578710361 HGQMVGCYQKPICI-UHFFFAOYSA-N 343.386 5.019 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CC2(C#N)CC2)cc1 590295527 QHWGAYUSIXRSAK-OAHLLOKOSA-N 336.460 5.172 30 20 EKED C[C@@]1(Cc2cccc3ccccc23)CCCN1C(=O)CCCCCC#N 598457567 KTYKRETWMORYET-QHCPKHFHSA-N 348.490 5.237 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCC(C)(C)C 610095546 YMKOYJKSXLYQTG-CQSZACIVSA-N 333.501 5.029 30 20 EKED C=CCN(Cc1coc(-c2ccc(Cl)cc2)n1)Cc1cccs1 674233492 MZMSIJZGNUGTDJ-UHFFFAOYSA-N 344.867 5.245 30 20 EKED Cc1cc(CCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)s1 753390327 MPIFDUYUCKWLTJ-SFHVURJKSA-N 348.471 5.112 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1ccc(O)c(Cl)c1 768756265 LOAIRQGXWVXRIS-VQHVLOKHSA-N 341.819 5.065 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)Nc1ccccc1O[C@H](C)C#N 780148938 NBVYLMFZOAUWSH-OXQOHEQNSA-N 330.472 5.303 30 20 EKED C=C[C@H](CC(=O)O[C@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798669873 MWXUCLDVMBAAQN-ZIAGYGMSSA-N 349.352 5.065 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1nccc2ccccc12 811697656 DNDUTGFHHOJRRP-WAYWQWQTSA-N 348.452 5.316 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1c[nH]c2ccccc12 915271604 FGYGNRFLSPELFS-ZHACJKMWSA-N 330.412 5.188 30 20 EKED C=CCCC1(C(=O)O)CCN([C@H](C)c2ccc(C(C)(C)C)cc2)CC1 1776167917 AYGLFJLUIVOKMJ-QGZVFWFLSA-N 343.511 5.178 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCC(C)C)cc1 1776784229 VWOAOGPKKHNEIY-IBGZPJMESA-N 349.515 5.015 30 20 EKED N#CCC[C@H](NC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 159685392 UOPXCCLOMACQBR-AWEZNQCLSA-N 348.233 5.160 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccc(CCC(F)(F)F)cc2)cc1 175803243 IDADAEIWGMSRRJ-AWEZNQCLSA-N 348.368 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](CC)CSC 191465207 JZPHLWPTQCFVFX-MRXNPFEDSA-N 334.529 5.144 30 20 EKED CCCCC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1 236850711 VSXANMVCPRPOCG-PGRDOPGGSA-N 336.479 5.389 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](C)C1CCCCC1 303344911 MKNKMBZFVGNZKT-HOTGVXAUSA-N 344.524 5.626 30 20 EKED C[C@H]1CCc2nc(N=C(O)c3scnc3C3CCCC3)sc2C1 329787001 QXLRPQFNRNNFKP-JTQLQIEISA-N 347.509 5.018 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 352173675 DVGUFHGATGTAAQ-QGZVFWFLSA-N 347.245 5.158 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 439438857 DTIBMDUFHLDAIC-OAHLLOKOSA-N 347.849 5.124 30 20 EKED C[C@@H](SCc1coc(-c2ccc(F)cc2)n1)c1cccc(C#N)c1 443140190 BBGKWRUTUYTSLD-CYBMUJFWSA-N 338.407 5.347 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(SC)c1 451328733 IQSJWNMYCIPZMV-UHFFFAOYSA-N 325.477 5.513 30 20 EKED C=CCCC1(C(=O)N[C@H](C)c2ccc(-c3ccccc3OC)cc2)CC1 476123936 XJNZATJIOISPCZ-QGZVFWFLSA-N 349.474 5.286 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1ccc(F)c(F)c1 480679728 JNIPTYBNIBPCRJ-KPZWWZAWSA-N 348.462 5.268 30 20 EKED CC(C)C(=O)Nc1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1 481993528 RZGUMCBJRPTSPW-NRFANRHFSA-N 347.462 5.032 30 20 EKED CCCc1sc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1CC 483245352 QJIODDIKIHPAKV-QGZVFWFLSA-N 348.471 5.301 30 20 EKED N#Cc1ccc(NCc2csc(-c3ccsc3)n2)c(Cl)c1 486575293 MTZMGXVMWICIBP-UHFFFAOYSA-N 331.853 5.009 30 20 EKED N#Cc1cccnc1N[C@H](c1ccccc1)c1ccc2ccccc2c1 518318553 JIXWZLKXPQYIDJ-JOCHJYFZSA-N 335.410 5.308 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2Cc2ccccc2)cc1Cl 548607220 MDKQCMSKXTWWAC-UHFFFAOYSA-N 346.817 5.055 30 20 EKED N#CCCC[C@H](NCc1ccc(C2CCCC2)cc1)c1ccccc1 552083457 GFFAOKCHUJVCNY-QHCPKHFHSA-N 332.491 5.869 30 20 EKED CC(C)Oc1ccc([C@H]2CCC[C@H]2NCC(C)(C)CCC#N)cc1 558247531 PVILYVJXARELEF-WOJBJXKFSA-N 328.500 5.029 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)c1ccccc1 561133365 LRTQNODWJJHDEX-YJSIEXFISA-N 345.486 5.141 30 20 EKED CC(C)c1ccc(-c2nc(CN3CCC[C@@H](CC#N)C3)cs2)cc1 595609988 RIAMZAKCNZQOAH-INIZCTEOSA-N 339.508 5.059 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@](C)(C#N)C1 612290750 OZSDQQLPRILWRS-HXUWFJFHSA-N 327.472 5.091 30 20 EKED Cc1cc2oc(=O)cc(CSc3ccccc3C#N)c2cc1C(C)C 741737410 YRXZXSCQVPGZKQ-UHFFFAOYSA-N 349.455 5.389 30 20 EKED C/C(=C\C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)C(C)(C)C 742629395 CLSUHBMHQKAWSR-FOWTUZBSSA-N 348.446 5.068 30 20 EKED CCCCC[C@@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 742654355 UYIQLCXWORMCEV-HZPDHXFCSA-N 332.513 5.626 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1nc2ccccc2o1 744039202 KKFWBUMBZNFTEQ-YWZLYKJASA-N 326.440 5.391 30 20 EKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1Cl 747199238 RXJXJLIZCGOWJO-CQSZACIVSA-N 346.883 5.037 30 20 EKED C[C@H]1C/C(=C/c2ccc(Oc3cnccn3)cc2)C(=O)c2ccccc21 751535899 NGZSDMCEDXPIAU-SUCHYCSPSA-N 342.398 5.042 30 20 EKED CCCC(=CC(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC 770728699 DCKASTCHJHXARN-HNNXBMFYSA-N 330.497 5.546 30 20 EKED CCCCCCC[C@H](N[C@@H]1CCO[C@]2(CCOC2)C1)c1ccccc1 773153661 WDNGSXKCEJWSTP-BHIFYINESA-N 345.527 5.016 30 20 EKED CC(C)Oc1ccc(NCc2ccc(O[C@H](C)C#N)cc2)c(Cl)c1 780583228 OAHVYHCITVVGRD-CQSZACIVSA-N 344.842 5.030 30 20 EKED C=CCCN(OCc1ccccc1)C(=O)Nc1cc2[nH]ccc2cc1C 782848030 CAZJQQSQPPNXFK-UHFFFAOYSA-N 349.434 5.018 30 20 EKED C=CC[C@@H](NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21)c1ccncc1 783559846 GVBBMTPKXFQDEY-YUXAGFNASA-N 348.490 5.132 30 20 EKED C[C@H](Cc1ccccc1C(F)(F)F)Nc1ccccc1O[C@H](C)C#N 795811257 SSGGLKNQFVBWAK-ZIAGYGMSSA-N 348.368 5.039 30 20 EKED C=C[C@H](CC(=O)O[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803064935 VZUIYMRRGQFYOD-ZIAGYGMSSA-N 349.352 5.065 30 20 EKED CCCC(=NNc1nc(Cl)c(Cl)cc1Cl)c1cccnc1 814740911 CNJAQZIOYJZRHG-UHFFFAOYSA-N 343.645 5.053 30 20 EKED COc1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 818268708 SNGPDDOLZLVAGB-UHFFFAOYSA-N 329.614 5.101 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC[C@@H](CC#N)C1 820738348 XIZXLECDADEPDB-HNNXBMFYSA-N 345.512 5.043 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)sc1C 915086286 JJUUWROFRNCMPX-IBGZPJMESA-N 346.455 5.273 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2CCCCC2)cc1 915088187 JERPGOWUNMQZHD-NRFANRHFSA-N 332.447 5.251 30 20 EKED CCCCC/C(C=NNc1ccc(C(=O)O)cc1)=C/c1ccccc1 1776012009 OOWLDICTZBUACV-IMKIVOICSA-N 336.435 5.446 30 20 EKED Cc1ccccc1-c1ccccc1C=NNc1cccc(C(=O)O)c1C 1776088459 NLMQTRXGEXJVAI-UHFFFAOYSA-N 344.414 5.115 30 20 EKED Cc1ccc2c(CC(=O)Nc3ccc(C(C)(C)C#N)cc3)coc2c1C 25437608 NBPVFZNDHMELCI-UHFFFAOYSA-N 346.430 5.032 30 20 EKED N#Cc1cccc(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)c1 303174046 RZNYBNWNLWJSPJ-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C=CCC[C@@H](N[C@@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 353626025 WYGKXFXSZRULCK-IAGOWNOFSA-N 349.400 5.103 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)C(C)(C)C 433159687 SSBUVVAETDKMTG-CQSZACIVSA-N 347.528 5.275 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(C)c1Br)c1ccccc1 470043936 GQLFRLUCBWLQDN-AWEZNQCLSA-N 344.252 5.056 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1ccccc1)c1ccco1 481934603 SRCCTBKMCNKFSD-GMAHTHKFSA-N 342.442 5.298 30 20 EKED Cc1ccc(CN(C(=O)Nc2ccc(C#N)c(Cl)c2)C(C)C)s1 510038543 CBDKWCTUYACYMG-UHFFFAOYSA-N 347.871 5.024 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 514681989 CRUDNJNGIVDCHL-KSFYIVLOSA-N 332.422 5.675 30 20 EKED Cc1ccc(-c2nc(CSCc3cc(C#N)ccc3F)co2)cc1 517940633 ZSRBPQXSZQYHJC-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CC(C)(C)[C@H]1CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 525714148 CSOHOWNFFZRFQX-HXUWFJFHSA-N 348.446 5.001 30 20 EKED CCCOc1cc(C)ccc1NCc1cccc(OCCCC#N)c1 532727736 WFXWMTQVPRXLKI-UHFFFAOYSA-N 338.451 5.079 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 550548106 MVLJQQZEDADACC-UHFFFAOYSA-N 346.386 5.319 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 559859136 BNVMHPDBYLDIAF-KBXCAEBGSA-N 347.289 6.079 30 20 EKED Cc1cc(Cl)cc2nc(S[C@H](C#N)Cc3ccccc3)oc12 609750893 MJWOCVRKQUJWDA-AWEZNQCLSA-N 328.824 5.017 30 20 EKED C=CCc1cc(CNc2ccc(Cl)cc2SC)cc(OC)c1O 630070217 VFWXVKUANYXZFW-UHFFFAOYSA-N 349.883 5.117 30 20 EKED C=CCOc1ccc(/C=C\C(=O)c2ccc(F)cc2F)cc1Cl 727264567 SFCHTYIIVLSKTQ-CLTKARDFSA-N 334.749 5.079 30 20 EKED CC(C)(C)CCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728814302 ZEMXLSOKXKKONO-HXUWFJFHSA-N 334.463 5.497 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)C12CC3CC(CC(C3)C1)C2 739421287 IJQSUDNTHRLUDE-UHFFFAOYSA-N 337.389 5.105 30 20 EKED O=C(/C=C\c1cnc2ccccn12)c1cc2c(ccc3ccccc32)o1 740765155 RAUJOLKZLCSKGN-KTKRTIGZSA-N 338.366 5.130 30 20 EKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 744115390 JRTYRDHIWBRRAE-GXTWGEPZSA-N 332.444 5.218 30 20 EKED CCCCCCCCCC(=O)Nc1c(F)cc(C(C)=O)c(F)c1F 763536417 PGVYSIQJZUIUHG-UHFFFAOYSA-N 343.389 5.386 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1c(Cl)ccc(Cl)c1Cl 768337429 MGBYVSNDRPCYFU-UHFFFAOYSA-N 348.657 5.524 30 20 EKED FC(F)(F)Oc1ccc(NN=Cc2c(Cl)cccc2Cl)cc1 812460972 BXVROFVMFHQCSE-UHFFFAOYSA-N 349.139 5.338 30 20 EKED N#CCCCC(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 812478612 YPUODJHTFXJSEY-UHFFFAOYSA-N 333.218 5.293 30 20 EKED CCC(F)(F)c1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 828990455 GCRMYLIOYTUYOE-UHFFFAOYSA-N 342.389 5.242 30 20 EKED C=CCN(C(=O)c1ccc(CSc2ccccc2)cc1)C(C)C 915148133 XJQIFYZMGHRTQY-UHFFFAOYSA-N 325.477 5.016 30 20 EKED CCOc1ccc(N=Cc2c(O)ccc3ccccc23)cc1OCC 920942238 TWRSBHGYTLPYCZ-UHFFFAOYSA-N 335.403 5.093 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(Cl)cc1 78481729 JPZKJKSRXQCKTO-BQYQJAHWSA-N 331.849 5.421 30 20 EKED CCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(F)cc1F 181893803 DDMRKFYORJEPQD-XOBRGWDASA-N 344.405 5.059 30 20 EKED CCc1c([C@H](C)NCc2ccc(OCC#N)cc2)oc2ccc(C)cc12 181934084 BJLQRNWHMPCCDV-INIZCTEOSA-N 348.446 5.057 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 199121162 ZPQUBHIWAUNEKB-LWUHNEAVSA-N 347.292 5.066 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Cl)cc1 214012869 JWCHILNEEHMWGK-WAYWQWQTSA-N 331.849 5.421 30 20 EKED CC(=O)c1ccccc1OCc1ccc(-c2ccccc2C#N)cc1 218129143 VQBHKWZLVPIYTE-UHFFFAOYSA-N 327.383 5.007 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2)nnc1-c1cccc(C)c1 255932997 ASPNCOUIEGVZPH-MRXNPFEDSA-N 335.476 5.293 30 20 EKED C[C@@H](Nc1cc(Cl)cc(Br)c1)c1cccc(C#N)c1 308321282 VPRLCSCKZLNZSQ-SNVBAGLBSA-N 335.632 5.147 30 20 EKED N#CCCCOc1cccc(NCc2cc(Cl)ccc2Cl)c1 319981359 OHFXXZTUPPBUEV-UHFFFAOYSA-N 335.234 5.288 30 20 EKED C[C@H]1C(=O)CC[C@@H](C(O)=Nc2ccc3ccc(Cl)cc3n2)C1(C)C 328657328 OTRMKTFIEMCDOC-FZMZJTMJSA-N 344.842 5.118 30 20 EKED N#CCC[C@H](NC(=O)Nc1csc2ccccc12)c1ccccc1 352810832 QCHCSRULAAFKER-INIZCTEOSA-N 335.432 5.068 30 20 EKED C=CC1CCN(C(=O)Nc2ccc3nc(C(C)(C)C)sc3c2)CC1 438638556 DTQCQQGQLGABLV-UHFFFAOYSA-N 343.496 5.024 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@H](C)c1cccc(C#N)c1 447557044 KLDUWQMGYJOZRQ-KDOFPFPSSA-N 332.369 5.211 30 20 EKED C[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)c2ccccc21 476719533 RYTDUGTXXCDDBS-MRXNPFEDSA-N 332.447 5.032 30 20 EKED N#Cc1ccc(CN(Cc2cccs2)Cc2cccs2)cc1F 483533608 RWAKWENGKDZTRX-UHFFFAOYSA-N 342.464 5.023 30 20 EKED COc1ccccc1CN(Cc1cccs1)CC(C)(C)CCC#N 506112924 OJMFSFGZHKOOBN-UHFFFAOYSA-N 342.508 5.089 30 20 EKED C[C@H](F)CCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510765669 OIBDSHHNIMVRJN-JOYOIKCWSA-N 331.275 5.037 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cc(Cl)ccc1Cl 515097777 UWDMBQBDYKCQQI-BBATYDOGSA-N 331.246 5.203 30 20 EKED C[C@H](NCc1ccc(CC#N)cc1)c1ccccc1Oc1ccccc1 541329052 UPECKMNUAWNGGP-SFHVURJKSA-N 342.442 5.396 30 20 EKED C[C@@H](NCCCCC#N)c1ccc(-c2ccc(Cl)cc2F)s1 542678417 UNVKMRMARLPAOE-GFCCVEGCSA-N 336.863 5.552 30 20 EKED CCC(CC)c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 545673396 OSTCKAHJPDLBFC-ZHACJKMWSA-N 334.423 5.012 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)c(C)c1 555336941 MALNHVVFJXEJON-UKRRQHHQSA-N 345.512 5.042 30 20 EKED CC(F)(F)c1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 568377779 UIOZHXDPVPOYNG-UHFFFAOYSA-N 340.295 5.301 30 20 EKED C=CCCCN(C)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 605738782 WEOGXGVOEXWTLK-UHFFFAOYSA-N 340.414 5.227 30 20 EKED CC(C)(C)OCc1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1 611392014 IOOXJJOCXDHTDW-JOCHJYFZSA-N 348.490 5.041 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CCCCCC2)cc1 726141964 KGLRRVZGQQPEEQ-NRFANRHFSA-N 332.447 5.251 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC[C@@](C)(C#N)C1 752583246 YXGNJCBCCQXKGG-IBGZPJMESA-N 345.512 5.043 30 20 EKED Cc1cncc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)c1 767365862 HFDROAGSPNVJMP-VURMDHGXSA-N 346.411 5.156 30 20 EKED C=C(C)[C@H](N[C@H](CC)c1ccc(F)cc1O)c1ccc(F)c(F)c1 796949258 PHMZTKGZQDEVQN-MJGOQNOKSA-N 335.369 5.168 30 20 EKED CC[C@H](NCC1CCC(C#N)CC1)c1ccc(Cl)c(Cl)c1O 799725132 DBNFHSQDWSRXNL-QOZQQMKHSA-N 341.282 5.070 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CC[C@@H](C)c3ccsc32)c1 834650986 SNMKABHKPOHRFS-IDHHARJASA-N 340.492 5.157 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1C 916847271 BFZDORPENJOTHK-XZVRFQMRSA-N 346.455 5.111 30 20 EKED CC1(C)CCC/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C1=O 1776550848 LCWFNKNYUMSHCM-OWBHPGMISA-N 340.444 5.276 30 20 EKED Cc1cc(Cl)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 7277409 FUIKMUGSLDOPIF-UHFFFAOYSA-N 346.817 5.439 30 20 EKED N#Cc1ccccc1NC(=S)Nc1ccc(Nc2ccccc2)cc1 44052572 HXGFGSAKKAFNHG-UHFFFAOYSA-N 344.443 5.111 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1c(C)noc1C 189884641 ABFRSPXRPXDUQE-CQSZACIVSA-N 340.467 5.276 30 20 EKED C[C@@]12CC3CC(C(O)=Nc4cccc5c4CN=C5O)(C1)C[C@](C)(C3)C2 329266144 HIMULAMXSOIRCS-SWOGZVPRSA-N 338.451 5.089 30 20 EKED C[C@@H]1C[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccsc2S1 358346905 DELGUWZUKWGUOZ-XOKHGSTOSA-N 328.506 5.308 30 20 EKED N#Cc1ccc(Cl)cc1N[C@H]1CCCc2cn(C3CCCC3)nc21 445602455 UXCQZNGHVFRZBH-KRWDZBQOSA-N 340.858 5.013 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(C)cc1Br)c1ccccc1 487631128 HYHAFHUIXLNCAI-OAHLLOKOSA-N 344.252 5.056 30 20 EKED CC(C)(C#N)CCC[S@](=O)Cc1ccc(C2CCCCC2)cc1 505731878 AZIKYEJKGLMFSD-QHCPKHFHSA-N 331.525 5.313 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2cccc(C#N)c2)cc1 536164031 UYPWQKKCNJFEQN-FQEVSTJZSA-N 333.435 5.051 30 20 EKED CC(C)[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 539609103 DXYBOXQCTRQLJL-BUXKBTBVSA-N 332.369 5.023 30 20 EKED N#CC1(CSc2nc(-c3cccs3)c(-c3cccs3)[nH]2)CC1 540859545 WRQULZDMZFGBEK-UHFFFAOYSA-N 343.502 5.263 30 20 EKED Cc1nc(Cc2ccccc2)sc1[C@H](C)NCC(C)(C)CCC#N 554066345 GLIKFPLHNGENJA-HNNXBMFYSA-N 341.524 5.023 30 20 EKED C[C@@H](N[C@H](C)c1ccncc1F)c1ccc(-c2cccc(C#N)c2)cc1 559834338 VCLNWVYEGJMQNP-HZPDHXFCSA-N 345.421 5.171 30 20 EKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(C2(C#N)CC2)cc1 596978679 COXIQCYCUYZULS-HNNXBMFYSA-N 347.487 5.044 30 20 EKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c(C)s1 603968012 HBOUIHCGPZUZEK-UHFFFAOYSA-N 338.457 5.217 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cccnc1Cl 728699408 UIGWYPXYGFRMED-KTKRTIGZSA-N 340.835 5.063 30 20 EKED CC(C)(C)C1C/C(=C/c2nccs2)C(=O)/C(=C/c2nccs2)C1 730086157 YGPYUHPSSFOESS-PJABCKPXSA-N 344.505 5.092 30 20 EKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2sccc2C)ccc1OC 733749667 SNRAZHMQCCSVRI-OWNNVSBGSA-N 330.449 5.139 30 20 EKED COc1cccc2cc(/C=C\C(=O)c3ccc(SC)c(F)c3)oc12 741846298 CDINRJQHTLZPCY-FPLPWBNLSA-N 342.391 5.199 30 20 EKED Cc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc(C)c1O 744869294 VWLPDDBLINBIBX-ONEGZZNKSA-N 327.232 5.273 30 20 EKED CCCC[C@@H](NCc1ccc(C#N)cn1)c1ccc(Cl)cc1Cl 783292905 DFDRXVRLCUZCHW-GOSISDBHSA-N 348.277 5.281 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(SC(F)F)cc2)cc1 792759746 CPBQGKQBDGRRKC-UHFFFAOYSA-N 346.402 5.055 30 20 EKED COc1ccc(-c2nc(/C=C3/CCc4ccccc4C3=O)cs2)cc1 796983481 GSEVLXWFKXXNES-VBKFSLOCSA-N 347.439 5.031 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)c1cccnc1 873831363 AASDCIICNAJMJX-VQHVLOKHSA-N 325.820 5.360 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)s1 902884384 GYEIWXFIHHUKGP-OCCSQVGLSA-N 338.398 5.463 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(-c2ccccc2)no1 926481293 SXOINSJLQONWEH-PXNSSMCTSA-N 345.446 5.427 30 20 EKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)CC2 187803020 LFTTWLFNTKKHPG-KSFYIVLOSA-N 334.463 5.050 30 20 EKED C=CCC1(C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2C)CCC1 191934302 ZOTFMCIWNZRWQD-UHFFFAOYSA-N 344.455 5.027 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCC1(CC#N)CC1 430764444 RZSMDPQKGALUEA-GFCCVEGCSA-N 345.899 5.116 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)sc1Cl)c1ccccc1 449338967 IGJRXOITSHZHOV-AWEZNQCLSA-N 339.291 5.580 30 20 EKED Cc1cccc([C@H]2CCCCN2C(=O)[C@@H](C)c2cccc(C#N)c2)c1C 462180463 MGTURVKZQYVLDG-PGRDOPGGSA-N 346.474 5.032 30 20 EKED C=CCCC1(C(=O)Nc2cccc(COC(C)(C)CC)c2C)CC1 476255065 UPZIZVYTTVQXDV-UHFFFAOYSA-N 329.484 5.385 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(Cl)cc1C 476999095 GJTVAEPMVUUWSZ-UHFFFAOYSA-N 341.882 6.061 30 20 EKED C[C@@H](CCCC(F)(F)F)NCc1ccc(F)cc1C(F)(F)F 480241412 NHGFWBZJODHUKH-VIFPVBQESA-N 331.275 5.055 30 20 EKED N#Cc1ccc(SCc2coc(-c3cccc(Cl)c3)n2)cc1 509626911 VFCJVHZHZPSXSP-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC1CCCCC1 510881504 WLFVXBQEMHEULX-HZPDHXFCSA-N 344.524 5.626 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 523110738 AYOLSQPNHZEMRW-DLBZAZTESA-N 334.463 5.053 30 20 EKED Cc1c([C@H](NC(=O)CCCCCC#N)C(C)C)oc2ccccc12 588460333 DMUJPTLEESPPGN-LJQANCHMSA-N 326.440 5.029 30 20 EKED N#Cc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)s1 589321349 BRFAMNCYQYGLIQ-INIZCTEOSA-N 337.275 5.167 30 20 EKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CCCCC#N 593974435 ZIQJUYQRDIGIOW-KRWDZBQOSA-N 336.435 5.158 30 20 EKED CCCc1ccc(-c2ccc(NC(=O)NCCCCC#N)cc2)cc1 609810222 MWAKNKBRNXISRV-UHFFFAOYSA-N 335.451 5.121 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1 610829680 DRIHHCVOHCGXNX-UONOGXRCSA-N 328.843 5.022 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cccc(OCCCC#N)c1 726743874 RZQZIFRQMPMINH-VAWYXSNFSA-N 344.414 5.055 30 20 EKED C[C@H](CC#N)Sc1ccccc1N=Cc1c(O)ccc2ccccc12 731318586 IQNCOEKTFHWZEK-OAHLLOKOSA-N 346.455 5.690 30 20 EKED COc1ccc(C(=O)/C=C\c2nccc3ccccc23)c2ccccc12 740764675 BMFZPLOCCDVPHX-QXMHVHEDSA-N 339.394 5.293 30 20 EKED C[C@H](C#N)CN(C(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CC1 754384676 POKOEJCXUMGWRL-OAHLLOKOSA-N 347.422 5.258 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3c(Cl)sc(Cl)c32)cc1 765010925 LXJLDWYBMZTNTP-CYBMUJFWSA-N 337.275 5.094 30 20 EKED C[C@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 766348492 AABZXSXMUVPCBM-ZBEGNZNMSA-N 347.245 5.039 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)Nc2cccc(COC)c2)cc1 776837645 WAUHSJQISJAERC-OAHLLOKOSA-N 331.843 5.137 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(Cl)c(Cl)c1 779712339 FERCNWWADANMGJ-VXGBXAGGSA-N 335.234 5.457 30 20 EKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccccc1-c1ccccc1 781070646 OELHTJKLNAQNHI-HXUWFJFHSA-N 338.451 5.263 30 20 EKED CCCCCCCCCC(=O)Nc1cc(NC(=O)N(C)C)ccc1C 798083071 MALZBLJUSXDSOY-UHFFFAOYSA-N 347.503 5.168 30 20 EKED CC(C)Oc1ccc(NCc2ccccc2CC(F)(F)F)cc1C#N 864039143 OBDKQGYXZLYQQS-UHFFFAOYSA-N 348.368 5.062 30 20 EKED C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 915304303 XNZQEIDFTCWZDY-MRXNPFEDSA-N 341.414 5.108 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cc1cc2ccccc2nc1Cl 917055612 RUVGFLQBSQDIAW-UHFFFAOYSA-N 349.865 5.172 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 919654068 CKRHAICYIYEJTF-QGZVFWFLSA-N 329.488 5.011 30 20 EKED CCCC(CCc1ccccc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033409 CPBICNWNGRZVNC-UHFFFAOYSA-N 344.842 5.239 30 20 EKED N#CCCC[C@H](N[C@H]1CCSc2c(F)cccc21)c1ccccc1 340442212 FGUKJIHAGWWWFL-OALUTQOASA-N 340.467 5.387 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 410348425 JQCUGMMMRRAKPW-GJZGRUSLSA-N 325.374 5.112 30 20 EKED Cc1nc2ccccc2n1CCCCCSCCC(C)(C)C#N 461245184 LCHUTZBQOJVRAR-UHFFFAOYSA-N 329.513 5.188 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(CC[C@H](C)C2)C1 475578075 LLECFNRGLGMFLO-JTSKRJEESA-N 340.511 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-n2cccc2)cc1 476079678 LQWACVXQWJMDCB-UHFFFAOYSA-N 344.458 5.582 30 20 EKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)c1 476317110 YUVMJPJQHUSSST-NRFANRHFSA-N 346.474 5.082 30 20 EKED Cc1cccnc1[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(C)C 481670567 PDBCGNVDUCVXRM-SFTDATJTSA-N 333.479 5.016 30 20 EKED C[C@H](C#N)CSc1ccccc1NCCOc1ccccc1Cl 487398967 WZHGTULAPLKQTO-CQSZACIVSA-N 346.883 5.083 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2ccccc2Cl)c1 510995787 JCZFKQUDQBBXNJ-CQSZACIVSA-N 344.842 5.130 30 20 EKED CC[C@@](C)(C#N)C(=O)N[C@H](C)c1ccccc1-c1ccc(Cl)cc1 513295147 FBGOEAZDOAMSJI-VLIAUNLRSA-N 340.854 5.124 30 20 EKED COc1ccc([C@@H](NCCCC(C)(C)C#N)c2ccc(C)cc2)cc1 532413627 PVIMXFNGUZVFFK-NRFANRHFSA-N 336.479 5.013 30 20 EKED CC[C@@H](C)Oc1cc(C)ccc1CN[C@H](C)c1ccc(C#N)c(F)c1 539609728 JLCHDPXLRCIONM-HZPDHXFCSA-N 340.442 5.034 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)CC2 569396964 VXHWGHVVQCFFCF-BJKOFHAPSA-N 338.454 5.119 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)noc1C(F)F 682803638 JFZSNMVMBYQPEE-UHFFFAOYSA-N 334.366 5.025 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)Nc2ccc(C#N)cc2)cc1 726798178 ZCVYHWVDFWMFBN-UHFFFAOYSA-N 325.437 5.093 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(O)cc3)s2)cc1 727655685 ZQONUPYRADGTTN-KPKJPENVSA-N 335.428 5.029 30 20 EKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccc(Cl)c([N+](=O)[O-])c1 741840187 JSDFMPQRQHXCOC-HWKANZROSA-N 345.713 5.030 30 20 EKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc2ccccc2c1 753133262 AYKQAEQWZUTWQI-KHPPLWFESA-N 342.423 5.254 30 20 EKED C#CC[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 758209717 KKXKZRCAKYJUAD-AWEZNQCLSA-N 348.780 5.164 30 20 EKED C[C@@H](Cc1ccccc1C(F)(F)F)Nc1ccccc1O[C@@H](C)C#N 795811254 SSGGLKNQFVBWAK-KBPBESRZSA-N 348.368 5.039 30 20 EKED CCCc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 814507092 HJDWQOFCECBYRZ-HXUWFJFHSA-N 335.451 5.196 30 20 EKED Clc1cc(NN=C2CCC(OC3CCCC3)CC2)cc(Cl)n1 819828646 LHJPQERTEMIBBT-UHFFFAOYSA-N 342.270 5.058 30 20 EKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCC1 838787813 KAYIIDWFTKGFPE-NHYWBVRUSA-N 344.867 5.076 30 20 EKED N#Cc1ccc(Br)c(CNc2ccc(C3CCC3)cc2)c1 864027146 UCIAXHMNSIAAJE-UHFFFAOYSA-N 341.252 5.200 30 20 EKED CC1=CC(=NNc2nc(C)nc3sc(-c4ccccc4)cc23)CC1 916311368 DBTXOKFSPAAHCQ-UHFFFAOYSA-N 334.448 5.175 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 919655730 YWZFNUDQUCLZRZ-INIZCTEOSA-N 344.503 5.016 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3ccsc3)cc2)cc1 921011597 ZDOISPVSELOCNS-KMKOMSMNSA-N 346.411 5.064 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)oc12 181418041 VCGCOPZXFIQRKZ-GJZGRUSLSA-N 334.419 5.115 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)c(C)c1 189845181 PAGHLWPCYHWALD-HNNXBMFYSA-N 349.459 5.387 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(COC)c1 191455329 FVSVREAJYQJUMC-UHFFFAOYSA-N 338.451 5.329 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCO[C@@H](CC)C1 276464545 OTCDUHXPBXJTDZ-AEFFLSMTSA-N 329.484 5.072 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 340437977 XFXKEZSQEFFBGZ-WOJBJXKFSA-N 326.871 5.816 30 20 EKED CSc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1F 340439189 BYRQASRBUBWGIO-BEFAXECRSA-N 342.483 5.633 30 20 EKED Cc1nc(CNc2cccc(C#N)c2C)oc1-c1ccc(Cl)cc1 431327036 FVNVLKJKYFIUPH-UHFFFAOYSA-N 337.810 5.096 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1 467606189 SVFFXYFYEFTPQZ-VQTJNVASSA-N 337.438 5.420 30 20 EKED Cc1c(Cl)cc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1Cl 480407949 RKJUPPQXRCOZAR-LLVKDONJSA-N 348.233 5.056 30 20 EKED C=C(C)[C@@H](NCc1cc(C)nc2ccccc12)c1ccc(F)c(F)c1 481592951 OPWXAFFURCEVQH-OAQYLSRUSA-N 338.401 5.228 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C)cc2cccnc12 486404826 ICRULGKRABFOEI-UHFFFAOYSA-N 334.444 5.074 30 20 EKED N#Cc1ccc(CN[C@H]2CCc3ccc(-c4ccccc4)cc32)s1 495193607 QIJSGRAZSINETE-NRFANRHFSA-N 330.456 5.064 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1c(Cl)cccc1Cl)C1CC1 518444132 PFXXSEVWZNTLED-MRXNPFEDSA-N 325.283 5.364 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 521495266 SBDSVFZYABLGDQ-UHFFFAOYSA-N 348.789 5.256 30 20 EKED Cc1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1C 537587016 PPCYHDSRTOORBC-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCCC2 550829466 HUHVRJKXMQZLKZ-VQIMIIECSA-N 338.520 5.713 30 20 EKED N#CCCCCCc1nc(-c2cccc(Oc3ccccc3)c2)no1 588321331 CXFUWKXXLUZYCM-UHFFFAOYSA-N 333.391 5.155 30 20 EKED N#CCCCCC(=O)N[C@@H](c1ccccc1)[C@H]1CCCc2ccccc21 593998907 RSFAEEUVIWSSRI-GMAHTHKFSA-N 346.474 5.048 30 20 EKED C=CCCCCCN(C)C(=O)c1csc(-c2ccccc2Cl)n1 606817054 RGAUFIMIXNIZTC-UHFFFAOYSA-N 348.899 5.282 30 20 EKED C[C@@H]1C[C@H](CC(=O)[C@@H](C#N)c2nc3ccccc3s2)CC(C)(C)C1 727629853 WURUOUPPRMTDRU-RBSFLKMASA-N 340.492 5.325 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 727952111 AOZGWUYQDGKZML-LSDHHAIUSA-N 328.481 5.469 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccc(OCC#N)cc1 729685935 NNFKYIXVWDJQGQ-MRXNPFEDSA-N 348.471 5.168 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 733679582 BLLCRHDMMHUQEX-HZPDHXFCSA-N 340.492 5.469 30 20 EKED CC(C)(C)/C=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 735208541 ZEDWHUFPOCBRMR-MYSGNRETSA-N 344.867 5.242 30 20 EKED O=C(/C=C/c1cnc2ccccn12)c1ccc(-c2ccccc2F)s1 740764694 BXZGSIWSMSJIPJ-CMDGGOBGSA-N 348.402 5.098 30 20 EKED CC(C)c1cccc(NC(=S)N(Cc2ccc(C#N)cc2)C2CC2)c1 745652466 CHXOYYSKMOKMBK-UHFFFAOYSA-N 349.503 5.043 30 20 EKED C=CC[C@@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccncc1 766021914 VMGVOCBJEZKTQD-IAGOWNOFSA-N 332.394 5.041 30 20 EKED C[C@H](C=NNc1c(Cl)cc(Br)cc1Cl)CCC#N 766025247 JPHJSZILQDGCQI-QMMMGPOBSA-N 349.059 5.093 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(C)c(C)c1O)c1ccc(F)c(F)c1 775556752 ACKNVTOLCVVZSS-LIRRHRJNSA-N 331.406 5.255 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(Br)cc1F)c1ccccc1 783258117 APBLQESWVRPSTN-ACJLOTCBSA-N 346.243 5.003 30 20 EKED FC(F)(F)c1cnc(C=NN(c2ccccc2)c2ccccc2)s1 788407684 HVEFHUCZNMEGNZ-UHFFFAOYSA-N 347.365 5.334 30 20 EKED C=CCCC[C@H](NCc1csc([C@H](C)OC)n1)c1ccccc1 880388620 MUYYHJKLEDEFMA-YJBOKZPZSA-N 330.497 5.038 30 20 EKED CCCCCCCCCCCN(C)Cc1ccsc1C(=O)O 1776784624 XLLAFHJLANNLBR-UHFFFAOYSA-N 325.518 5.409 30 20 EKED CN(Cc1cccc(C#N)c1)Cc1sc2ccccc2c1Cl 26328548 BWBNYZBWXAYFEA-UHFFFAOYSA-N 326.852 5.058 30 20 EKED CCc1ccsc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 66510937 DPMKYIWGFKRBNX-LLVKDONJSA-N 346.864 5.064 30 20 EKED CCCCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 128814404 XGLXQAWFRYNYGO-MRXNPFEDSA-N 341.480 5.132 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(CCCC)nc1C 188059757 HSXKUECPHOFAKT-UHFFFAOYSA-N 339.483 5.096 30 20 EKED CCn1nc(C)c(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c1C 206843794 SJQVPZDHUWJDTC-PFONDFGASA-N 330.431 5.083 30 20 EKED N#CCCCOc1cccc(NCc2ccc(Cl)c(Cl)c2)c1 237745011 QURLUTMCILOCSJ-UHFFFAOYSA-N 335.234 5.288 30 20 EKED Cc1nc(C2CC2)oc1/C(O)=N/CC1CCC(c2ccccc2)CC1 329772543 HMWHGBBTYACREK-UHFFFAOYSA-N 338.451 5.139 30 20 EKED CC[C@H](C)[C@H](C)N(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CC1 458806256 VXAIYXHKSKPVKS-ABSDTBQOSA-N 341.499 5.030 30 20 EKED CC(C)(C#N)CCSc1nc(-c2cccs2)nc2ccccc12 463045564 WZZPSRVCANOMMK-UHFFFAOYSA-N 339.489 5.390 30 20 EKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C(C)(C)C1 472736033 GTQIRRRACTZNRX-HNNXBMFYSA-N 349.434 5.003 30 20 EKED N#CC1(CCCSCc2ccc(C3CCC3)cc2)CCOCC1 512392537 WGSFMGGXFPZPNN-UHFFFAOYSA-N 329.509 5.288 30 20 EKED Cc1ccc(-c2ccc(C(=O)Nc3ccc(C#N)cc3Cl)s2)o1 543818038 VLVIDKFXJWUROC-UHFFFAOYSA-N 342.807 5.094 30 20 EKED Cc1nc(SCCC(C#N)(c2ccccc2)c2ccccc2)oc1C 572343783 PVMUFNBMFKNBSP-UHFFFAOYSA-N 348.471 5.284 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2)cc1 591698472 AWIARPIIIMCGET-INIZCTEOSA-N 330.406 5.215 30 20 EKED Cc1ncccc1/C=C\C(=O)c1ccc(Oc2ccccc2)c(F)c1 728787839 UCUCWWOFRBTNNH-LUAWRHEFSA-N 333.362 5.218 30 20 EKED O=C(/C=C/c1cnn2ccccc12)c1ccc(-c2ccc(F)cc2)s1 729644641 ZFCPBADRKYATKO-RMKNXTFCSA-N 348.402 5.098 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 731400531 QNJLPOHUDBTSJU-CABCVRRESA-N 333.501 5.171 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1nc(-c2ccccc2)cs1 740765508 DQMUTPCMIYIZJM-KHPPLWFESA-N 342.423 5.254 30 20 EKED CCOc1cc(/C=C/C(=O)c2coc3ccccc23)cc(Cl)c1O 747705594 OIOLCMOQVCAQTQ-BQYQJAHWSA-N 342.778 5.087 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1 753141080 GEOURJXNEADINZ-FPLPWBNLSA-N 334.444 5.225 30 20 EKED C[C@H](Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(C#N)c(F)c1 776801865 CEUMSWQCGQUULY-VIFPVBQESA-N 340.732 5.125 30 20 EKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1cnn(C2CCCC2)c1 799897356 SOBMWPSRZJHOSW-KHPPLWFESA-N 349.459 5.018 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ncc(-c2ccccc2)s1 811645746 BCPWFYMKVYVEBI-UHFFFAOYSA-N 348.349 5.242 30 20 EKED C[C@@H](C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc2ccccc2c1 842941093 NKVROLNEOJXGAB-FZKQIMNGSA-N 346.455 5.154 30 20 EKED C=CCCCCC[C@@H](C)N[C@@H](C(=O)O)c1ccc2ccccc2c1 901514374 GMHPXAQOFJURNX-OXQOHEQNSA-N 325.452 5.080 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc(C2(C(=O)O)CC2)cc1 1776786047 GKLOHKVLOOCLAB-MRXNPFEDSA-N 345.483 5.128 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)s1 66802016 KDCAVMRYZBZAKV-NSHDSACASA-N 330.478 5.012 30 20 EKED CCC[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 90664436 KBGLZDLJWOCPDN-VQTJNVASSA-N 337.423 5.071 30 20 EKED C[C@@H](SCc1ccc(-c2ccccc2C#N)cc1)c1cnccn1 185696966 RNMUNWNKZZECCP-OAHLLOKOSA-N 331.444 5.010 30 20 EKED CCCCCCCCC(=O)N1CCC(Nc2cccc(C)c2)CC1 303829703 HBBQOGAVGYIBPW-UHFFFAOYSA-N 330.516 5.149 30 20 EKED CC(O)=Nc1cc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)ccc1F 328975035 BECOLEZLGNVYAH-VNQPRFMTSA-N 332.419 5.628 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(C)ccc1OC 340449173 LDOGILNZKIDBQL-RTWAWAEBSA-N 336.479 5.480 30 20 EKED C[C@@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccsc2S1 340450303 MDNRCZHJYVSMCT-ZTFGCOKTSA-N 342.533 5.698 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(F)F)nc1 451329772 KTQBRLUPAQIJPU-UHFFFAOYSA-N 344.405 5.298 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccc(Cl)c2ccccc12 462479426 LOUXAWNRIRMFPU-CYBMUJFWSA-N 338.813 5.355 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 506211353 FYMDYNXFRMUHEE-IBGZPJMESA-N 342.870 5.037 30 20 EKED C[C@H]1[C@H](C)CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 510049205 KCLLVEPINCNVRN-CVEARBPZSA-N 349.434 5.003 30 20 EKED C[C@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccc(C#N)cc1 532465916 VQMRVTHVYSJOKJ-SJCJKPOMSA-N 328.868 5.099 30 20 EKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)cc2)cc1 536162877 ILQZWNIBFXSQII-HXUWFJFHSA-N 333.435 5.051 30 20 EKED Cc1ccc(C)c([C@H](NCc2ccc(C#N)s2)c2ccccc2)c1 553711811 KUNPJOHSHQHDCC-OAQYLSRUSA-N 332.472 5.116 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1nc(-c2ccccc2)cs1 564428798 YHSSMDFQMYHNSO-LIRRHRJNSA-N 345.471 5.020 30 20 EKED CN(Cc1nc(C#N)cs1)[C@H](c1ccc(Cl)cc1)C1CCCC1 573650727 GPEAFHZYRAUVNV-SFHVURJKSA-N 345.899 5.031 30 20 EKED CC[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCCC1 590067683 GJQNALNKDRKRJW-UXHICEINSA-N 341.499 5.080 30 20 EKED N#CCc1ccc(CN[C@@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 599051168 GXCQSJXGKJBOFQ-HXUWFJFHSA-N 349.865 5.055 30 20 EKED CCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 726858187 GCFZGKNFNRXZSE-CYBMUJFWSA-N 332.856 5.076 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 729892416 YGFQUILHLWXNIH-HOCLYGCPSA-N 326.465 5.059 30 20 EKED Cc1cc(C)cc(C(=O)/C=C\c2ccccc2OCc2ccccn2)c1 730435969 DXPCWHSTBGQQNM-KHPPLWFESA-N 343.426 5.174 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1cc(Cl)ccc1Cl 742429295 LCIHLOJALRGJTJ-CLFYSBASSA-N 343.213 5.280 30 20 EKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccsc2)cc1OC 749101553 HGWDUAOOSNCUAD-SNAWJCMRSA-N 336.840 5.095 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1csc(-c2ccccc2)n1 754708983 GZNRCFZIAXKLBA-UHFFFAOYSA-N 348.349 5.242 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3coc(-c4ccccc4)n3)oc2c1 754824025 HRXOGOJITHXGLF-KTKRTIGZSA-N 329.355 5.292 30 20 EKED CCCCCCCC[S@](=O)Cc1nc(-c2cccs2)oc1C 790138778 GNRWWBWKETUROU-QFIPXVFZSA-N 339.526 5.321 30 20 EKED C=CCCC[C@H](c1ccccc1)c1nc(-c2ccccc2OC)no1 904266858 PBNKLPPPGWVOSL-QGZVFWFLSA-N 334.419 5.233 30 20 EKED CCc1nc2cc(N=Cc3cc(Cl)cc(Cl)c3O)ccc2o1 917559673 SSLZGHPRPXGJOZ-UHFFFAOYSA-N 335.190 5.153 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc2cc(C)oc12 1776783700 FNLHRMFWMXBEOV-GOSISDBHSA-N 331.456 5.035 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1C(C)(C)C 1776787026 KOLGQBKHPSQTDC-GOSISDBHSA-N 333.516 5.278 30 20 EKED Cc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C 7276391 IOKUUKCRFOROEA-UHFFFAOYSA-N 326.399 5.094 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(SCC(F)(F)F)cc1 78694595 GUKWOHUTIHEIRO-VOTSOKGWSA-N 343.395 5.002 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1cccs1)c1ccccc1 160362887 GVDQCVWMDCYBQK-NVXWUHKLSA-N 328.481 5.158 30 20 EKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C#N)cc1 182102795 CXBZPBLJBSQTNI-PXAZEXFGSA-N 336.332 5.042 30 20 EKED Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)s1 188141873 CBUDIRHVUJERAI-UHFFFAOYSA-N 349.459 5.105 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCC[C@@H](C)CC1 443597055 YRTFTLQIIZABGI-PMPSAXMXSA-N 345.512 5.171 30 20 EKED CC[C@H](NCc1ccc(C(F)(F)F)cc1C)c1ccc(C#N)cc1 447594204 XOODUBRVXCKRLL-SFHVURJKSA-N 332.369 5.126 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)cc1 595411453 QEYRKKCMCNICTN-KUHUBIRLSA-N 328.843 5.043 30 20 EKED Cc1ccc(-c2ccc(CN[C@H](C)c3cccc(C#N)c3)s2)cc1 610344981 PJWSPDWBQOMBQR-MRXNPFEDSA-N 332.472 5.446 30 20 EKED C[C@H](CC#N)OC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 733709772 NNPURLNTNTZQMM-ZCFIWIBFSA-N 348.638 5.320 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)s1 758432402 AFIOTIOURQKQCO-FPLPWBNLSA-N 334.444 5.225 30 20 EKED CCCCCCC[S@](=O)Cc1coc(-c2cccc(Cl)c2)n1 764455064 PIWHUDHZSPSHGZ-QFIPXVFZSA-N 339.888 5.214 30 20 EKED CC(=NNc1c(Cl)cc(F)cc1Cl)c1nc(C)sc1C 767911424 SQMYZUHVHBSXCE-UHFFFAOYSA-N 332.231 5.042 30 20 EKED Cc1ccccc1[C@@H](NCc1cc(Cl)ccc1OCC#N)C(C)C 775406114 FUPGVDLESOLJAQ-FQEVSTJZSA-N 342.870 5.038 30 20 EKED C=CCCCCC[C@@H](C)Nc1ccc(Cl)c(C[S@@](C)=O)c1 793586592 JPMCWGAFOPMRIH-SPLOXXLWSA-N 327.921 5.155 30 20 EKED CC(/C=C\C(=O)c1ccnc(Cl)c1)=C/c1ccccc1OC(F)F 811693521 KFWNJMGECZGXPL-CEHXRRPISA-N 349.764 5.179 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCO2 815636040 NXXHZCZSXUXOAG-LEWJYISDSA-N 334.463 5.097 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=S)NCC(C)(C)CC#N 840846225 UZFOUBPHVFISDV-UHFFFAOYSA-N 331.529 5.160 30 20 EKED CCc1ccc(C=NOCc2coc(-c3cccc(Cl)c3)n2)cc1 914571977 XYNYOHVWOOLQBX-UHFFFAOYSA-N 340.810 5.108 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2ccccc2Cl)o1 915988204 SBJNZMQHPJYMGE-SOFGYWHQSA-N 329.808 5.261 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(F)cc1 916319351 NHWQKGSBJNIYAE-UHFFFAOYSA-N 332.593 5.017 30 20 EKED CCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917046517 KOLBWFFOWBCTRY-WCQYABFASA-N 334.872 5.342 30 20 EKED CCCCCCC[C@H](C)CNc1nc2ccccc2c(C)c1C(=O)O 1776782321 HQRYWKXRANZWBW-HNNXBMFYSA-N 342.483 5.650 30 20 EKED N#C[C@H](C(=O)c1sccc1-c1ccccc1)c1nc2ccccc2o1 41548090 QHLSXPHXGDNNMW-OAHLLOKOSA-N 344.395 5.046 30 20 EKED Cc1ccc2nc(/C=C/c3cccc(OCCCC#N)c3)ccc2c1 110398578 IPIUQERKYVHMPI-CSKARUKUSA-N 328.415 5.396 30 20 EKED CC(C)(C)c1cc(NC(=O)c2cccc(C(F)F)c2)c(C#N)s1 179544761 BGWRIJACENBMEE-UHFFFAOYSA-N 334.391 5.107 30 20 EKED C=CCCC[C@H](C)NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C 181398394 ANDUMSJYBKCSIP-ZFWWWQNUSA-N 337.533 5.022 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(OC(F)F)c1 193907239 YARILMQMHQHHKO-AWEZNQCLSA-N 346.377 5.144 30 20 EKED CC(C)CCc1nc(CN[C@H](CCCC#N)c2ccccc2)cs1 433016111 NQWLPSDRGZDAEE-LJQANCHMSA-N 341.524 5.256 30 20 EKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(C#N)cc1 439573095 OCOGDDUFENNGEG-MRXNPFEDSA-N 339.398 5.395 30 20 EKED C=C[C@@H]1CCCCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442796012 FNLWUXFXXAUJCN-GFCCVEGCSA-N 349.261 5.169 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(C#N)c1 464418664 HQRFLQQTWWCXNF-MRXNPFEDSA-N 334.463 5.376 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccccc1 476080278 OFRZEFDHEHUFCN-MRXNPFEDSA-N 339.504 5.658 30 20 EKED CC1(C)CCCC[C@@H]1CC(=O)N[C@@H](CCCC#N)c1ccccc1 487498515 FMKRWFVDKLSHME-MOPGFXCFSA-N 326.484 5.144 30 20 EKED C=CCCCN(C)C(=O)c1ccc(CSc2ccccc2)cc1 522946324 XDDBLFMBOFUCIN-UHFFFAOYSA-N 325.477 5.017 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 524882543 YPMYCFKEJDJYFN-GAJHUEQPSA-N 344.433 5.332 30 20 EKED CCc1c(C)sc(NC(=O)c2ccc(C)c(C)c2Cl)c1C#N 542164913 FOPHVZPBHQAEEZ-UHFFFAOYSA-N 332.856 5.013 30 20 EKED COc1ccsc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543851778 XDPWGSALOCYPTQ-HNNXBMFYSA-N 348.471 5.146 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C#N)c(Cl)c1 572573568 FOGHIMKWJYAYAE-UHFFFAOYSA-N 340.854 5.540 30 20 EKED CC(C)n1ncc2ccc(NCc3ccc(C(C)(C)C#N)cc3)cc21 594505573 UXWHIJPSFODGLJ-UHFFFAOYSA-N 332.451 5.030 30 20 EKED CCC(C)(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 608847634 UTNXMHJULWGSOP-QGZVFWFLSA-N 340.854 5.370 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)C(C)(C)C 609651521 GVJXAPILRQBWDS-OAHLLOKOSA-N 336.435 5.280 30 20 EKED CC(C)CCN1Cc2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2C1 609824874 BUISCRCHBYXDSU-KRWDZBQOSA-N 333.479 5.093 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)cc(Cl)c1 619755939 ZVAXSSWNILFKTN-JTQLQIEISA-N 339.653 5.369 30 20 EKED Cc1cc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)c(C)s1 727264006 LGAJIVOOUYWARC-CMDGGOBGSA-N 325.458 5.385 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 729068179 XIDCFZKZQQLSAT-ZBFHGGJFSA-N 334.444 5.056 30 20 EKED C[C@](C#N)(NC(=O)c1sc2ccccc2c1Cl)C1CCCCC1 734238987 VYCALUFLGFAWRL-GOSISDBHSA-N 346.883 5.147 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 756518895 JOALYZYVAALUFX-VSOYFRJCSA-N 346.817 5.168 30 20 EKED FC(F)(F)C1CCC(C=NNc2ncc(Cl)cc2Cl)CC1 767361196 NZFPQTVFAMEEJO-UHFFFAOYSA-N 340.176 5.155 30 20 EKED C#CC[C@H](N[C@@H](CC)c1ccccc1OC(F)F)c1ccccc1 773106235 KWTXMQDDIKZBHW-ROUUACIJSA-N 329.390 5.093 30 20 EKED C[C@@H](NCc1ccc2oc3ccccc3c2c1)c1ccc(C#N)cc1 775160324 ZFOLEWCUMJJNML-OAHLLOKOSA-N 326.399 5.308 30 20 EKED Cc1c(N[C@@H](C)c2ccc(OCC#N)cc2)cccc1C(F)(F)F 777626337 CWUMDABJFRBKOO-ZDUSSCGKSA-N 334.341 5.089 30 20 EKED C=C(C)[C@H](N[C@@H]1COCc2cccc(Cl)c21)c1ccc(F)c(F)c1 788753026 HIRRJMPEWXNMJU-MJGOQNOKSA-N 349.808 5.097 30 20 EKED CN(CCC(C)(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 831230122 DXMOALWMZHSGFU-FQEVSTJZSA-N 349.478 5.242 30 20 EKED C=CCCC(C)(C)NC(=O)Nc1cccc(C2SCCS2)c1 854249687 IHWWROAKYBXPDP-UHFFFAOYSA-N 336.526 5.032 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776700116 ZOWULIDSTHZSCA-MARXPDLDSA-N 347.414 5.276 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1Br 90665367 RDZYVNYNWQHKDL-KSSFIOAISA-N 343.268 5.145 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)(F)F 90665614 SSXJENLEVHMIDD-PBHICJAKSA-N 348.368 5.281 30 20 EKED C[C@H]1C[C@H](N[C@@H](CCC#N)c2ccccc2)c2ccsc2S1 90665809 DELGUWZUKWGUOZ-JQFCIGGWSA-N 328.506 5.308 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CC[C@@H](C)c2ccccc2)n1 161084849 MNMZGAKEFCANGF-GDBMZVCRSA-N 326.465 5.027 30 20 EKED COc1ccc(-c2csc(CN[C@@H](C)c3ccc(C#N)cc3)c2)cc1 177484187 NQQYGNGHLQMNQZ-HNNXBMFYSA-N 348.471 5.146 30 20 EKED N#Cc1c(Cl)nsc1N[C@@H](Cc1ccccc1)c1cccs1 301957793 NWTRFPMVBRQIMS-ZDUSSCGKSA-N 345.880 5.126 30 20 EKED CC[C@H](CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1)c1ccc(C)cc1 303865199 PPEPBJWQARSEGQ-UYAOXDASSA-N 348.490 5.360 30 20 EKED Cc1nc(C2CC2)oc1/C(O)=N/[C@H](C)C1(c2ccccc2)CCCC1 330039237 FGBHZUFUPCRTLR-OAHLLOKOSA-N 338.451 5.066 30 20 EKED CC[C@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 447581424 UKGVBKUMQFZNMO-BEFAXECRSA-N 347.487 5.484 30 20 EKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1(C#N)CC(C)C1 532074598 ZOJTYMDESWKZIR-YSJWXEPDSA-N 348.446 5.013 30 20 EKED C=C[C@@H](CC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 535334236 ZJPYRKGCTYDVBX-INIZCTEOSA-N 333.456 5.714 30 20 EKED COc1cccc(CNc2ccccc2S[C@@H](C)CC#N)c1Cl 594706413 XZTZPXULZPGVAM-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2cccc(COC(C)(C)C)c2C)C1 666256717 SVDRCNXKFCUIGE-QGZVFWFLSA-N 344.499 5.130 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1cc2c(ccc3ccccc32)o1 728700960 ZBCSRUGSJUKSIE-VQHVLOKHSA-N 333.774 5.531 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2scnc2C)cc1 742435077 RTXWDOQKXKROJL-QXMHVHEDSA-N 335.428 5.023 30 20 EKED CCC[C@H](CC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744766313 NLZGWWJTKRTZBH-ICSRJNTNSA-N 335.451 5.042 30 20 EKED COc1ccc(N(CCCC(C)(C)C#N)Cc2cccs2)cc1 746666054 IBTPYKRKFFITHE-UHFFFAOYSA-N 328.481 5.093 30 20 EKED CCC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCC1 752635330 FLQDSUSXPJXDIF-FQEVSTJZSA-N 347.462 5.044 30 20 EKED CC(C)CCC[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1 772957365 DUOGDVDEGSLNKO-QFIPXVFZSA-N 336.479 5.246 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C\c2ccc3ncccc3c2)cc1Cl 773160667 OTIWTEWVPISTFR-XQRVVYSFSA-N 343.213 5.020 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(Cl)ccc1O 775533918 SEGPTEWGTHOKLH-GOSISDBHSA-N 344.842 5.291 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nccc3ccccc23)CCC(F)(F)CC1 850985101 DHCHYCCARMENJL-INIZCTEOSA-N 342.389 5.017 30 20 EKED C[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 915350537 XTCRLDAMGQEQSD-MAODMQOUSA-N 347.462 5.042 30 20 EKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCCCC1 915353314 SKULLGVMUBUGRX-NRFANRHFSA-N 347.462 5.138 30 20 EKED C[C@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1cccc(C#N)c1 181901631 NGOPWVBGGRAKFJ-YCRPNKLZSA-N 347.849 5.047 30 20 EKED C[C@@H](Cc1nnc(S[C@@H](C)c2cccc(C#N)c2)o1)c1ccccc1 189796692 ZFNFCKLVDUYUBT-GJZGRUSLSA-N 349.459 5.141 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CCCC1)C1CC1 191438482 BNUVRFBGPXEJCG-UHFFFAOYSA-N 326.484 5.477 30 20 EKED N#CCC[C@H](Nc1ncnc2sc3c(c12)CCCC3)c1ccccc1 301779011 IMMPDDPDYMAWPR-INIZCTEOSA-N 348.475 5.027 30 20 EKED CC(C)(C)Cc1nc2cc(N=C(O)C3CCSCC3)ccc2o1 329409709 CSOHSNMYPDGWHS-UHFFFAOYSA-N 332.469 5.148 30 20 EKED N#CCCC[C@@H](NC/C=C\c1ccc(F)cc1F)c1ccccc1 353914682 KZKHJACGLNQDRC-QKWWCAPFSA-N 326.390 5.003 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C)CCC#N 411526237 DCZRISJURNDLQC-NEPJUHHUSA-N 333.888 5.115 30 20 EKED N#C[C@H]1CC[C@@H](N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)C1 429696350 IKMRMHMZPZLGTF-WMLDXEAASA-N 335.278 5.165 30 20 EKED CCN(CC1CCC1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 432063545 QUANCTLJJJAPQW-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCC[C@H](N[C@H]1C[C@H](C)n2ccnc21)c1ccc(C(F)(F)F)cc1 453175629 QIGBBUJGSQYYTF-JQFCIGGWSA-N 349.400 5.205 30 20 EKED Cc1ccc(F)c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 466962346 UVGGRSHZUUYISN-ZDUSSCGKSA-N 343.427 5.172 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1cccc(C)c1C 473361491 PSKXGWPGMVLPQR-NRFANRHFSA-N 347.462 5.243 30 20 EKED N#CC[C@@H](CC(=O)N[C@H](c1ccccc1)C1CCCC1)c1ccccc1 475028989 HOVMCBHVVMPRFZ-JTHBVZDNSA-N 346.474 5.122 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1C 476082829 XXUUUKMYRNBBII-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C=C(C)[C@@H](N[C@H]1CCSc2ccccc21)c1ccc(F)c(F)c1 480670027 VXUJMPMIVYVUBM-PKOBYXMFSA-N 331.431 5.409 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cnc2ccsc2c1)c1ccc(F)c(F)c1 480678142 SHZIDDSVKSEWPO-BLVKFPJESA-N 344.430 5.543 30 20 EKED C=CCC[C@H](NCc1ccc(C)nc1C)c1ccc(C(F)(F)F)cc1 480881620 AXVOMWJBLPZGMO-IBGZPJMESA-N 348.412 5.514 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccccc1OC1CCC1 481649391 DWBVJISKDNTUHS-QFIPXVFZSA-N 346.474 5.047 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1F 512630894 ORXHWCHAEHPHKT-OYHNWAKOSA-N 348.396 5.277 30 20 EKED C=CCC[C@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccco1 513666058 JANAJNKRXUSPAP-INIZCTEOSA-N 339.357 5.018 30 20 EKED N#C[C@@H](Sc1nnc(-c2ccc3ccccc3c2)o1)C1CCCCC1 522332845 QKILRJITVJKRCW-GOSISDBHSA-N 349.459 5.454 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 524832554 ZAVRVFOJCQQKHB-XUWVNRHRSA-N 345.512 5.027 30 20 EKED CC(C)(CCC#N)CN1CC=C(c2ccccc2C(F)(F)F)CC1 538803711 TVXIYYJXODGIKH-UHFFFAOYSA-N 336.401 5.124 30 20 EKED CC(C)(C#N)CCCN[C@H](c1ccc(Br)cc1)C1CCC1 540376410 FQTMFYRIKHECBA-KRWDZBQOSA-N 349.316 5.210 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 540604859 ALUCFZLUQNYVIX-UZLBHIALSA-N 332.472 5.254 30 20 EKED CC(C)(CCC#N)CN[C@@H](c1ccccc1)c1ccc(Cl)cc1 567637595 BHXXPQNICBTGEX-IBGZPJMESA-N 326.871 5.349 30 20 EKED Cc1c([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 570590213 HWPNZJGNTYVWRS-QRWLVFNGSA-N 330.431 5.341 30 20 EKED COc1cc(CN[C@H](C)c2ccc(-c3ccccc3)s2)ccc1C#N 577328674 HMLGXMWSEHBMSO-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)F)nc1 595038136 JOGKHLDPORBXEZ-YOEHRIQHSA-N 329.394 5.105 30 20 EKED C=CCCCSCc1csc(-c2ccc(OC)c(OC)c2)n1 609804002 UPKJZUMOVAKNSP-UHFFFAOYSA-N 335.494 5.027 30 20 EKED C(=NN=C1c2ccccc2-c2ccccc21)c1nccc2ccccc12 740761138 WCDLRWYLFJHVIJ-UHFFFAOYSA-N 333.394 5.087 30 20 EKED FC(F)(F)c1ccc2sc(NN=C[C@H]3CC=CCC3)nc2c1 743445389 SBCBKQQBOQOGTF-JTQLQIEISA-N 325.359 5.069 30 20 EKED CC(=NNc1c(Cl)cc(F)cc1Cl)c1cnn(C(C)C)c1C 787164381 ZDVPLKYBHIXJDN-UHFFFAOYSA-N 343.233 5.054 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C\c1cc(C)c(C)cc1C 1776783287 MSEMAKCZFMFRSX-KUFMOJEASA-N 345.527 5.418 30 20 EKED Cc1cc2occ(CC(=O)Nc3ccc(CC#N)cc3)c2cc1C(C)C 24179045 ZXNURVHEKZSPNA-UHFFFAOYSA-N 346.430 5.112 30 20 EKED CC(C)(C#N)CCC[S@](=O)[C@H]1CCc2c(Cl)cc(Cl)cc21 153769000 NBEMHKCNYUTKHV-YCRPNKLZSA-N 344.307 5.059 30 20 EKED CC[C@@]1(C)CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 173123076 VHDAPHPHXKHJGO-KXBFYZLASA-N 345.512 5.125 30 20 EKED C[C@H](Nc1cccc(NC(=O)C2CCCCC2)c1)c1cccc(C#N)c1 180028427 VHFGRKGNMCSSCF-INIZCTEOSA-N 347.462 5.250 30 20 EKED N#Cc1ccc(CN[C@H](CCCc2ccccc2)c2ccccc2)o1 237843746 VSEBIZOMZHDQDB-JOCHJYFZSA-N 330.431 5.005 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C(/Cl)c2nc3ccccc3s2)cc1 255445452 HZNZKYHAOWPDCG-XBUHWIKASA-N 340.835 5.324 30 20 EKED C[C@H](NCc1ccc([C@H](C)C(F)(F)F)cc1)c1ccc(C#N)cc1 296179274 CRYDBKHTBVEFRB-KBPBESRZSA-N 332.369 5.075 30 20 EKED CC[C@H](C)[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 302936610 IJAJODODQDDPKI-JXFKEZNVSA-N 334.463 5.256 30 20 EKED CC(C)(C)C1CCC(C/C(O)=N/[C@H]2CCC(O)=NC23CCC3)CC1 328711952 BIHASXSVZDTEOZ-GPANFISMSA-N 334.504 5.227 30 20 EKED C=CCC(C)(C)CNC(=O)Nc1cccc(COC(C)(C)C)c1C 433007869 WNTPUEGHBPYMTP-UHFFFAOYSA-N 332.488 5.034 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(F)cc1)c1ccccc1 435100128 CAHWOXUVSZMYAA-JXFKEZNVSA-N 340.442 5.236 30 20 EKED CC(C)(C#N)CCCCNC(C)(C)c1cccc(C(F)(F)F)c1 444624953 GQKVUQYAOOOPQY-UHFFFAOYSA-N 326.406 5.250 30 20 EKED C=CC[C@H](CC)NC(=O)c1ccccc1SCc1cccs1 466523862 BDSHSDRYKYRWPM-AWEZNQCLSA-N 331.506 5.125 30 20 EKED CCCC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(OC)cc1 512620687 SDAVHVSIDJBYAT-QVKFZJNVSA-N 340.442 5.288 30 20 EKED C[C@@H](SCc1ccc(Br)s1)c1ccc(C#N)cc1 522840672 YNALRNLGYUXBHY-SNVBAGLBSA-N 338.295 5.377 30 20 EKED N#CCSCCCS[C@@H](c1ccccc1)c1ccc(F)cc1 549197389 SSNOPYWMAXQDON-SFHVURJKSA-N 331.481 5.295 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 556203538 RUNMMQOUXMYNBP-BEFAXECRSA-N 346.396 5.791 30 20 EKED C[C@@H](CCCC(F)(F)F)NCc1cc(F)c(C(F)(F)F)cc1F 558258398 VCRRAEOUQHNHCB-QMMMGPOBSA-N 349.265 5.194 30 20 EKED CC(C)OCc1ccccc1CNc1ccc(C#N)c(C(F)(F)F)c1 609448906 GVJKDHXSFFBTAJ-UHFFFAOYSA-N 348.368 5.114 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccc(CC)cc1 609967847 LAYSYQJDXLTWAT-GOSISDBHSA-N 348.490 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(c2ccccc2)C1 621458923 TWRMOOPZTFFTRZ-UHFFFAOYSA-N 348.490 5.344 30 20 EKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2c(C)noc2C)cc1 727781173 GETBQDFULDNIPJ-SEYXRHQNSA-N 347.414 5.075 30 20 EKED COc1ccc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)cc1 734303444 PTQZPIPXQJKGOQ-QXMHVHEDSA-N 335.428 5.023 30 20 EKED CCSc1ccc(Cl)cc1N[C@H](C)c1ccc(OCC#N)cc1 777677349 JJHJBOXQDSBQQM-CYBMUJFWSA-N 346.883 5.527 30 20 EKED C=CCC(C)(C)C(=O)OCC(=O)Nc1c(C(C)C)cccc1C(C)C 796461576 MGZCJKDGWHWHDC-UHFFFAOYSA-N 345.483 5.017 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776697863 SXFNLGKXOOCJOQ-BSYHEUMXSA-N 342.822 5.448 30 20 EKED CSc1ccc2cc(CNc3cccc(C#N)c3)c(Cl)nc2c1 15294507 BYVYKJGEEFXLDA-UHFFFAOYSA-N 339.851 5.094 30 20 EKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)oc2c(C)cccc12 66504637 VWLVCPBDAAPWMF-AWEZNQCLSA-N 346.411 5.149 30 20 EKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 175947507 UZLPBQIJALOVJP-ZDUSSCGKSA-N 347.409 5.214 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1ccc(-c2cccnc2)cc1 187439292 KQBUTMKJOYMPRX-HNNXBMFYSA-N 347.849 5.124 30 20 EKED Cc1c(N=C(O)[C@@H](C)/N=C(/O)C2CCCCC2)sc2c1CCCC2 329777265 OWSDUPVNNRLXQX-CYBMUJFWSA-N 348.512 5.449 30 20 EKED Cc1cc2cc(NC(=O)c3sc4ccc(C#N)cc4c3C)ccc2[nH]1 431950810 GJONCSVPEJIALL-UHFFFAOYSA-N 345.427 5.123 30 20 EKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCCCC1 438041565 MXAWBUNZNOHEKK-CABCVRRESA-N 345.512 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC(O)(CCC)CCC 476794337 MVBDWGKMIYDIJH-UHFFFAOYSA-N 331.500 5.198 30 20 EKED N#CC1(CCCOc2cc(Cl)c(Cl)cc2Cl)CCOCC1 499908971 UHFGGWDESBFUBX-UHFFFAOYSA-N 348.657 5.126 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cc1cc(Cl)cc2cccnc12 516198766 PVMUWIKQGNFFJG-UHFFFAOYSA-N 349.865 5.172 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCCC(C)(C)C1 535155233 AOJZOEMDZGZROD-GJZGRUSLSA-N 330.497 5.093 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1cccc(C#N)c1 537293827 INZOCWGZZURMPH-BFUOFWGJSA-N 328.406 5.274 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)CCC(C)(C)C#N 540688253 UWYBRJLIMGCGPK-OAHLLOKOSA-N 327.497 5.051 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC[C@H](C(F)(F)F)C1 573824733 QKYOUPBRRIXIKD-CABCVRRESA-N 339.401 5.456 30 20 EKED C=CCC[C@@H](NCc1cccc(NC(=O)CC(C)C)c1)c1ccco1 575010387 ONQJFIMKXXNOBY-LJQANCHMSA-N 340.467 5.061 30 20 EKED C[C@@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccc(C#N)cc1 603633304 UQRQELLRQKYYEK-GOSISDBHSA-N 341.458 5.177 30 20 EKED N#Cc1ccc(SCc2coc(-c3ccc(Cl)cc3)n2)c(F)c1 610219107 WYVCGGDCVJXNNT-UHFFFAOYSA-N 344.798 5.298 30 20 EKED CC(=NNc1ccc(F)cc1)c1csc(-c2csc(C)n2)c1 729140929 PNKQKWSYRRSGCT-UHFFFAOYSA-N 331.441 5.155 30 20 EKED C=CCCCN(C)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 736524722 BFUUSIXIHURYPZ-UHFFFAOYSA-N 348.421 5.079 30 20 EKED O=C(/C=C/c1cnc2ccccn12)c1ccc(Oc2ccccc2)cc1 740764484 WRRZNODRTSCLJI-SDNWHVSQSA-N 340.382 5.023 30 20 EKED COc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1F 747195111 SETTWSYJBWHDQE-RQOWECAXSA-N 331.195 5.099 30 20 EKED CC(C)[C@H]1/C(=C/c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 766505496 JCICBZDKIHKZGE-ZYNFKGNASA-N 346.455 5.225 30 20 EKED C#Cc1cccc(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c1 770129312 OGTCZMYQFWLBIB-IBGZPJMESA-N 338.838 5.080 30 20 EKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1c[nH]c2ccccc12 770574142 WIANKYHGKATKDU-ZHACJKMWSA-N 330.412 5.188 30 20 EKED CC1(C)C/C(=C/c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 794970213 WZKFONKYELWWCG-PTNGSMBKSA-N 346.455 5.153 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)C(C)(C)C)n2)cc1 815910839 JHSSIMFLRYIRCA-OAHLLOKOSA-N 340.492 5.367 30 20 EKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccccc1C(F)(F)F 850073254 GAMPKDRJYIKSOD-AWEZNQCLSA-N 344.380 5.111 30 20 EKED C[C@@H](CC(C)(C)C#N)OC(=O)c1ccc(C2SCCCS2)cc1 851213051 COXURJNYAAIBDV-ZDUSSCGKSA-N 349.521 5.040 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(F)cc1C(F)(F)F)c1ccncc1 858365924 VBWWMQYGBBXGAE-YVEFUNNKSA-N 338.348 5.208 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)cc1 915087521 UPJDNSBIJBYWOH-CJFIXGCPSA-N 344.458 5.107 30 20 EKED N#CCCCOc1cccc(NCc2ccc(-c3ccccc3)s2)c1 327379960 ODFSYMAQOHMUKC-UHFFFAOYSA-N 348.471 5.710 30 20 EKED CCC[C@@H](/N=C(/O)Cc1ccc2c(c1)N=C(O)C2)C1CCCCC1 329625281 GITRTTCDKSRAAV-QGZVFWFLSA-N 328.456 5.079 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1cccc(OCc2ccccc2)c1 434796234 SXEUJLAUACTPLK-INIZCTEOSA-N 348.471 5.050 30 20 EKED N#CCc1ccc(NC(=O)N(Cc2ccccc2)C2CCCCC2)cc1 437625009 NWWBGQOMAGGVSW-UHFFFAOYSA-N 347.462 5.119 30 20 EKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1cccc(C#N)c1 442896330 CGRFMNPAJRWSBD-NSHDSACASA-N 332.350 5.302 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 474695473 CLMWUQJVGJJEEG-GOSISDBHSA-N 348.446 5.034 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 512668778 WOAREHQSZDWJHR-UZUQRXQVSA-N 344.433 5.332 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)c(F)c1 540709262 JVCUMSNDSHMPBH-DJJJIMSYSA-N 328.406 5.274 30 20 EKED COc1cccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542948103 RUIOJIRRYRKPPU-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@H]1C[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC[C@H]1C 543594576 SUQYMSAVIWCKRP-QKPAOTATSA-N 345.512 5.027 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H]1CC[C@@H](C#N)C1 555425020 WBXVZALMUFRXQK-GHJWDPDVSA-N 345.899 5.115 30 20 EKED C[C@@H](SCc1nc(C#N)cs1)c1cccc(C(F)(F)F)c1 594912015 SPKJKOQTLRSBDV-SECBINFHSA-N 328.384 5.028 30 20 EKED Cc1nc(C)c(C#N)c(S[C@H](C)c2ccc(Cl)cc2Cl)n1 603946851 REYOZEXJHDUUDH-SECBINFHSA-N 338.263 5.125 30 20 EKED C=CCCCSCC(=O)c1cc(C)n(Cc2cccs2)c1C 609804835 MVMJZMSOQIOYLN-UHFFFAOYSA-N 333.522 5.097 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1c(C)cc(C)cc1Cl 620999753 GBERNGSHTXCZRI-UHFFFAOYSA-N 342.870 5.219 30 20 EKED Cc1oc(-c2ccccc2)cc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 626467382 QEQIPUIAWWTNLM-MRXNPFEDSA-N 348.427 5.079 30 20 EKED CC[C@H](/N=C\c1cc(Cl)ccc1O)c1nc(C(F)(F)F)cs1 745976944 OYPLVDXECNPIIO-OPJQEUEOSA-N 348.777 5.091 30 20 EKED C#CC[C@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccccc1 773104743 FSODCPUVURPPRK-ROUUACIJSA-N 327.880 5.231 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc(Br)ccc1F)c1ccccc1 773117146 UDZHJTLDETVWSY-UGSOOPFHSA-N 346.243 5.003 30 20 EKED O=C(/C=C/c1nccn1Cc1ccccc1)c1cc2ccccc2s1 780188341 LSOPSIDPIJSSLY-ZHACJKMWSA-N 344.439 5.042 30 20 EKED O=C1/C(=C\c2scnc2C2CC2)CCSc2ccc(Cl)cc21 782340758 GFODOOMCPGFEBU-XFFZJAGNSA-N 347.892 5.436 30 20 EKED C[C@H](Oc1ccc(C(=O)Nc2sccc2C#N)cc1)c1ccccc1 788423889 RYNJOSKCHYLJNI-AWEZNQCLSA-N 348.427 5.012 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797572633 DWWJILLSTGLYMJ-ZBFHGGJFSA-N 340.492 5.201 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(Br)ccc1C)c1ccncc1 858364501 FVBPFOHZBXFBRX-KSSFIOAISA-N 345.284 5.121 30 20 EKED C#Cc1cccc(NC(=O)c2sc3cccc(C)c3c2Cl)c1 874512873 UJURHDTYKQXXRK-UHFFFAOYSA-N 325.820 5.097 30 20 EKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 193728856 FOQNFIZPBDRSIX-HXUWFJFHSA-N 347.462 5.165 30 20 EKED CC(C)(C)[C@@H]1CCCC[C@@H]1/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 329957913 MGLUGGDPYCCMOY-HIEASXQVSA-N 348.531 5.473 30 20 EKED N#Cc1cc(Cl)ccc1N[C@H]1CCCc2cn(C3CCCC3)nc21 445591168 KEGGSUIROAUKAQ-SFHVURJKSA-N 340.858 5.013 30 20 EKED CC[C@@H](Nc1cccc(CN2CCCCC2)c1)c1ccc(C#N)cc1 447574624 NUSQDLJENMJQFN-JOCHJYFZSA-N 333.479 5.107 30 20 EKED CC1(C#N)CCC(N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 449297439 CSIKOQZITOUHNX-RSWLEGOBSA-N 336.401 5.013 30 20 EKED Cc1nc(C(C)C)ccc1CNc1ccccc1SC[C@@H](C)C#N 453077064 AJTDVFFKAFTTFT-HNNXBMFYSA-N 339.508 5.377 30 20 EKED CC[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 457489835 MFEPNZZTTGUNEN-RTWAWAEBSA-N 349.478 5.181 30 20 EKED Cc1nc(N[C@@H](C)c2ccc(-c3cccnc3)cc2)c(Cl)cc1C#N 461958199 QNFUUZXZLPOEGI-ZDUSSCGKSA-N 348.837 5.150 30 20 EKED CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](C)CC#N 475773876 NCPWCNBQTNDXIU-XHSDSOJGSA-N 330.497 5.236 30 20 EKED CCC(CC)CN(CCC#N)Cc1cnc(-c2ccsc2)s1 513725103 LYDCQGVPEKDRJN-UHFFFAOYSA-N 333.526 5.023 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2F)s1)c1ccc(C#N)cc1 520962100 PPRRTNIGVQJBRH-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1 521702518 DQOJYVMHZXFJHT-NRFANRHFSA-N 329.403 5.309 30 20 EKED CCCCCCCCOC(CCC(=O)O)OCCCCCCCC 584600544 KQOYZXMRNJNKNZ-UHFFFAOYSA-N 344.536 5.932 30 20 EKED C=C(C)COc1cccc(NC(=O)c2[nH]c3ccccc3c2Cl)c1 589552903 MCJVCWRPDGKFEC-UHFFFAOYSA-N 340.810 5.029 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)[C@H](C)CC#N)c(C(F)(F)F)c1 598807082 DEKUDGHICNNDNE-GHMZBOCLSA-N 344.402 5.084 30 20 EKED CC(C)c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611093289 VOOULZWLGOBFFF-UHFFFAOYSA-N 333.218 5.241 30 20 EKED C[C@@H](NCc1ccc(Oc2ccccc2)c(F)c1)c1cccc(C#N)c1 611386358 IIFSCJKXGFRJEY-MRXNPFEDSA-N 346.405 5.340 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCC(C)(C)C#N 611621092 XRBOKSHLPGZMCW-UHFFFAOYSA-N 345.512 5.091 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(NC)ccc1Cl 626633574 CMGBJQXITRWMMJ-UHFFFAOYSA-N 342.870 5.486 30 20 EKED CCCCCCCCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730421960 ROYJLWRNVZNGDV-CQSZACIVSA-N 332.444 5.362 30 20 EKED CC(C)CCOc1cccc(N[C@@H](C)c2ccc(OCC#N)cc2)c1 776887147 VGBHRQAIQSXPDR-KRWDZBQOSA-N 338.451 5.187 30 20 EKED CC[C@@H](C(=O)OCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 798877224 QJXUIDOKEPXYPM-OAHLLOKOSA-N 341.373 5.072 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@]1(C)CC1(Cl)Cl 830898284 YMTFXTRPKOZZMR-KRWDZBQOSA-N 340.294 5.451 30 20 EKED O=C1/C(=C\c2ccsc2)CCOc2c1ccc(Cl)c2Cl 921138445 LMEMLQZMEYFOCJ-YFHOEESVSA-N 325.216 5.104 30 20 EKED Cc1ccc(C)c(/N=C(\O)N2CCC[C@H]2c2ccccc2Cl)c1 82095455 UWGIBTHNFFDSLJ-SFHVURJKSA-N 328.843 5.339 30 20 EKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(C(C)(C)C)s2)c1 127305433 UKNXGNWVXNHMTQ-MRXNPFEDSA-N 342.508 5.016 30 20 EKED CC[C@H](C)N(Cc1ccccc1)C(=O)N[C@H](CCC#N)c1ccccc1 160598921 ZRSXKEJDBJLHIN-GHTZIAJQSA-N 349.478 5.042 30 20 EKED C[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(OCC#N)cc1 180541256 BRPHLNDZOLVUFW-CHWSQXEVSA-N 349.261 5.308 30 20 EKED Cc1ccc(C(=O)[C@@H](C#N)c2ccccn2)c(Sc2ccccc2)c1 181484647 GWRHCGVRAIJRKC-SFHVURJKSA-N 344.439 5.031 30 20 EKED C[C@H](Nc1ccc2nc(C3CC3)sc2c1)c1ccc(OCC#N)cc1 182975244 GBGTVTANQLFFSR-ZDUSSCGKSA-N 349.459 5.249 30 20 EKED CC(C)C[C@@H](NCc1cccc(OCCCC#N)c1)c1cccs1 236623382 BKVUZQHELJNVES-LJQANCHMSA-N 342.508 5.308 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1O 436979832 MWLVBSZFMZPMDL-UHFFFAOYSA-N 329.827 5.150 30 20 EKED CC(C)c1ccc(-c2noc(CSc3ccc(C#N)cc3)n2)cc1 509663643 FZTZRDRAAQHAFA-UHFFFAOYSA-N 335.432 5.024 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1F 512614950 XTFAXCHVATUVER-NYHFZMIOSA-N 348.396 5.277 30 20 EKED C[C@@H](Sc1cccc(F)c1C#N)c1nc2ccccc2n1C(F)F 518061697 OPWQETHDSHFOQI-SNVBAGLBSA-N 347.365 5.295 30 20 EKED N#Cc1ccc(SCc2ccccc2Oc2cccnc2)c(F)c1 524987684 YEKXXRXIQCUXJY-UHFFFAOYSA-N 336.391 5.177 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2cccs2)cc1 570168035 FMDYNFJREHOEQA-INIZCTEOSA-N 344.483 5.627 30 20 EKED CC(C)Oc1cccc([C@H](N[C@@H](C)c2ccc(C#N)cc2)C(F)F)c1 577395590 MBDJHPYECIMAOA-LIRRHRJNSA-N 344.405 5.002 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(-c2ccccn2)cc1)c1ccccc1 581520449 XTTVJWKFKMJWTH-KRWDZBQOSA-N 328.415 5.047 30 20 EKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C(C)C)cc1 615468658 OWFTTYRFUZEMKN-UHFFFAOYSA-N 338.451 5.039 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2Cl)nnc1-c1ccco1 670477201 TYWKTPYETUIARL-LBPRGKRZSA-N 345.855 5.231 30 20 EKED COc1ccc2oc(C(C)=NNc3cccc4ncccc34)c(C)c2c1 729141997 JSPYDWGNUCRKJR-UHFFFAOYSA-N 345.402 5.134 30 20 EKED Cc1ccsc1C(=O)/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1 733749076 QUXVVZSVHMILCV-VURMDHGXSA-N 339.372 5.121 30 20 EKED N#Cc1ccc(CNc2cccc(Cl)c2SC(F)F)c(F)c1 742261708 HRJMKAHQMWRTDP-UHFFFAOYSA-N 342.773 5.278 30 20 EKED N#CCOc1cccc(NCc2ccc(-c3ccc(Cl)cc3)o2)c1 779588865 RBIDEQXFJNQWCT-UHFFFAOYSA-N 338.794 5.114 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)cc1 788348915 GMRCBAWUGAJXKR-FPLPWBNLSA-N 325.355 5.181 30 20 EKED CC(/C=C\C(=O)c1ccc(C#N)s1)=C\c1ccccc1OC(F)F 811694235 UMLMTVQCKHXCMV-DEOFSOSHSA-N 345.370 5.064 30 20 EKED N#Cc1ccc(Br)c(CNc2cccc(C3CCC3)c2)c1 864028703 YSRGOHJYRUIUHW-UHFFFAOYSA-N 341.252 5.200 30 20 EKED C[C@@H](SCCC(=O)Nc1cccc(C#N)c1)c1ccc(Cl)cc1 62698564 CBJHUNDKZBMXCS-CYBMUJFWSA-N 344.867 5.035 30 20 EKED CC(C)c1ccc(-c2nnc(SCc3ccc(C#N)cc3)o2)cc1 66261165 FWPAZIWUMJWNNH-UHFFFAOYSA-N 335.432 5.024 30 20 EKED N#Cc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)c1 72067734 MOCLBJDRNKJKJB-CSKARUKUSA-N 333.774 5.368 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC1CCCCC1 108145968 AAHJHLJAHDLGSR-CQSZACIVSA-N 348.537 5.085 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)c1ccncc1 218950149 UTRUXVUVYWZSKX-FNORWQNLSA-N 325.820 5.360 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@@H](CCC#N)c1ccccc1 353314795 NJYLXAQNECYXLB-SFTDATJTSA-N 334.463 5.052 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1 447532356 TVUCDBNEGFGPCL-GAJHUEQPSA-N 341.458 5.422 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1 483038642 HFXODKGHXGCVTQ-UHFFFAOYSA-N 333.218 5.047 30 20 EKED C[C@H](c1cccc(C#N)c1)N1CCC(c2nc3ccccc3s2)CC1 487498616 LEYUCCXFBYPDAZ-OAHLLOKOSA-N 347.487 5.109 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccc(CC#N)cc1 488865093 SPLAHPJTPMPVIF-VOIUYBSRSA-N 339.504 5.060 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CC(C)(C)C#N)cc1 500410071 OJLXPBIRRQJILM-OAHLLOKOSA-N 338.476 5.418 30 20 EKED CC(C)[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512643752 YDXYQNLQVUIHFG-BLVKFPJESA-N 332.369 5.023 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 516984698 QTHRXQQXUCWSQL-BEFAXECRSA-N 344.405 5.374 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 539495741 CDWCTOVPDRQJAO-HXOBKFHXSA-N 344.433 5.332 30 20 EKED CCN(C(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(C#N)c(Cl)c1 540273795 WCGDKAZSJSCUJH-LBPRGKRZSA-N 347.245 5.022 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1C(F)(F)F 540442939 BHKYAXNGEXVYJT-AWEZNQCLSA-N 346.396 5.357 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccc(Cl)cc1)C1CC1 540469289 ODDMZQVRBHJZNX-HXUWFJFHSA-N 338.882 5.382 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 540604857 ALUCFZLUQNYVIX-OXJNMPFZSA-N 332.472 5.254 30 20 EKED Cc1cscc1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542003254 XPXLNRVIMHIOCL-OAHLLOKOSA-N 346.455 5.086 30 20 EKED C=CCC[C@H](CC)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 545189543 DQKKZGROLCYIOK-RDPSFJRHSA-N 341.520 5.292 30 20 EKED CCCO[C@@H]1CCCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1 553023904 ZFNNTWUIOSKSKR-JOCHJYFZSA-N 348.490 5.006 30 20 EKED C=C(C)COc1cccc(NC(=O)c2oc3ccc(F)cc3c2C)c1 589381921 BPXOANRDFXEDOT-UHFFFAOYSA-N 339.366 5.088 30 20 EKED N#Cc1ccccc1SCc1ncc(-c2cccc(Cl)c2)o1 610206695 GOJCPKIVNYWLFV-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc2ccccc2o1 619754626 GFAFCBBYUCQXFP-FQEVSTJZSA-N 338.838 5.445 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@H]1c1ccncc1 726883880 NOKGHXONXOYROZ-YPNIWSFNSA-N 328.500 5.442 30 20 EKED CCC[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 733680928 JKWUUBJWZIFQLS-SJORKVTESA-N 338.451 5.391 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C1CCCCCCC1 741560431 AKUXSEFPHLLPBI-OAHLLOKOSA-N 330.497 5.237 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(-c2nnc(C)o2)cc1 741944282 NRUVKVJNUDLUCI-UHFFFAOYSA-N 329.444 5.124 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCC[C@H](C)C3)n2)cc1 744034355 HCAIYEUDEXNAPY-BHYGNILZSA-N 338.476 5.121 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@H]1c1cc(C)on1 775137072 SRYADAWBRAIACM-LPHOPBHVSA-N 334.504 5.423 30 20 EKED Clc1ccc(NN=Cc2conc2Cc2ccccc2)cc1Cl 814796396 BJDIWCQKMKHKDG-UHFFFAOYSA-N 346.217 5.018 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCCCCC1 836386635 QDWYGJKLLADXRU-MRXNPFEDSA-N 345.512 5.126 30 20 EKED N#Cc1ccccc1NC(=S)Nc1cccc(Oc2ccccc2)c1 915994334 LGFWGYPHZNCXDB-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CCOc1ccc(C(=O)/C=C/c2csc(-c3ccccc3)n2)cc1 916152209 QVCYHYIWADNQIE-JLHYYAGUSA-N 335.428 5.105 30 20 EKED N#CCCCOc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 917559120 GVMZKWHZHINEFE-UHFFFAOYSA-N 349.217 5.132 30 20 EKED O=C(/C=C\c1cn2cc(Cl)ccc2n1)c1cccc2ccccc12 920755898 TYFSNQVTQNIIDP-KTKRTIGZSA-N 332.790 5.037 30 20 EKED Cc1cc(Cl)c(C(=O)Nc2ccccc2SCCC#N)cc1C 180776509 WRGGIIAZGXHJAT-UHFFFAOYSA-N 344.867 5.215 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Br)cs1 194121297 MUUXGZALKNNRCI-IUODEOHRSA-N 349.297 5.206 30 20 EKED N#CCCCOc1cccc(NCc2ccc(Cl)cc2Cl)c1 237744968 LODSOAJKSIYMIE-UHFFFAOYSA-N 335.234 5.288 30 20 EKED CC(O)=Nc1cc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)ccc1F 328975033 BECOLEZLGNVYAH-NUEKZKHPSA-N 332.419 5.628 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cnn(C2CCCC2)c1 340446353 NGXVQNUQGGWRNY-LAUBAEHRSA-N 336.483 5.084 30 20 EKED CC(C)(CCC#N)CNCc1ccc(-c2ccc3c(c2)CCCO3)cc1 462771805 DWOVJBQSMQNYRI-UHFFFAOYSA-N 348.490 5.098 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(CC[C@H](C)C2)C1 475578074 LLECFNRGLGMFLO-HTAPYJJXSA-N 340.511 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCCC[C@@H]1C 476087664 BRSBNYYOYULHRS-LPHOPBHVSA-N 329.484 5.072 30 20 EKED C[C@H]1CCCC[C@@H]1CC(=O)Nc1ccccc1SC[C@H](C)C#N 519423850 GKAHRTFMUIAGAI-OWCLPIDISA-N 330.497 5.093 30 20 EKED C=CCOc1cccc(NC(=O)N(CC)[C@H](CC)c2ccccc2)c1 519913242 ODUDYDUXTWOVSL-HXUWFJFHSA-N 338.451 5.257 30 20 EKED CCc1ccc(-c2noc(CS[C@H](C)c3ccc(C#N)cc3)n2)cc1 522840982 GALCHKAFJLFYLA-CQSZACIVSA-N 349.459 5.165 30 20 EKED C[C@@H](SCC(=O)Nc1cccc2ccccc12)c1ccc(C#N)cc1 522841018 HYFGIHBBNQMBQQ-OAHLLOKOSA-N 346.455 5.144 30 20 EKED N#CCCSc1ccccc1NC(=O)c1ccc(-c2ccccc2)o1 541285386 FUZKVHFXDJISLD-UHFFFAOYSA-N 348.427 5.205 30 20 EKED C=CCOc1ccc(CNC(=O)Nc2c(C)cccc2C(C)C)cc1 554051488 YWMNKWNADMFYFC-UHFFFAOYSA-N 338.451 5.005 30 20 EKED C[C@H]1CCCCN1Cc1ccc(N[C@@H]2CCc3ccc(C#N)cc32)cc1 571333800 KPJKFDXPGIINKR-GAJHUEQPSA-N 345.490 5.032 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)c1cccs1)CC2 575841200 SRZDVCCMXVWGFM-NHCUHLMSSA-N 344.483 5.181 30 20 EKED N#CC1(CC(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 590289027 YCTNUTCEBKVUCF-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C=CCOc1ccccc1CN[C@@H](c1cccnc1)C1CCCCC1 590798473 XWDDMWNNKKAQKN-JOCHJYFZSA-N 336.479 5.058 30 20 EKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CCCCC#N)c1ccccc1 593987067 FSWVXURBXJWITJ-INIZCTEOSA-N 340.854 5.518 30 20 EKED Cc1ccc(-c2cc(CSCc3cc(C#N)ccc3F)on2)cc1 609236671 UOSKCGHXFNMFIP-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CCn1nc(C)c(/C=C\C(=O)c2cccc(-c3ccccc3)c2)c1C 727975730 VPPLWTBHXXMOLU-YPKPFQOOSA-N 330.431 5.083 30 20 EKED CCCCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 728116956 DWEUFXNKYVWFES-HXUWFJFHSA-N 335.451 5.196 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(SC(C)(C)C)cc1 750595332 UYZIREZKJBDDOS-UHFFFAOYSA-N 347.528 5.371 30 20 EKED Cc1ccc(/C=C/CC(=O)Nc2ccccc2SCCC#N)cc1 84761478 YDMNREUKSFYPIJ-GQCTYLIASA-N 336.460 5.043 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1cccc(-c2ccncc2)c1 180932274 PIHWAGJIYALFEC-BQYQJAHWSA-N 336.394 5.193 30 20 EKED C=C(C)[C@H](NCc1csc(-c2ccco2)n1)c1ccc(F)c(F)c1 187372844 FMLLNNPZSWKGAN-KRWDZBQOSA-N 346.402 5.088 30 20 EKED C=C(C)[C@@H](NCc1cc(-c2cccs2)on1)c1ccc(F)c(F)c1 187791159 JUPWBDBYMLOLKH-GOSISDBHSA-N 346.402 5.088 30 20 EKED C[C@H](Sc1nnc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 189784723 RAZKDVVXRXSVJU-NSHDSACASA-N 341.823 5.115 30 20 EKED CC[C@H](Nc1ccc(C#N)c(Cl)c1)c1nc(C(F)(F)F)cs1 301434059 QLPIAWZJVRNEKQ-NSHDSACASA-N 345.777 5.250 30 20 EKED CC(O)=Nc1ccccc1-c1noc([C@@H]2CCC[C@@H]3CCCC[C@H]32)n1 329720885 BTAHJNFKIWISRK-ARFHVFGLSA-N 339.439 5.418 30 20 EKED N#CC1(CC[S@@](=O)Cc2cccc(Cl)c2Cl)CCCCC1 417160683 IESSSBBKJIQBEJ-OAQYLSRUSA-N 344.307 5.106 30 20 EKED N#CC1(CCSCc2cc3ccccc3nc2O)CCCCC1 419408349 LZENVUNSQVEDNH-UHFFFAOYSA-N 326.465 5.038 30 20 EKED CCC[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(F)cc1F 439434152 DCQWMIHBZULKCV-SFHVURJKSA-N 334.797 5.121 30 20 EKED CCN(C(=O)CC[C@H](C)c1ccccc1)[C@H](C)c1ccc(C#N)cc1 440791640 KEALPRRRGKDWGP-ZWKOTPCHSA-N 334.463 5.052 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C)ccc1F 466895376 GLYXTSMQBRTIMR-UHFFFAOYSA-N 338.835 5.069 30 20 EKED CC#CCCCC(=O)N(Cc1cc(C)nc2ccccc12)C1CCCC1 467511060 IZMIUHNLLCUPJZ-UHFFFAOYSA-N 348.490 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)CC)cc1 476134919 GDKWFLBPTXFPHB-UHFFFAOYSA-N 335.447 5.384 30 20 EKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nccc2ccccc12 483198962 MQUSZENEPVVDFF-INIZCTEOSA-N 341.197 5.032 30 20 EKED C=CCOc1ccc(CNc2cccc(COC(C)C)c2)cc1Cl 522282985 LGFDUHKGURZRDQ-UHFFFAOYSA-N 345.870 5.442 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1cccc(C)c1C 540499862 ABZIJDFTEXAZFJ-OAQYLSRUSA-N 343.511 5.120 30 20 EKED C=CC[C@@H](C)[C@H](C)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 543113699 ZSOBNNGOGIYYMT-CVEARBPZSA-N 340.442 5.020 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 554943641 ZKQVTBQYYYNZOC-QGZVFWFLSA-N 349.474 5.386 30 20 EKED C=CCC[C@@H](NCc1nc2cc(Cl)ccc2s1)c1ccco1 577131457 OEYAVUWKURYOHG-CYBMUJFWSA-N 332.856 5.340 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(F)cc1C(F)(F)F 599042265 AKEGQVLMIORUTL-VOJFVSQTSA-N 348.343 5.054 30 20 EKED COc1cccc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)c1 734303416 OEOOQLDGAPMQOW-ZHACJKMWSA-N 335.428 5.023 30 20 EKED CCOc1cccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741474294 WZKPRINMOYKNKR-KTKRTIGZSA-N 329.399 5.043 30 20 EKED COc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1OC1CCCC1 743465949 UBPGXFYLXFWOKQ-HNNXBMFYSA-N 336.435 5.061 30 20 EKED CCSc1ccc(Cl)cc1NCc1ccc(O[C@@H](C)C#N)cc1 770564490 TWBQZEALZWDNRV-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED C/C(=C\C(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 773982964 NNQPOHKXJGRKOG-HFQYIWAZSA-N 338.476 5.287 30 20 EKED C[C@H](N[C@@H](c1ccccc1)C1CCCCC1)c1ccc(OCC#N)cc1 776159138 IDBPJOLJWOUIPO-MBSDFSHPSA-N 348.490 5.561 30 20 EKED C=CCc1cc(CN[C@@H](CCC)c2ccsc2)cc(OC)c1OC 785564259 AEJIYUHPAAVKKN-SFHVURJKSA-N 345.508 5.125 30 20 EKED CC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccc1OC 795782675 OIIVGQDIEAJJNY-LEWJYISDSA-N 334.463 5.075 30 20 EKED N#Cc1sc(N[C@H]2CCc3c2ccc(Cl)c3Cl)nc1Cl 804454009 KMOFJFOIAUQZIJ-VIFPVBQESA-N 344.654 5.074 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1 1776697838 QJWHJSFMEOEMON-PFLWAWFJSA-N 334.415 5.194 30 20 EKED Cc1ccc(C)c(Sc2ccc(NC(=O)C3(C#N)CCC3)cc2)c1 78818647 HSQHLWSKTDMAQU-UHFFFAOYSA-N 336.460 5.087 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 129202484 BJNFMEWVHMVEDV-KRWDZBQOSA-N 346.430 5.257 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1cccc(C#N)c1 153700027 GUIWQFRFMFTCHZ-SJORKVTESA-N 327.431 5.032 30 20 EKED Cc1cc(C#N)ccc1CN[C@@H](C)c1sc(-c2ccccc2)nc1C 186329236 DTSRZNCTEYGIKW-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C=C(C)COc1cccc(NC(=O)c2cccc(Cl)c2Cl)c1 303126812 BCUCNWFICDGLRU-UHFFFAOYSA-N 336.218 5.201 30 20 EKED C[C@H](N[C@@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 376868188 YJBMDIFIDWXGAB-IRXDYDNUSA-N 327.431 5.032 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 410377468 BQOCIXBFEOUABV-UHFFFAOYSA-N 347.380 5.552 30 20 EKED Cc1ccc(OC(F)F)c(CNc2ccccc2SCCC#N)c1 427409180 YKXUXDWDZOFEMC-UHFFFAOYSA-N 348.418 5.214 30 20 EKED CN(CC(C)(C)C#N)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1 455392597 FEMIKMBECKKWTF-UHFFFAOYSA-N 341.842 5.020 30 20 EKED CC(C)CC[C@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 473757814 VYEAIGZXKOXPQI-LJQANCHMSA-N 341.499 5.310 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(CC)s1 475582410 SPHCUZWKOSRKBL-UHFFFAOYSA-N 342.508 5.484 30 20 EKED CC(C)C[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Cl)cc1 498129239 ZNEPGMZGQHOYKA-QGZVFWFLSA-N 349.906 5.056 30 20 EKED C=CCC[C@@H](NC(=O)Nc1ccc(-c2ncco2)cc1)c1ccccc1 501381081 JPAAIHNJCJBCDT-LJQANCHMSA-N 347.418 5.171 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2)cc1F)c1cccc(C#N)c1 503593260 VYQJGDLNCFNUSR-INIZCTEOSA-N 330.406 5.215 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(O[C@@H](C)CC)cc1 511005773 ZHKLZRONONSPLB-KRWDZBQOSA-N 338.451 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccccn1 530500161 MCQNBPGGVNCXNL-FQEVSTJZSA-N 349.478 5.303 30 20 EKED CC[C@@H](C)Sc1ccc(NCCCC2(C#N)CCOCC2)c(C)c1 538610056 LRKOAVWMTNHQIJ-QGZVFWFLSA-N 346.540 5.398 30 20 EKED C[C@@H](NC(c1ccc(F)cc1)c1ccc(F)cc1)c1cccc(C#N)c1 539494360 HCYNTJYKVHMXJL-OAHLLOKOSA-N 348.396 5.277 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H]1CCc2cc(C#N)ccc21 588958820 VLUDHFXCZSXBDH-IFMALSPDSA-N 341.458 5.003 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 605965275 XLESZQVTHJZGHI-QGZVFWFLSA-N 348.899 5.099 30 20 EKED CC(C)(CCc1ccccc1)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 608994919 VRTNESHIIYVGCD-UHFFFAOYSA-N 349.478 5.021 30 20 EKED CCC/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 729320497 ZKBRFGOTUCVHBK-PRCIHIDRSA-N 338.838 5.290 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(SC(F)F)cc1 734980276 JEBPOWFKHUNUIL-ONNFQVAWSA-N 341.382 5.446 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(Oc2ccncc2)cc1 747613781 ANXKDFGALJOSPS-UHFFFAOYSA-N 340.382 5.483 30 20 EKED Cc1cscc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748536040 UVQIPYUYIUHGGF-GOSISDBHSA-N 347.443 5.356 30 20 EKED CCCCCCCCC(=O)N(Cc1ccc(F)cc1)C1CCOCC1 756785718 WQBRJTCLXGONFC-UHFFFAOYSA-N 349.490 5.084 30 20 EKED C#CC[C@H](NC(=S)Nc1ccc(Cl)cc1Cl)c1ccccc1 756856908 NGDFQAKYJXPEIW-HNNXBMFYSA-N 349.286 5.044 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2cc(Cl)sc2Cl)s1 758430052 OJNDQRCUIRNEQD-ARJAWSKDSA-N 332.277 5.531 30 20 EKED N#CCCCOc1cccc(/C=C2/C(=O)c3cccc4c3[C@@H]2CCC4)c1 763291480 XPPQNARCIBISOS-DDNKWHRWSA-N 343.426 5.069 30 20 EKED C=CC[C@@H](N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 766020431 PJDDHELVAXUQSY-HNAYVOBHSA-N 349.503 5.482 30 20 EKED N#CC1CCC(CNC(=O)c2c3ccccc3cc3ccccc23)CC1 799387946 RZXMNBKOUPXRDS-UHFFFAOYSA-N 342.442 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cnc1Cl 890165644 IMCBCYFUSBYQEO-UHFFFAOYSA-N 328.843 5.148 30 20 EKED C#Cc1cccc(NC(=O)N(Cc2ccc3ccccc3c2)C2CC2)c1 919903210 MOUIJCWYHYEPEY-UHFFFAOYSA-N 340.426 5.018 30 20 EKED O=C(O)c1cccc(C=Nn2c3ccccc3c3ccccc32)c1Cl 1776112740 JCSPJZVCVJACKY-UHFFFAOYSA-N 348.789 5.028 30 20 EKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(OCC#N)cc1 181724782 POAOAHHWRNVSSB-HUUCEWRRSA-N 336.460 5.215 30 20 EKED C[C@@H](Nc1cccc(NC(=O)c2cccs2)c1)c1cccc(C#N)c1 182854645 MQQWQPJBIRENQW-CQSZACIVSA-N 347.443 5.045 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)C(C)(C)C 433159686 SSBUVVAETDKMTG-AWEZNQCLSA-N 347.528 5.275 30 20 EKED N#CC[C@@H]1CC[C@H](Nc2cc(C(F)F)nc3ccc(Cl)cc23)C1 450676357 XGXHIAISOASXLK-JQWIXIFHSA-N 335.785 5.320 30 20 EKED C=CCOCCCC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 463357625 BGRQRYGAIPNFFP-UHFFFAOYSA-N 345.826 5.054 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 464535275 CTHDINARJFHOLX-AWEZNQCLSA-N 327.390 5.045 30 20 EKED CCCC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CCC1 467555643 UGZJLDAWPKPJIF-OAHLLOKOSA-N 345.512 5.173 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@@H]2CCCC[C@H]21 475548568 CFNGITMPNSUQKO-FFZOFVMBSA-N 340.511 5.581 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2C)nnc1-c1ccoc1C 481447484 CHBHTOUYBFOSCU-HNNXBMFYSA-N 339.464 5.194 30 20 EKED CC(C)(C)[C@@H](CC1CCCCC1)NCCCC1(C#N)CCOCC1 499608792 GUYVFFLLFWKQTF-LJQANCHMSA-N 334.548 5.062 30 20 EKED C[C@H](c1ccccc1)N(C(=O)c1cccc(CC#N)c1)c1ccccc1 502745779 XLUDDXYNLZAIAZ-GOSISDBHSA-N 340.426 5.161 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccccc1Oc1ccccc1 508079471 QEGBDQNXKOVMDD-KRWDZBQOSA-N 328.415 5.201 30 20 EKED CCN(C(=O)C[C@H](C)C1CCCCC1)[C@H](C)c1ccc(C#N)cc1 508941053 HBKQWMQZXXSUQF-DLBZAZTESA-N 326.484 5.074 30 20 EKED C[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)cc1F 512297205 VYMTYHZKIFFTJZ-LLVKDONJSA-N 349.236 5.344 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCCc2c(Cl)sc(Cl)c21 554363888 RYVVCSMNUPBQNI-NSHDSACASA-N 331.312 5.352 30 20 EKED Cc1cc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)sc1Br 586778356 ZYXVJUWMRMXYQN-VXGBXAGGSA-N 349.297 5.103 30 20 EKED N#Cc1ccc(C2(N[C@H]3CCCc4c3[nH]c3ccccc43)CCC2)cc1 594519688 XUTQPVZNVXEKEX-NRFANRHFSA-N 341.458 5.086 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(C#N)cc3F)cs2)o1 603632647 CZFKWQWAPZWNDU-UHFFFAOYSA-N 344.436 5.156 30 20 EKED N#CCC[C@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 611337035 FSOFYIBJYMLGFX-ZWKOTPCHSA-N 345.273 5.615 30 20 EKED N#C[C@@H](C(=O)c1cc2sccc2s1)c1ccc2ccccc2n1 617896335 CJWHXAYHRARBLU-GFCCVEGCSA-N 334.425 5.001 30 20 EKED C=C(C)CNC(=S)N[C@H](c1ccc(C(C)C)cc1)c1cccs1 730595929 CSIXMYCMIPCGTQ-GOSISDBHSA-N 344.549 5.001 30 20 EKED C[C@@H](CC#N)Sc1ccccc1N=Cc1c(O)ccc2ccccc12 731318585 IQNCOEKTFHWZEK-HNNXBMFYSA-N 346.455 5.690 30 20 EKED C#CCCOc1ccc(CN[C@H](C)c2ccc(SCC)cc2)cc1 733327072 NEOPRRXRAQHVCS-QGZVFWFLSA-N 339.504 5.052 30 20 EKED C=CC[C@@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccncc1 734508709 CLYNVWTZFQPEQU-HSZRJFAPSA-N 343.474 5.257 30 20 EKED CC(C)C[C@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 741110602 JHFOXZZHWFQJTI-VQTJNVASSA-N 342.442 5.241 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 756223905 HUCUKIOHBKADDX-BEFAXECRSA-N 328.415 5.238 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(C(C)C)cc2)c1 772985269 VQTOHUGBBYPFGI-UTKZUKDTSA-N 336.479 5.342 30 20 EKED C/C(=C/C(C)(C)C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 773984988 XUFHPXYEPPSSGO-VPUINMBXSA-N 332.856 5.118 30 20 EKED C[C@@H](NCc1ccnc(Cl)c1)c1ccc(-c2cccc(C#N)c2)cc1 782525500 YYTNPSKLOAMAPR-OAHLLOKOSA-N 347.849 5.124 30 20 EKED CC(C)[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797569679 UVPKFFDSARSEPN-WBVHZDCISA-N 340.492 5.057 30 20 EKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 805858677 UEDDVYCVBRNFFO-CYBMUJFWSA-N 347.409 5.214 30 20 EKED N#CCCCCC(=O)O[C@@H](c1ccccc1)c1cccc(Cl)c1 847716502 ROEGEAKWBWTPGQ-IBGZPJMESA-N 327.811 5.057 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)cc1 916135243 NRYPIVHOAQWNSI-PKNBQFBNSA-N 333.774 5.368 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776119474 BXQOIURLYVOSQF-CMDGGOBGSA-N 348.851 5.293 30 20 EKED N#Cc1ccccc1CSCc1coc(-c2ccc(Cl)cc2)n1 31423671 DCNQGUSZBJULRA-UHFFFAOYSA-N 340.835 5.300 30 20 EKED CCCc1nc(CNc2ccccc2S[C@H](C)CC#N)cs1 86207521 UZGRBNDUUZRSEA-CYBMUJFWSA-N 331.510 5.102 30 20 EKED CCC[C@@H]1CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 135770415 AMWMQXRQRNGPFU-JKSUJKDBSA-N 345.512 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(F)cccc2[nH]1 188067523 IDUSLSGARVWFPD-UHFFFAOYSA-N 336.410 5.411 30 20 EKED CCO[C@H](C)c1nc(CS[C@H](C)c2cccc(C#N)c2)cs1 190801832 FKQRJFZLPFDYQL-CHWSQXEVSA-N 332.494 5.107 30 20 EKED Cc1nnc(S[C@H](C)c2cccc(C#N)c2)n1[C@@H]1CCC[C@H](C)C1 248923981 LGKPRLKLRGNWRN-PMUMKWKESA-N 340.496 5.063 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(F)ccc1-c1ccoc1 410355200 YRWVIWPTFKHYHI-UHFFFAOYSA-N 335.378 5.457 30 20 EKED N#Cc1cccc(SCc2coc(-c3cccc(Cl)c3)n2)c1 435044500 UCDJCFADOCLRGV-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1C(C)(F)F 455784403 CHIGCFNTZYPJIG-UHFFFAOYSA-N 344.405 5.061 30 20 EKED C=CCOCCCC(=O)Nc1ccccc1Oc1ccccc1Cl 463371752 QFTLZYUHMGFCFL-UHFFFAOYSA-N 345.826 5.054 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cl)cc1 475571278 FPOLTGYDJLQGPI-UHFFFAOYSA-N 342.870 5.514 30 20 EKED C=CCC[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 494809903 PYKLCHJOZQGBHS-KRWDZBQOSA-N 330.815 5.045 30 20 EKED CCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@@H](CC)c1ccccc1 521767361 JPHZQNRMJDDIDA-UWJYYQICSA-N 349.478 5.192 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)c(F)c1 537407009 IYJCPKVHPFHDGQ-IVZQSRNASA-N 348.396 5.277 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1 552083566 MVCDQBASVPTZGE-GOSISDBHSA-N 333.262 5.518 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2ccc(C#N)c(C(F)(F)F)c2)cc1 574835031 DRXUPBQZDRJKOW-MRXNPFEDSA-N 346.377 5.112 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)CCCCCC#N 588624232 UTPGMVNIFPMBDX-SFHVURJKSA-N 334.463 5.347 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 606916588 KPCFAIKAYBABPA-UHFFFAOYSA-N 341.455 5.169 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCCC[C@@H]1c1noc(C)n1 737617304 YRSGJUFVFGHLGY-HAZIXKIPSA-N 347.503 5.129 30 20 EKED CCCCCCOc1cccc(CN[C@H](C)c2cccc(C#N)c2)c1 743496839 SONUTHWDMJKDPV-GOSISDBHSA-N 336.479 5.368 30 20 EKED N#Cc1cccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)c1 750917329 SJBSDPJBKWPATF-OQLLNIDSSA-N 341.382 5.085 30 20 EKED Cc1c(C(=O)/C=C\c2cnc(-c3ccccn3)s2)oc2ccccc12 753141404 HREAADJVKOHZCV-KTKRTIGZSA-N 346.411 5.156 30 20 EKED CC[C@H](C#N)OC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 753423717 GSZZROMZNCKZIR-MRVPVSSYSA-N 347.745 5.032 30 20 EKED C[C@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 755612803 XIAPDAXYMQFTRT-GDBMZVCRSA-N 340.492 5.449 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccc(OC(F)F)cc2)CC1 770402170 RXDVQSPLYNVZTL-UHFFFAOYSA-N 342.389 5.104 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3=CCCCCC3)n2)cc1 773983195 UGXJMEMBIMMYCG-QGZVFWFLSA-N 336.460 5.185 30 20 EKED CC(C)(C)[C@H](NCc1cc(C#N)ccc1F)c1cc2ccccc2o1 779412551 MXTSLIKEWUWMBI-HXUWFJFHSA-N 336.410 5.321 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CCC(C)C)c2ccoc2)c1 796815420 DMGAGIYVXHDZMH-PZJWPPBQSA-N 340.467 5.228 30 20 EKED C[C@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)cc1F 864023577 RLMIYZCTGPIRNU-INIZCTEOSA-N 346.405 5.449 30 20 EKED CN(C)c1ccc(C#N)cc1CNc1ccc(SC(C)(C)C)cc1 864028177 QEPFCZAOMATSEH-UHFFFAOYSA-N 339.508 5.127 30 20 EKED N#CCCC[C@@H](NC[C@H]1[C@H](c2ccccc2)C1(F)F)c1ccccc1 930568970 IXFYGAABYTWKAA-ZCNNSNEGSA-N 340.417 5.060 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776370264 XYMWAPHPZBOXLN-YCRREMRBSA-N 334.371 5.151 30 20 EKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 151710004 GUDACISLQGKTDJ-LAUBAEHRSA-N 347.462 5.066 30 20 EKED CC(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)=C1CCCC1 161973317 VJNYEJYLFJZSEU-CYBMUJFWSA-N 330.840 5.016 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)c1cccc(C#N)c1 181971851 JAEILOUQENAVIZ-OXQOHEQNSA-N 332.472 5.254 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCCCC(C)(C)C#N)s2)cc1 184539768 NFBQDQJEOCJZOU-HNNXBMFYSA-N 341.524 5.408 30 20 EKED C[C@@H](SCC1CC1)C(O)=Nc1sc2c(c1C#N)CCCCC2 329625971 SZXGUSLUOSUFEH-LLVKDONJSA-N 334.510 5.008 30 20 EKED Cc1ccc(-c2nnc(SCCC3(C#N)CCCCC3)o2)cc1 412981234 DZAWFPMYWNRRJD-UHFFFAOYSA-N 327.453 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1[C@@H](c2ccccc2)[C@H]1C 430810732 MUSHTDHWWMRMAU-MAODMQOUSA-N 333.475 5.527 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@@H]1CCc2ccccc21)c1ccccc1 435761999 RMBKGTUCWKWSPW-LEWJYISDSA-N 334.463 5.023 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccccc1F 476119234 PRNJWGVZNHYZQV-MRXNPFEDSA-N 339.454 5.810 30 20 EKED CCOc1c(Cl)cccc1CNc1cccc(OCCCC#N)c1 486989932 OCMVPUYQYQYCJQ-UHFFFAOYSA-N 344.842 5.033 30 20 EKED CC(C)c1cccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 503624338 IZIDPHBIELWAAT-UHFFFAOYSA-N 345.446 5.003 30 20 EKED N#Cc1ccc2c(c1)[C@H](NC1(c3c(Cl)cccc3Cl)CC1)CC2 521122166 AJSRYTDFZGZXTM-QGZVFWFLSA-N 343.257 5.131 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)sc1Cl 536840798 VVICJAWPKYIICW-RISCZKNCSA-N 339.291 5.751 30 20 EKED COc1ccc(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)s2)cc1 538395592 QCVCARXGFSZLPI-OAHLLOKOSA-N 348.471 5.146 30 20 EKED CC(C)C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccs1 542555378 FRQSRWRMERUFLQ-GOSISDBHSA-N 326.509 5.426 30 20 EKED CC[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(Cl)c1F 563464564 ZEZSTVUITCANSO-QGZVFWFLSA-N 328.818 5.081 30 20 EKED CC(C)(C#N)c1ccc(-c2nc(C(C)(C)c3cccc(F)c3)no2)cc1 583228507 CQZWEPGSSJOEEW-UHFFFAOYSA-N 349.409 5.003 30 20 EKED Cc1cccc(-c2nnc(SCCC#N)n2[C@@H]2CCCC[C@@H]2C)c1 593577994 IGOUPMPHGPDQFJ-DOTOQJQBSA-N 340.496 5.011 30 20 EKED N#CCC1(CNc2ccc(Oc3ncc(Cl)cc3Cl)cc2)CC1 594700608 KIXKPWTWXVVDHP-UHFFFAOYSA-N 348.233 5.286 30 20 EKED CC(=NNc1cccc(C)c1)c1csc(-c2csc(C)n2)c1 729140723 MARGPICQRIBCCP-UHFFFAOYSA-N 327.478 5.325 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1 735793278 RRNJGBDSJWDEJP-ZBFHGGJFSA-N 325.456 5.044 30 20 EKED Cc1cc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc(C)c1F 741467733 QGMSUCJFJNCFGL-ONEGZZNKSA-N 343.448 5.524 30 20 EKED CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 749057007 TUZHPXMZAROHTG-VXGBXAGGSA-N 348.418 5.091 30 20 EKED CC(C)(CCC#N)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1 770558838 LSBDFSIZWTYQAN-OAQYLSRUSA-N 336.479 5.095 30 20 EKED C#CC[C@H](N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 773108364 WYZPSYIXRIYDNU-JXFKEZNVSA-N 346.499 5.534 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc(OC)cc1 789719383 ORUAYUPOCCYCOO-QINSGFPZSA-N 335.447 5.199 30 20 EKED C=CCNC(=S)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 917594001 NHVBINHTOMUASW-UHFFFAOYSA-N 337.275 5.133 30 20 EKED CC(=NNc1cccc(Cl)c1F)c1[nH]c(-c2ccccc2)nc1C 921137544 BQPUHNVFUAVFJU-UHFFFAOYSA-N 342.805 5.014 30 20 EKED CCN(CCCC#N)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 64348621 AEXXHOUAYRJNDA-UHFFFAOYSA-N 336.357 5.091 30 20 EKED N#CCCCOc1cccc(NCc2cccc(-c3ccccn3)c2)c1 127053501 YTSYXFJYSKRNPI-UHFFFAOYSA-N 343.430 5.043 30 20 EKED CC(C)(C#N)CCCOc1ccc([N+](=O)[O-])cc1-c1cccs1 135483764 DAVPVOAUJVZNAL-UHFFFAOYSA-N 330.409 5.032 30 20 EKED N#CCC[C@H](NC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 178639679 DCTJIHZIHYETAV-HNNXBMFYSA-N 348.233 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ncccc1C(F)(F)F 189879527 HVYPNXXUWYNYHC-UHFFFAOYSA-N 348.368 5.205 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1COc2cc(C)c(C)cc21 189902587 DCUQKVMLLPEDNG-FQEVSTJZSA-N 349.474 5.270 30 20 EKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccn1C(C)C 340109398 VOPBDDHZLNKTFY-CQSZACIVSA-N 341.480 5.024 30 20 EKED CCC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340444714 IPEZLPXSGSIXNJ-FGZHOGPDSA-N 336.479 5.561 30 20 EKED CC(C)c1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 431704404 XAYXPPHWKCSUOV-IBGZPJMESA-N 335.451 5.367 30 20 EKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 475908031 VNOBVJZGJIPKHT-OFNKIYASSA-N 348.490 5.238 30 20 EKED C=C(C)[C@@H](NCc1csc(CCCC)n1)c1ccc(F)c(F)c1 481579007 GHLDZPOABDWLSC-GOSISDBHSA-N 336.451 5.171 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(C#N)s1 487292737 YMBGAJPWPMVIPY-UHFFFAOYSA-N 336.869 5.026 30 20 EKED CC(C)(CCC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 487432506 WKCBJFXQBRYRDM-NRFANRHFSA-N 348.490 5.296 30 20 EKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3ccsc3)c2C#N)C1 495804602 RMLFQPHHSQJGSY-GFCCVEGCSA-N 344.505 5.085 30 20 EKED C[C@H]1C[C@@]1(NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 503441333 ZQEYBSVRCRUDQV-BTYIYWSLSA-N 338.882 5.166 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2ccc(SCC)cc2)cc1 504030341 IZAGZPQEJKSXDR-MRXNPFEDSA-N 327.493 5.214 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1CC(C)(C)C1 506804007 ITHLMBAANBRAHP-UHFFFAOYSA-N 334.419 5.034 30 20 EKED CCN(Cc1cnc(C2CCCC2)s1)[C@H](C)c1ccc(C#N)cc1 508604394 MHZQMZMQBDKJEL-OAHLLOKOSA-N 339.508 5.255 30 20 EKED C=CC[C@@H](C)NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 522645280 MGQLIOUQAPJXEP-CYBMUJFWSA-N 333.353 5.067 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)c1cccc(C#N)c1 539495390 OKSSTNQLSLACPO-WZONZLPQSA-N 326.443 5.193 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccc(Cl)cc3)cc2)ccn1 566648600 AWMJVCQURGMCMG-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cncc(Br)c1)c1ccccc1 578643982 IVKSDPZWBZRGRZ-KSSFIOAISA-N 345.284 5.202 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H](C)c1ccc(C#N)cc1 583715963 IBILJWSMSAKZRO-YCRPNKLZSA-N 329.447 5.076 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1nc2ccccc2s1 727974521 LVPMSXQKERYTGR-ZHACJKMWSA-N 348.452 5.316 30 20 EKED O=C(/C=C\c1cccc2ccccc12)c1c(Cl)nc2sccn12 741842748 BLVBQQBZMRMNSP-HJWRWDBZSA-N 338.819 5.099 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc2ccccc2n1 756518016 ASLDQBOLMHMBTB-LULLPPNCSA-N 332.447 5.018 30 20 EKED CN(CCC#N)c1ccc(CN[C@H](CC2CCC2)c2ccccc2)cc1 778113183 AUECDYKAUJDMGA-HSZRJFAPSA-N 347.506 5.058 30 20 EKED C[C@H](NCc1cccc(SC(F)(F)F)c1)c1ccc(C#N)cc1 781340927 FYVQCPJXHAWRBF-LBPRGKRZSA-N 336.382 5.021 30 20 EKED CCCCCc1ccc(C(CC)=NNc2ccccc2C(=O)O)cc1 1776030075 UYOFODLCRYAMIS-UHFFFAOYSA-N 338.451 5.344 30 20 EKED Cc1ccc(NN=Cc2csc3ccc(C(=O)O)cc23)cc1Cl 1776034930 NHLWTDHYAHJRCI-UHFFFAOYSA-N 344.823 5.007 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)C1CCCCCC1 66954090 XDZSKGIDCVXIAT-OAHLLOKOSA-N 345.512 5.267 30 20 EKED N#Cc1c(Cl)nsc1N[C@H](c1ccccc1)c1ccc(F)cc1 301077111 GKWOBUWPCVCOKE-OAHLLOKOSA-N 343.814 5.009 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccnc1 376868189 YJBMDIFIDWXGAB-SJORKVTESA-N 327.431 5.032 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@H](CCCC#N)c1ccccc1 433032264 RGYSTOORWATLRY-OAQYLSRUSA-N 331.463 5.013 30 20 EKED N#C[C@@H](C(=O)c1cc(F)c2ccccc2c1)c1nccc2ccccc12 498978269 JSIPMNHPIFQPAQ-LJQANCHMSA-N 340.357 5.017 30 20 EKED N#CC1(CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)CC1 500752444 GDXXRHDZVZTKQI-UHFFFAOYSA-N 331.444 5.140 30 20 EKED C=CCN(Cc1cccs1)C(=O)CCCCCc1cccs1 517559940 UDYMHDCNFJYXFV-UHFFFAOYSA-N 333.522 5.127 30 20 EKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518255926 KANVQTGXNAQYIB-HXUWFJFHSA-N 349.434 5.003 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(C#N)cc1 520153811 YFACAMLBGTUISX-LLVKDONJSA-N 348.233 5.090 30 20 EKED COc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)c2ccccc12 531696466 BIQRQIIRUPCYKV-HOTGVXAUSA-N 330.431 5.132 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccccc1 535353031 CDDPJGJCTNYIEE-OXQOHEQNSA-N 339.866 5.363 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1 536165863 PXWKPSPBGZFEQL-AWEZNQCLSA-N 332.403 5.004 30 20 EKED C[C@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)c(F)c1 539609527 JDWWVTFUVUZIMR-YVEFUNNKSA-N 336.332 5.042 30 20 EKED C=CC[C@H](C)[C@H](C)Nc1ccccc1CN(C)C(=O)c1cccs1 541206234 PDYCGAPMEIZPGW-HOTGVXAUSA-N 342.508 5.033 30 20 EKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)sc12 579037031 OMRVSCRUANOWMV-KRWDZBQOSA-N 342.423 5.248 30 20 EKED CCN(Cc1ccc(-c2ccccc2C#N)cc1)[C@H]1CCOC(C)(C)C1 583963653 VSROCKOZTJAXPO-NRFANRHFSA-N 348.490 5.005 30 20 EKED N#CCCCCCC(=O)Nc1cccc(Cl)c1SCC(F)F 588755250 FDKDKUORJJAZBB-UHFFFAOYSA-N 346.830 5.110 30 20 EKED FC(F)Oc1cccc(Cl)c1C=NNc1ccc(Cl)cc1 732923485 CGSQAFSXZDOZIV-UHFFFAOYSA-N 331.149 5.041 30 20 EKED O=C(/C=C\c1cn[nH]c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 751525584 XOKBZRDUJLSYSS-BHQIHCQQSA-N 348.349 5.053 30 20 EKED C#CCCCCCC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 779868302 MTYFNNYRUIUIEH-IBGZPJMESA-N 345.895 5.191 30 20 EKED Cc1cc2c(cc1C)C(=O)/C(=C/c1scnc1C1CC1)CS2 782352261 RMXZCDZWVGLKJO-NTUHNPAUSA-N 327.474 5.009 30 20 EKED C=CCCCCC[C@@H](C)Nc1ccc(Cl)c(C[S@](C)=O)c1 793586594 JPMCWGAFOPMRIH-SZNDQCEHSA-N 327.921 5.155 30 20 EKED C[C@H](C#N)OCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 801655430 ZFXKHIKKTFQOBB-KDOFPFPSSA-N 331.868 5.091 30 20 EKED CCCC[C@@H](CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915180651 QPIGQZNHETZUPN-DYESRHJHSA-N 334.463 5.497 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2cccs2)cc1 915180969 UKSMTKCZFRNLHY-SJFMBGHLSA-N 344.439 5.055 30 20 EKED CCCCCCCCCCCCCCCCCCNS(N)(=O)=O 43543913 QIJYZYSUOVKJCJ-UHFFFAOYSA-N 348.597 5.041 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(C#N)cc1)C1CC1 65889201 RMXVJKWKUYQDFQ-INIZCTEOSA-N 340.426 5.077 30 20 EKED C[C@@H](NCCCC(C)(C)C#N)[C@H](C)c1ccccc1C(F)(F)F 185794024 REICOONCKKDGIN-UONOGXRCSA-N 326.406 5.117 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NCc1ccc(O[C@H](C)C#N)cc1 236648731 XDTYWBCJCCGFON-GCJKJVERSA-N 336.479 5.163 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cn(C)nc1C(C)C 280775040 HJOCFOUJXCUYQX-UHFFFAOYSA-N 340.471 5.039 30 20 EKED C=CCOCC(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 410041320 BIMXINSPKYDZRS-UHFFFAOYSA-N 343.426 5.162 30 20 EKED CC[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cccc(Cl)c1 463007720 GXWNROYOLNBTRX-ZDUSSCGKSA-N 339.748 5.189 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(NC3CCCC3)c2)cc1 479976930 SJTJZNOCQZNXGP-UHFFFAOYSA-N 347.462 5.095 30 20 EKED COc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(C#N)c(F)c1 538508664 XHEHMIUFBBHDOB-MGPUTAFESA-N 340.442 5.144 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(C)CCCCC1 562021867 FWOYDAHFAIPZKU-HNNXBMFYSA-N 345.512 5.173 30 20 EKED N#CCCn1cc(/C=C/c2nc(C3CCCCC3)no2)c2ccccc21 609474771 PJBZRSGPSOEKDW-VAWYXSNFSA-N 346.434 5.156 30 20 EKED C=C[C@H](CC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1)c1ccccc1 617917762 IEUDDSJLAFDYNX-UTKZUKDTSA-N 335.447 5.083 30 20 EKED C=CC[C@@H]1CC[C@@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C1 651672562 DUFQNKGQZKNEQY-RGDJUOJXSA-N 343.355 5.230 30 20 EKED O=C(/C=C/c1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1 727976372 QUUDDVSBUIYNHD-SNAWJCMRSA-N 330.227 5.019 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccsc1 728441343 HRBIRDBFTJPURH-SREVYHEPSA-N 329.421 5.215 30 20 EKED FC(F)(F)c1cccc(NN=C2CCC(c3ccccc3)CC2)n1 739422468 VJFKHWNUDSQROK-UHFFFAOYSA-N 333.357 5.226 30 20 EKED N#C[C@H](C(=O)CCCC1CCCC1)c1nc(-c2ccccc2)cs1 744036710 HJBARSZOQNJLOX-QGZVFWFLSA-N 338.476 5.347 30 20 EKED C=CCOc1ccccc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990296 QGGLOLGICBSJRA-VAWYXSNFSA-N 341.410 5.210 30 20 EKED O=C(/C=C\c1ccc(Cl)nc1)c1ccc(Cl)c(C(F)(F)F)c1 754689510 HVLKQTNVXZCFBW-KTAJNNJTSA-N 346.135 5.303 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(Br)cc1 760264731 NVAUTRBFBYFGPT-HJWRWDBZSA-N 348.265 5.069 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2ccc(-c3ccncc3)cc2F)c1 763292106 JCDBCLGKWZIORK-FNORWQNLSA-N 335.353 5.231 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792096840 SJZBYVBEILXFPD-KWRJMZDGSA-N 346.817 5.168 30 20 EKED Cc1oc(C#N)cc1C(=O)Nc1ccccc1SCc1ccccc1 797802276 HPADUYMHDNIXKV-UHFFFAOYSA-N 348.427 5.004 30 20 EKED CC1(C)C[C@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932564003 PMZHPYQYMBNNLA-HXUWFJFHSA-N 347.462 5.148 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc2ccccc2c1C 189880140 VPQBOGYIBIOKCB-UHFFFAOYSA-N 333.431 5.845 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1occc1Br 189890087 NRUISLBYMMGESU-UHFFFAOYSA-N 348.240 5.146 30 20 EKED O=C1/C(=C\c2ccc(O)c(Cl)c2)CSc2ccc(Cl)cc21 207715738 JPQSGMJDXMYXSP-YHYXMXQVSA-N 337.227 5.071 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)c(N)c(Cl)c1 271767529 UGDMXEVDXCCQJN-SJKOYZFVSA-N 348.277 5.271 30 20 EKED N#CCCC[C@@H](NC(=O)CC1CC(c2ccccc2)C1)c1ccccc1 352199024 SZJZOYWHFYOGTA-FQUBMZHMSA-N 346.474 5.122 30 20 EKED N#CCCC[C@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1 353915936 ORDPUNKAHYZAIK-SFHVURJKSA-N 348.368 5.110 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(-c2csc(C)n2)cc1 410348080 UEECKDOPPQYPIJ-UHFFFAOYSA-N 348.471 5.489 30 20 EKED Cc1cccc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c1Cl 411004524 CTUXEDJSDQCKOX-UHFFFAOYSA-N 332.856 5.131 30 20 EKED Cc1sc([C@@H](C)N[C@H](C)CCC#N)nc1-c1ccc(Cl)cc1 411545348 WYOHAXMXRSAKPB-VXGBXAGGSA-N 333.888 5.115 30 20 EKED Cc1ccc(-n2cnnc2SCCCCC(C)(C)C#N)cc1Cl 436139265 XWTXOTHBBWGYOC-UHFFFAOYSA-N 348.903 5.041 30 20 EKED C[C@@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 439678892 RQBJWOZJUXVMFY-VGOFRKELSA-N 342.442 5.105 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 471874940 HZCJJXFOWCCFRD-INIZCTEOSA-N 349.478 5.517 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCCc1cccc(F)c1 486055308 YXPBKPNTAYBVNR-HNNXBMFYSA-N 328.456 5.265 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(C(F)(F)F)cc1 512618904 KLHCTDUXXQHPQS-VXGBXAGGSA-N 336.332 5.128 30 20 EKED CC(C)(C#N)CCCN[C@H](Cc1cccc(F)c1)c1cccc(F)c1 537108256 LAWURERBGQVWHD-HXUWFJFHSA-N 342.433 5.168 30 20 EKED CC[C@@H]1C[C@@H](CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542946745 XNTUBDNELAEQOQ-WCAVRKLYSA-N 348.490 5.081 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)c1ccccc1 561133364 LRTQNODWJJHDEX-RLLPEYFOSA-N 345.486 5.141 30 20 EKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 562089020 MUIOBLOTTPFMTD-INIZCTEOSA-N 347.462 5.245 30 20 EKED CC(C)n1ccc(CSCc2ccc(-c3ccccc3C#N)cc2)n1 609741749 RDJJHZIBZIKUIB-UHFFFAOYSA-N 347.487 5.436 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCc4c3ccc(Cl)c4Cl)CC2)c1 611475965 DEGJMEYFZPVKHL-KRWDZBQOSA-N 343.257 5.131 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)cc1Cl 618807472 ZVKADAABUIVMMM-VOJFVSQTSA-N 331.246 5.203 30 20 EKED C=CCOc1ccc(CN[C@@H](CC)c2ccc(Cl)cc2)cc1OC 642339603 JCAQCLWUJQZUMW-SFHVURJKSA-N 345.870 5.154 30 20 EKED O=C1/C(=C/c2cccs2)CCc2nc(-c3ccc(F)cc3)sc21 727685373 KYMRBQNXHKHYKR-ZRDIBKRKSA-N 341.432 5.223 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)cc1 728700724 UXRISHNEGXABOC-XBNGYDHASA-N 333.431 5.216 30 20 EKED O=C(/C=C\c1ccnc2ccccc12)c1ccc(C(F)(F)F)cc1 731835818 RLWKVLDBZRDVCN-YFHOEESVSA-N 327.305 5.150 30 20 EKED CCCCCCOc1ccc(CN[C@@H](C)c2cccc(C#N)c2)cc1 743495345 CVTFHPYLNDBXKZ-SFHVURJKSA-N 336.479 5.368 30 20 EKED N#Cc1csc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)c1 748441260 VYLBZDQIQKLFQC-GHXNOFRVSA-N 347.411 5.147 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](CC2CCCC2)c2ccccc2)cc1 752103217 OMEIZXYKPGZBMK-WZONZLPQSA-N 348.490 5.389 30 20 EKED CCCc1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1 753142588 RNTCHLDSFXUCGW-HJWRWDBZSA-N 334.444 5.054 30 20 EKED CC(C)c1ccc2c(c1)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)CCC2 762625756 PVTAJCBPBSPWHS-UZUQRXQVSA-N 348.490 5.268 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc(-c2ccccc2)cc1C 775655573 GVEWQWARHXINQO-UHFFFAOYSA-N 337.463 5.364 30 20 EKED CC[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(F)cc1F 795994361 WQVNLQBAXDMGRG-DNVCBOLYSA-N 343.373 5.047 30 20 EKED CC(C)c1ccc2occ(C(=O)Nc3ccccc3O[C@H](C)C#N)c2c1 804544048 FMDKNJPRPYDBHF-CQSZACIVSA-N 348.402 5.099 30 20 EKED N#Cc1cccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)c1 56517831 JNNTYLJEQYYUSV-NRFANRHFSA-N 341.414 5.080 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 90664591 IAPTZIOTMPMNFX-QZTJIDSGSA-N 344.405 5.374 30 20 EKED O=C(/C(=C/c1cncs1)c1nc2ccccc2s1)c1ccccc1 129896659 IOGLCCFZLYDJRB-GDNBJRDFSA-N 348.452 5.176 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCOc2ccccc21 189894850 PKITUORXKYRCGA-GOSISDBHSA-N 349.474 5.433 30 20 EKED Cc1ccc(-c2ccsc2C(=O)Nc2cccc(C#N)c2C)cc1 432331801 QNTLGAZIOLEMTM-UHFFFAOYSA-N 332.428 5.156 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)CC(F)(F)F 451332648 QJAGPPAUGNESAP-CYBMUJFWSA-N 327.390 5.456 30 20 EKED CC(C)(CCC#N)CNCc1ccc(Oc2ccc(F)cc2)cc1 462679203 HIZKOOBBRSIKNW-UHFFFAOYSA-N 326.415 5.038 30 20 EKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)c1cccc(C)c1 463261408 DYFVMPQHGWIZHG-QGZVFWFLSA-N 349.503 5.217 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(Cl)c1F 466841917 APNGKRXNMGEBSZ-LBPRGKRZSA-N 334.847 5.343 30 20 EKED CCCOc1ccccc1[C@@H](CC(C)C)NCc1cccc(C#N)c1 467769370 IGGMDFKPLDUACJ-OAQYLSRUSA-N 336.479 5.224 30 20 EKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1cc2ccccc2o1 515720538 KENZCSGFYCNCPF-LBPRGKRZSA-N 344.336 5.174 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)c1ccc(C#N)cc1 524069142 XWHHSTFJWXTKLE-UWJYYQICSA-N 346.499 5.563 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccc(Oc2ccccc2)cc1 538396365 STCCWTHMBDFVDF-HNNXBMFYSA-N 334.444 5.263 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(CCC(F)(F)F)cc2)cc1 614058571 FQLUQDCDBFOALF-UHFFFAOYSA-N 346.396 5.595 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614178774 DFNPFBAFIZVSIM-MRXNPFEDSA-N 338.520 5.451 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Cl)ccc1Cl 618806861 STKOJDVXLADHIU-BBATYDOGSA-N 331.246 5.203 30 20 EKED C=C(C)CN(CC)C(=O)c1sc2cccc(Cl)c2c1Cl 641953213 YLEYPMFGODACQO-UHFFFAOYSA-N 328.264 5.246 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)Nc2cccc(C#N)c2)cc1 726797339 GCHQTMFRCXNDIE-UHFFFAOYSA-N 325.437 5.093 30 20 EKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCC(C)(C)C)cc1 729070376 UUIGWUMDPGFKOM-MAUKXSAKSA-N 342.483 5.064 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 731114223 KDLACQUVMDQPIR-HUUCEWRRSA-N 333.501 5.029 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)ON=Cc2ccc(C(C)C)cc2)n1 744445526 QJJJYTAHWXGSKD-MRXNPFEDSA-N 349.434 5.280 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccc(-c2ccncc2)cc1 745990616 VUYVLHQPRUGVGK-SREVYHEPSA-N 343.357 5.530 30 20 EKED C[C@@H](CCC(F)(F)F)NCc1cccc(-c2ccc(C#N)s2)c1 753566551 ROJFNJAERZDHFN-LBPRGKRZSA-N 338.398 5.107 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccncc1 796770066 BJEFVAANTXDHRF-RDTXWAMCSA-N 330.859 5.020 30 20 EKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ccc(F)cc1F 916269247 AHDAEIOOKBSXMW-UHFFFAOYSA-N 331.753 5.003 30 20 EKED CSc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 920063647 CIVUTFRDUGIJNX-DAXSKMNVSA-N 343.498 5.490 30 20 EKED C[C@@]1(CCNC(CCC(F)(F)F)CCC(F)(F)F)CC1(F)F 926706006 QPRDQGLSAOOOCM-SNVBAGLBSA-N 341.286 5.065 30 20 EKED CC1(C)C/C(=C/c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776526670 PUEHIBNMXQOATN-YFHOEESVSA-N 346.835 5.047 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Br)cc1 36991677 GMXWBLLOLOSAKX-UGSOOPFHSA-N 343.268 5.123 30 20 EKED CCN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](C)c1cc2ccccc2o1 69606320 PSFIVHNNXKETSQ-HNNXBMFYSA-N 347.418 5.228 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)n1 80452274 RETYFQBUNMKTGD-LBPRGKRZSA-N 339.247 5.063 30 20 EKED C=CCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 177835269 OJDPKDUMKNYDQA-UHFFFAOYSA-N 342.386 5.006 30 20 EKED C=C(C)[C@H](NCc1csc(-c2ccoc2)n1)c1ccc(F)c(F)c1 187777013 FYOOCEXNCPGPCN-KRWDZBQOSA-N 346.402 5.088 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(Cl)c1 187911182 KQVZFSPPPNRSLU-SNVBAGLBSA-N 336.869 5.048 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(OC(F)F)c1 193907255 YARILMQMHQHHKO-CQSZACIVSA-N 346.377 5.144 30 20 EKED CC[C@@H](N[C@H](c1cccc(C)c1)c1ccccn1)c1ccc(C#N)cc1 364662034 OWKKGRGTBOSTNI-FYYLOGMGSA-N 341.458 5.092 30 20 EKED Cc1cc(NCc2ccccc2C(C)(C)C#N)ccc1-c1ccncc1 427409030 RKMFLZXWNKDBTL-UHFFFAOYSA-N 341.458 5.470 30 20 EKED Cc1sc(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c(C#N)c1C 439783590 OWFMTEHZBZNTEF-ZDUSSCGKSA-N 334.444 5.132 30 20 EKED CN(CCC#N)C(=O)Nc1ccc(Cl)cc1-c1ccc(Cl)cc1 471398617 JARCCENMACYLCO-UHFFFAOYSA-N 348.233 5.038 30 20 EKED CC(C)(C#N)CCCN1CCC(c2ccccc2C(F)(F)F)CC1 474208783 HVOPAKHMEWWEOL-UHFFFAOYSA-N 338.417 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1Cc2ccccc2S1 476173356 ZZNOEVBSZNROCD-LJQANCHMSA-N 337.488 5.194 30 20 EKED Cc1ccccc1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 490667585 JCRKUUNYMXCELI-FQEVSTJZSA-N 347.462 5.069 30 20 EKED Cc1cc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)sc1Br 512106622 OTTOTKQFCXTOOU-RYUDHWBXSA-N 349.297 5.103 30 20 EKED N#CC1(CCCSC/C=C\c2ccc(Cl)cc2)CCOCC1 512390292 BXBDUPXTAGZSDH-IWQZZHSRSA-N 335.900 5.187 30 20 EKED Cc1ccc(-c2nc(CSCc3cccc(C#N)c3)cs2)o1 517940281 RMFOIAKQIJMUAY-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 519179460 NXFJPBNFRGPZMX-UHFFFAOYSA-N 336.863 5.091 30 20 EKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)c(F)c1 537400191 NIOWIUKONFPHQS-BLVKFPJESA-N 328.818 5.153 30 20 EKED Cc1ccncc1[C@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543961587 XXUKMEURCXVTPO-ROUUACIJSA-N 341.458 5.341 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 559863923 WDIGLDQRURCISR-MBSDFSHPSA-N 332.491 5.651 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1cccc(Cl)c1 568810723 XDSSDJOLGULOQK-LLVKDONJSA-N 338.760 5.081 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(F)c2ccccc12 576793866 YQGMPNGHUQOXGZ-PEBXRYMYSA-N 330.406 5.189 30 20 EKED Cc1sc(NC(=O)CCCCC#N)nc1-c1cccc2ccccc12 594009125 PTUNEWPEQNYDGQ-UHFFFAOYSA-N 349.459 5.294 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc2ccccc2c1 610078495 PRGOYZXFXXWNMX-MRXNPFEDSA-N 332.472 5.704 30 20 EKED Cc1cc(C)cc(C(=O)/C=C/c2ccccc2OCc2ccccn2)c1 730435970 DXPCWHSTBGQQNM-ZHACJKMWSA-N 343.426 5.174 30 20 EKED O=C1/C(=C/c2ccc(-c3ccncc3)cc2F)CCc2sccc21 751534118 HDGKYXUMYABAGT-LFIBNONCSA-N 335.403 5.162 30 20 EKED C=CC[C@@H](N[C@H](CC)c1ccc(OC(F)F)cc1)c1ccncc1 766018378 HCYFRSYJSMTMKI-QZTJIDSGSA-N 332.394 5.041 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1 766023054 SZYCFFUQUNNPGH-XMSQKQJNSA-N 335.495 5.040 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c(C)ccc(C)c32)c1 769962464 IKNQPYPOGLEDNZ-DENIHFKCSA-N 348.490 5.152 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1cc(Cl)sc1Cl 772795640 CMQQGYKFIUKZAU-WAYWQWQTSA-N 334.227 5.499 30 20 EKED C/C(=C\c1ccccc1C(F)(F)F)CNc1cccc(OCC#N)c1 800519670 STQKACREBIUXJD-SDNWHVSQSA-N 346.352 5.123 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nccc2ccccc12 802812905 HKAJVTDRMVMALL-ZSXHRAQDSA-N 332.447 5.018 30 20 EKED CC(/C=C/C(=O)c1ccc(C#N)cc1)=C\c1ccccc1OC(F)F 811685065 ILWHNAYCPIVZES-RGNKTVKFSA-N 339.341 5.002 30 20 EKED N#Cc1ccc2c(c1)[C@@H](Nc1cccc(OCc3ccccc3)c1)CC2 864022205 INFDXVFOMJMVTE-QHCPKHFHSA-N 340.426 5.237 30 20 EKED CCCCCCCCCC(=O)N1CCC([C@H](O)c2ccccc2)CC1 914536079 HMRJYOKKEGPOFH-JOCHJYFZSA-N 345.527 5.099 30 20 EKED CCCOc1c(/C=C/C(=O)c2cc(F)ccc2F)cccc1OCC 916135048 ZULUITIIZARWHG-DHZHZOJOSA-N 346.373 5.048 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2c(F)cc(C(=O)O)cc2F)cc1 1776700069 UMTCXJAHBMKHLV-IDVQTMNDSA-N 344.357 5.073 30 20 EKED CCC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 90664432 KBGLZDLJWOCPDN-PMACEKPBSA-N 337.423 5.071 30 20 EKED Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 124126160 IEHDRQFTQUXYCU-YJBOKZPZSA-N 346.455 5.099 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1cccs1)c1ccccc1 160362467 GVDQCVWMDCYBQK-RDJZCZTQSA-N 328.481 5.158 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2occc2-c2ccc(F)cc2)cc1 179085872 XRKCZNFWKJZLKN-UHFFFAOYSA-N 348.377 5.139 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C(F)(F)F)cc1 182458863 NYXZLIBPZIHTJB-AWEZNQCLSA-N 346.396 5.357 30 20 EKED O=C(/C(=C\c1cncs1)c1nc2ccccc2s1)c1ccccc1 255584228 IOGLCCFZLYDJRB-XNTDXEJSSA-N 348.452 5.176 30 20 EKED CC(O)=Nc1ccc(C)cc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@H]21 329086529 UVCRVUSKSJORDY-BRWVUGGUSA-N 328.456 5.797 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 340437974 XFXKEZSQEFFBGZ-PMACEKPBSA-N 326.871 5.816 30 20 EKED C=CCC[C@H](C(=O)N(C)c1nc2ccccc2s1)c1ccccc1 487552098 ORELSXGQSXDDSS-INIZCTEOSA-N 336.460 5.009 30 20 EKED C=CCC(C)(C)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 497693461 BRLMPWQYKXYKDG-UHFFFAOYSA-N 339.401 5.014 30 20 EKED C=CCCc1ccccc1NC(=O)Nc1cnn(C2CCCC2)c1C 505016522 IPXJABWGHDDXCF-UHFFFAOYSA-N 338.455 5.069 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 530593807 ADLKVFNOHRVMEB-ZDUSSCGKSA-N 346.352 5.018 30 20 EKED C=CCC[C@H](NCc1cccc(O)c1)c1ccc(C(F)(F)F)cc1 533391966 UQVXIUQDSABYBU-SFHVURJKSA-N 335.369 5.208 30 20 EKED C=C(C)[C@H](CC(=O)Nc1ccc(S[C@H](C)CC)cc1C)OCC 534425414 JHUFJEQXHUMZOO-QAPCUYQASA-N 335.513 5.195 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1cnc(-c2ccccc2)s1 535785692 BDYAQBOFHJUJOI-UHFFFAOYSA-N 347.487 5.092 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 556197904 NPHJXLCORBDBBY-AUUYWEPGSA-N 330.834 5.565 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@H]3CCc4ccc(C#N)cc43)oc12 562095477 CJEDKGDZJUHJKR-KUHUBIRLSA-N 346.430 5.041 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 573825938 WQBVFTZHAGCQGL-YJBOKZPZSA-N 339.401 5.014 30 20 EKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)c2ccccc12 576793865 YQGMPNGHUQOXGZ-JLCFBVMHSA-N 330.406 5.189 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc2ccccc12 614179845 PJPLPICCUHRLAE-KRWDZBQOSA-N 328.459 5.492 30 20 EKED C=CCC1(NC(=O)Nc2ccc(C(C)C)cc2C(C)C)CCOCC1 665497776 NKRSYVMZNIMVIB-UHFFFAOYSA-N 344.499 5.180 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccccc1 669727328 GPEVFUDLXFBVGA-HXUWFJFHSA-N 334.463 5.420 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1ccnc2ccccc12 731313478 ZXTVDAAMZIQLQN-UHFFFAOYSA-N 337.426 5.276 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CCC(C)(C)C3)n2)cc1 781768122 VNDJWPGELJDGPT-HOTGVXAUSA-N 338.476 5.121 30 20 EKED C=CC[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccncc1 788579800 HMQJQLHDWRNHDH-SLBVQIDZSA-N 332.900 5.196 30 20 EKED Cc1nc(-c2cccnc2)sc1[C@@H](C)Nc1ccc(CCC#N)cc1 903297320 DMQGDXCFWJPUDL-CQSZACIVSA-N 348.475 5.143 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C\c1ccc(Cl)cc1 1776783036 DIAXIELBSIGYFD-JTHGQSKGSA-N 337.891 5.147 30 20 EKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)c(C)c1Cl 1777436226 WZGKBLMMERGSEY-VURMDHGXSA-N 349.213 5.205 30 20 EKED CC(C)c1ccc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc1 14497505 HJHNYWXWZWFFIV-UHFFFAOYSA-N 347.443 5.057 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Br)cc1 36991680 GMXWBLLOLOSAKX-FZKQIMNGSA-N 343.268 5.123 30 20 EKED CCCC(CCC)SCC(=O)c1cn(CCC#N)c2ccccc12 64048632 RJBSIWZDKXZARG-UHFFFAOYSA-N 342.508 5.440 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1cccc(C#N)c1 303131860 BKSOMZCMBXBPLE-MDZDMXLPSA-N 348.402 5.025 30 20 EKED C[C@@H](NCCCCF)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 319760394 YGDKQYUVBNWUNG-SECBINFHSA-N 331.275 5.125 30 20 EKED O/C(Cc1coc(-c2ccccc2)n1)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329176783 LVQURMRWLQRGAX-CGTJXYLNSA-N 338.451 5.200 30 20 EKED Cc1cc2c(cc1C)[C@@H](N[C@H](CCC#N)c1ccccc1)CCS2 427519360 OSIRJUZODHNWFO-UXHICEINSA-N 336.504 5.475 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 430613451 VNRPGYBDAVRDLZ-LLVKDONJSA-N 346.521 5.290 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1cccc(C#N)c1 437659498 XQOHYYGQCRLQRV-UHFFFAOYSA-N 339.464 5.152 30 20 EKED N#C[C@@H](NC(=O)CCCC1CCCC1)c1ccc(Cl)c(Cl)c1 463743623 HTLZEBAGSXHTQD-MRXNPFEDSA-N 339.266 5.035 30 20 EKED C=CCCC1(C(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)CC1 475105373 BXLLIZYQAPAEBB-OAHLLOKOSA-N 340.492 5.042 30 20 EKED C=CCOc1ccc(C(=O)Nc2c(CC)ccc(Cl)c2CC)cc1 498286861 JPDLEVXGXMPYLP-UHFFFAOYSA-N 343.854 5.282 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)C2(C#N)CCCCC2)c(C)c1 498453725 ONRPGLPKBGEYMD-HNNXBMFYSA-N 330.497 5.298 30 20 EKED CCCN(C(=O)c1ccc(CC#N)cc1)[C@H](C)c1cc2ccccc2o1 533922645 RCZIOIRLZMHIPD-MRXNPFEDSA-N 346.430 5.112 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1cccc(C#N)c1 537293830 INZOCWGZZURMPH-YJYMSZOUSA-N 328.406 5.274 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 559860058 PTOLLAUCTQYFHJ-KXBFYZLASA-N 346.396 5.791 30 20 EKED CCCCCCCCCCC(C)(C)C(=O)N1[C@H]2CC[C@H]1CC(O)C2 755908473 SOEGAFVWMFRQDH-ROUUACIJSA-N 337.548 5.058 30 20 EKED C=CCC(CC=C)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 758509910 LNMOPSBJXNBYTN-QGZVFWFLSA-N 336.460 5.063 30 20 EKED O=C1/C(=C\c2nc(Cl)cs2)CCSc2ccc(Cl)cc21 759082018 BBDNXLRCZCCJCY-YVMONPNESA-N 342.272 5.212 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 766022912 YRVQUXMLVXTMAK-JPYJTQIMSA-N 344.458 5.842 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797572180 ZWCZFRLAJWQKIO-GJZGRUSLSA-N 332.513 5.223 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815635856 KFBMQKXVLZJMRI-KSSFIOAISA-N 328.843 5.131 30 20 EKED C[C@@H](Nc1ccccc1COC(C)(C)C)c1ccc(OCC#N)cc1 903293552 LDHDERVZMLCERQ-MRXNPFEDSA-N 338.451 5.077 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1F 915087456 UNXJSUAIWKDWPK-HXUWFJFHSA-N 344.389 5.042 30 20 EKED CCCCCCC[C@@H](C)CNC(=O)Nc1ccc(C)c(NC(C)=O)c1 918035636 WYFOIZXIOJCSQQ-OAHLLOKOSA-N 347.503 5.072 30 20 EKED N#Cc1ccc(CSCc2coc(-c3ccc(Cl)cc3)n2)cc1 31423469 RRUXPHDTJSJKBJ-UHFFFAOYSA-N 340.835 5.300 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)OC1CCCCC1 189872397 GTHULDCMRBKBTJ-HXUWFJFHSA-N 343.511 5.605 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCOC)C(CC)CC 191439794 GDKUTSLYUVPPQV-UHFFFAOYSA-N 346.515 5.207 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@H](c2ccccc2)C(C)C)c1 303497092 LTHCFNNKXPNAAU-FQEVSTJZSA-N 338.451 5.112 30 20 EKED C[C@H](/N=C(/O)[C@]1(C)CCc2ccccc2C1)c1ccc2c(c1)CC(O)=N2 329046747 VDNGRIUABVNNTL-RCDICMHDSA-N 348.446 5.043 30 20 EKED C[C@@H](CCCC(F)(F)F)NC1CCC(C#N)(c2ccccc2)CC1 426054128 FWBMELPLYUFKLA-ZLPCBKJTSA-N 338.417 5.101 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=O)Nc3ccc(CC#N)cc3)c2)o1 431585762 NONDCJFSTAVENM-UHFFFAOYSA-N 345.402 5.274 30 20 EKED C[C@H](S[C@@H](C)c1nc(-c2cccs2)no1)c1cccc(C#N)c1 443156967 PVZUANCSQDRXQW-RYUDHWBXSA-N 341.461 5.225 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2=CCCC2)cc1Cl 471230378 PYKJJVGSEYNECJ-GOSISDBHSA-N 336.822 5.044 30 20 EKED Cc1ccc([C@@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1C 475174980 JSGFAMYOHKKZAZ-IRLDBZIGSA-N 346.474 5.055 30 20 EKED C=CCC[C@@H](C(=O)N(C)c1nc2ccccc2s1)c1ccccc1 487552099 ORELSXGQSXDDSS-MRXNPFEDSA-N 336.460 5.009 30 20 EKED Cc1cc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)sc1Br 512106623 OTTOTKQFCXTOOU-VXGBXAGGSA-N 349.297 5.103 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)sc1Cl 536840801 VVICJAWPKYIICW-SMDDNHRTSA-N 339.291 5.751 30 20 EKED C/C=C\c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 584861480 HMERRIFIEGVUDW-UQCOIBPSSA-N 342.446 5.109 30 20 EKED C=CCC[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CC1 676637741 QTRMZQNRMMLEQI-BZPMIXESSA-N 343.355 5.230 30 20 EKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cc1 728440964 ATVDLDPRNOHIPF-AWNIVKPZSA-N 339.460 5.042 30 20 EKED C/C(=C/C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 731332022 ASTMPXIQKHJCBQ-YARYAAFXSA-N 336.460 5.123 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1 735793275 RRNJGBDSJWDEJP-GDBMZVCRSA-N 325.456 5.044 30 20 EKED COc1ccccc1-c1ccc(/C=C2/COc3ccccc3C2=O)cc1 741468163 FZIDFMDZPWCEMY-JXAWBTAJSA-N 342.394 5.021 30 20 EKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1ccnc(F)c1 794720824 IEEWPSQMNCDBSQ-PBDTWZTKSA-N 335.300 5.082 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCCC[C@@H]1c1nc(C)no1 804858715 FIEJHFGSAQGISF-FUHWJXTLSA-N 349.519 5.208 30 20 EKED N#C[C@H](C(=O)[C@H]1CCC[C@@H]1c1ccccc1)c1nc2ccccc2s1 835039991 MKAOETYEDVQSKB-IXDOHACOSA-N 346.455 5.056 30 20 EKED CC(C)CC(Cc1cccc(Cl)c1)=NNc1cccc(C(=O)O)c1 1776036832 BWOUAGSFEKBOKT-UHFFFAOYSA-N 344.842 5.095 30 20 EKED Cc1c(NN=C2CCC[C@H]2c2ccc(Cl)cc2)cccc1C(=O)O 1776087120 JNDDZYGEBKGQOI-INIZCTEOSA-N 342.826 5.082 30 20 EKED C=CCCC1(CNc2nc3ccccc3c(C)c2C(=O)O)CCCC1 1776170431 KSEYBPJAZXSHTI-UHFFFAOYSA-N 338.451 5.180 30 20 EKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc2ccccc12 25364077 JKVRRTYNHJYNHW-SFHVURJKSA-N 343.474 5.040 30 20 EKED C[C@H](SCc1csc(-c2ccccn2)n1)c1cccc(C#N)c1 190791640 IPEXCZHIXNWREI-ZDUSSCGKSA-N 337.473 5.071 30 20 EKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 424356108 UWJUMWCKNOHIBV-QRWLVFNGSA-N 342.870 5.434 30 20 EKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426136434 AQHXCPPALOENLK-NSHDSACASA-N 348.233 5.090 30 20 EKED C=CCC[C@H](NC(=O)N(CC=C)Cc1cccs1)c1ccccc1 435106106 ZNTZBMDDPQBWNF-IBGZPJMESA-N 340.492 5.153 30 20 EKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1Cl 439446073 PWLWOXPFQJEDNB-GFCCVEGCSA-N 341.867 5.014 30 20 EKED C[C@H](NC(=O)N[C@H](CC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 503350055 VHFQBRRLFCZJGP-OXJNMPFZSA-N 349.478 5.096 30 20 EKED C=C[C@H](CC(=O)N(C)[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 535452639 XYNFBKCECHPDEM-DNVCBOLYSA-N 347.380 5.108 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 540594776 NYDWOXDNPXACMZ-AOMKIAJQSA-N 346.861 5.652 30 20 EKED C[C@H](NCCCCC#N)c1ccc(-c2ccc(Cl)cc2F)s1 542678418 UNVKMRMARLPAOE-LBPRGKRZSA-N 336.863 5.552 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(-c2ccncc2)c(C)c1)c1ccccc1 561089199 JTABSJHOHHOWSQ-GOSISDBHSA-N 342.442 5.355 30 20 EKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(C2CCC2)c1 570712196 MMLMGNGBJJPVPG-HNNXBMFYSA-N 333.435 5.051 30 20 EKED CC(C)(C)[C@H](NCc1ccc(C#N)cc1F)c1cc2ccccc2o1 611524483 JDDTUZCEJBCAFG-HXUWFJFHSA-N 336.410 5.321 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cl)o1 682777449 YWPMXBBOHMYHRG-UHFFFAOYSA-N 332.831 5.107 30 20 EKED C=C[C@@](C)(CC)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 685383482 FYAOPQRZQZTVPP-WFASDCNBSA-N 328.309 5.001 30 20 EKED CC(C)(C)/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 735208540 ZEDWHUFPOCBRMR-CKXPSTMWSA-N 344.867 5.242 30 20 EKED C#CCCCCNCc1nc(-c2cc(Cl)ccc2Cl)cs1 754065057 OZRGFZUIZMANOK-UHFFFAOYSA-N 339.291 5.010 30 20 EKED C[C@H](NCc1ccc2oc3ccccc3c2c1)c1ccc(C#N)cc1 775160321 ZFOLEWCUMJJNML-HNNXBMFYSA-N 326.399 5.308 30 20 EKED C[C@H](N[C@H](CC1CCCC1)c1ccccc1)c1ccc(OCC#N)cc1 776170311 OVEBFPSMJAEJNH-FDDCHVKYSA-N 348.490 5.561 30 20 EKED N#CCOc1cccc(NCc2ccc(-c3ccc(F)cc3)s2)c1 779587529 AJUQMSGFFFDCGH-UHFFFAOYSA-N 338.407 5.069 30 20 EKED C[C@H](Nc1ccc(-c2ccco2)cc1F)c1ccc(OCC#N)cc1 787002143 SDRKYXVMFKKQKU-AWEZNQCLSA-N 336.366 5.161 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](OCC)C1CCCC1 867727057 PUSFUFQXEXHXNT-HXUWFJFHSA-N 329.484 5.072 30 20 EKED C=CCCCCC[C@H](C)N[C@@H](C(=O)O)c1ccc2ccccc2c1 901514373 GMHPXAQOFJURNX-OXJNMPFZSA-N 325.452 5.080 30 20 EKED FC(F)(F)c1ccccc1C=NNc1ccccc1C(F)(F)F 916259802 MHNLRXCOKDQDRK-UHFFFAOYSA-N 332.247 5.170 30 20 EKED C=CCCCCCCCCCNc1cc(C)c([N+](=O)[O-])cc1C(=O)O 1776172464 HQLYMZCEGRLCNT-UHFFFAOYSA-N 348.443 5.320 30 20 EKED CC(/C=C/C(=O)c1ccc(NC(=O)NC(C)C)cc1)=C\c1ccccc1 60349781 DGIUAJWHMMQHBA-WKURBQFISA-N 348.446 5.059 30 20 EKED C[C@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1ccc(C#N)cc1 154319987 DUNFRRNRLFFCTQ-UONOGXRCSA-N 346.446 5.327 30 20 EKED C[C@H](Nc1ccc2cc(C#N)ccc2n1)c1nc(C(C)(C)C)cs1 301957599 ARXFKIPYMFFIKC-LBPRGKRZSA-N 336.464 5.034 30 20 EKED N#Cc1ccc(NC(=O)c2cc3ccccc3s2)cc1C(F)(F)F 325147419 JTQVCCVAUVMHMU-UHFFFAOYSA-N 346.333 5.044 30 20 EKED C[C@](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)(C(=N)O)c1ccccc1 329084803 UABQOTINBJBXNO-CNVJLJKISA-N 328.456 5.000 30 20 EKED CC(C)O[C@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 433025265 JGWUBMJHDGRHPR-FCHUYYIVSA-N 336.479 5.177 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)C1CCCCC1 438041566 MXAWBUNZNOHEKK-GJZGRUSLSA-N 345.512 5.029 30 20 EKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)c1ccc2ccccc2c1 439767259 JGRICZZAPJJWJO-CYBMUJFWSA-N 346.455 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(F)cc1F 475582005 RSPDFQFWWRZFQA-UHFFFAOYSA-N 344.405 5.138 30 20 EKED Cc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)n1 481024528 OWKNYEGVOGQGFO-QGZVFWFLSA-N 341.458 5.088 30 20 EKED CC(C)n1c([C@@H]2CCCN2CCCC(C)(C)C#N)nc2ccccc21 483063218 LXFUMBYCGRJFQC-IBGZPJMESA-N 338.499 5.084 30 20 EKED CC(C)[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 487606994 WSGUHPXSUBVHDN-VXKWHMMOSA-N 348.490 5.368 30 20 EKED N#Cc1ccc(NC(=O)c2ccc(SCc3ccccc3)cc2)cc1 515434135 UESVHTUIFTZGHE-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600537 CGXPOLNVZNJHQF-OAHLLOKOSA-N 337.423 5.003 30 20 EKED C[C@H]1CCC[C@H](OCc2cccc(NCc3cc(C#N)cs3)c2)C1 532728371 OMXCLQWGUNKQOU-KXBFYZLASA-N 340.492 5.327 30 20 EKED N#CCCCCCC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 588834887 QVHWXBPQBUSAIC-JOCHJYFZSA-N 346.430 5.112 30 20 EKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1(C)C 609428698 UXZITXCLZGWVFN-HDMKZQKVSA-N 342.508 5.258 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc2ccccc2c1 610078288 AAYYUPWRGHRXLR-INIZCTEOSA-N 332.472 5.846 30 20 EKED Cc1ccsc1C(=O)/C=C\c1csc(-c2ccc(F)cc2)n1 733749513 YYSDPBMUCITJTC-SREVYHEPSA-N 329.421 5.215 30 20 EKED COCc1cccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)c1 742434316 HFGYFIWBXBOGRR-QXMHVHEDSA-N 349.455 5.161 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc2cc(OC)ccc2c1)c1ccccc1 773115132 LRPDVTWZTGASCO-GAJHUEQPSA-N 329.443 5.264 30 20 EKED O=C(/C=C\c1ccc(SC(F)F)cc1)c1cccc(F)c1F 781550455 XDVBRGRSCANQRF-TWGQIWQCSA-N 326.314 5.176 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@@H]2c2ccccc2)n1 835201793 ZOUUUSXQRHPEAD-BRWVUGGUSA-N 338.476 5.027 30 20 EKED CCCCCCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917045409 ZESJZFDVONNPSC-ZDUSSCGKSA-N 334.872 5.486 30 20 EKED O=C(O)c1ccc(NN=C(CC2CCCC2)CC2CCCC2)cc1F 1776076832 ITOXTJKKCDCJNJ-UHFFFAOYSA-N 346.446 5.452 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)n1 89980099 UEDXCVWKZLSTHD-INIZCTEOSA-N 336.416 5.017 30 20 EKED N#CCC[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccc1 164278281 IFLZPWZEDGRJSE-INIZCTEOSA-N 329.325 5.034 30 20 EKED CCOc1cc(/C=C/C(=O)c2ccc(Cl)s2)cc(Cl)c1O 301492863 RZKGOYYQGBCGEI-ONEGZZNKSA-N 343.231 5.055 30 20 EKED O/C(=N/Cc1cc(O)nc2ccccc12)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329186204 PTJPQBBYDMYONY-QILLFSRXSA-N 338.451 5.003 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2cccc(C#N)c2)n1 442911007 DPASEZSYSMFHIS-LLVKDONJSA-N 347.365 5.005 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H](CC)c3ccc(C#N)cc3)oc12 447518557 NWAVLVXHWWVHMJ-HNAYVOBHSA-N 348.446 5.505 30 20 EKED CC(C)(CCC(=O)Nc1ccc(CC#N)cc1Cl)c1ccccc1 452643922 KYACQLQARXKNQX-UHFFFAOYSA-N 340.854 5.103 30 20 EKED C=CCC[C@@H](C(=O)Nc1cnc(C(F)(F)F)cc1C)c1ccccc1 464661749 KTRBAYYSQAGTTR-OAHLLOKOSA-N 348.368 5.097 30 20 EKED N#CC[C@H](CC(=O)N1CCC[C@H]1CCC1CCCC1)c1ccccc1 476379285 VCTGCPTWCIGYPS-RTWAWAEBSA-N 338.495 5.035 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1 483045744 KJJCRTQMDJITOZ-LAUBAEHRSA-N 334.463 5.420 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 488380210 ORPLOAXDIONXEC-JKSUJKDBSA-N 332.513 5.458 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC1CCCC1 510875936 BFMKZKXSMSCDPW-HUUCEWRRSA-N 330.497 5.236 30 20 EKED CC(C)[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 538225914 KKSGJOPPIRREFD-FQEVSTJZSA-N 342.433 5.253 30 20 EKED N#CCC1CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 542854799 VSUNCIBQAPLKAA-UHFFFAOYSA-N 330.884 5.194 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2CCCC[C@@H]21 563085109 PNYDJZKZVBXDCY-LPHOPBHVSA-N 326.484 5.335 30 20 EKED N#CCCC1CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CC1 569237863 GZRQMVBFVDCLQL-UHFFFAOYSA-N 349.434 5.027 30 20 EKED Cc1csc(Sc2ccc(NC(=O)CCCCCC#N)cc2)n1 588156438 LNFJIRFCYREZAN-UHFFFAOYSA-N 345.493 5.015 30 20 EKED C[C@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccc(C#N)cc1 603633305 UQRQELLRQKYYEK-SFHVURJKSA-N 341.458 5.177 30 20 EKED CCCCCCCC(=O)Nc1ccc(Sc2ncccn2)cc1C 727056235 NLMGLYIYHVZRGG-UHFFFAOYSA-N 343.496 5.235 30 20 EKED N#CCOc1cccc(/C=C/C(=O)c2cccc(-c3ccccc3)c2)c1 730150863 YJSQBNHCXHFKTQ-OUKQBFOZSA-N 339.394 5.152 30 20 EKED Cc1ccc(-c2ncc(/C=C3/CCc4c(O)cccc4C3=O)s2)cc1 742434211 DHDZNHIDJNOPDO-PTNGSMBKSA-N 347.439 5.037 30 20 EKED C=C[C@H](CC(=O)O[C@H](c1ccccc1)c1ccccn1)c1ccccc1 759276536 XDHUKGVTTTUKEN-WZONZLPQSA-N 343.426 5.074 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCCC[C@H]1c1nc(C)no1 804858714 FIEJHFGSAQGISF-AEFFLSMTSA-N 349.519 5.208 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cc(Cl)cc(Cl)c1O 806133167 IMIJCWWZUPRTCO-APPDUMDISA-N 349.261 5.373 30 20 EKED C=CCCCN(CC)C(=O)Nc1ccccc1CCC(F)(F)F 930345193 SAQNJCOLAYZKKJ-UHFFFAOYSA-N 328.378 5.002 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc([C@H](C)CC)cc1 1776784305 STISTECVKFCCFS-XLIONFOSSA-N 333.516 5.494 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sccc1C1CC1 70859311 SGPORODVDIXLBU-GFCCVEGCSA-N 342.489 5.130 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Cl 118445696 KTXQHMLWVQTYGD-OLZOCXBDSA-N 344.867 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@H](C)[C@H]1c1ccccc1 430810834 MUSHTDHWWMRMAU-TYCQWZJGSA-N 333.475 5.527 30 20 EKED C=CCC[C@@H](NCc1ccc(OCc2ccccn2)cc1)c1ccco1 476015061 XTCPEBRWANKOIO-OAQYLSRUSA-N 348.446 5.051 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCc2ccccc21 476128314 BJYVHIBYBIRBCD-NRFANRHFSA-N 333.475 5.597 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2sccc2C#N)o1 477920667 MVQSSPKWLKTZLU-UHFFFAOYSA-N 342.807 5.094 30 20 EKED C[C@@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1F 512646760 CWPJFCNUISMQCG-YJYMSZOUSA-N 328.406 5.274 30 20 EKED C=CCC[C@H](NCc1cn(-c2ccccc2)nc1C(C)C)c1ccco1 513654168 HJUMQDHJGQJHQJ-FQEVSTJZSA-N 349.478 5.386 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520923526 QFSXMFMVLSWUEA-OAHLLOKOSA-N 338.476 5.457 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)ccc1OC 531695216 BCSJMWDBPNDCNQ-ACJLOTCBSA-N 328.843 5.022 30 20 EKED CSc1cccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C 538199531 URKXECWTJOOLQT-UHFFFAOYSA-N 339.464 5.162 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(C(F)(F)F)c1 557518213 WHHFBYOIXDZDJS-YJYMSZOUSA-N 344.380 5.305 30 20 EKED N#C[C@@H](C(=O)/C=C\C1CCCCC1)c1nc(-c2ccccc2)cs1 735594069 UIBBCBGMJKUGCU-CPFIRTDXSA-N 336.460 5.123 30 20 EKED C#Cc1cccc(NC(=O)N(Cc2ccccc2)C2CCCCC2)c1 743084356 NRKMCZGBRSELQQ-UHFFFAOYSA-N 332.447 5.035 30 20 EKED CCCC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 760008067 NJHDRHYHQMTQFK-HXUWFJFHSA-N 347.462 5.044 30 20 EKED FC(F)(F)c1ccc(C=NOc2ccccc2C(F)(F)F)s1 761828903 VAECDRYKPGKEAU-UHFFFAOYSA-N 339.260 5.199 30 20 EKED O=C1/C(=C/c2scnc2C2CC2)Cc2c1ccc(Cl)c2Cl 782327564 RPQHZZRBJVUDBT-RMKNXTFCSA-N 336.243 5.150 30 20 EKED CC[C@@H](C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 796800210 VWKWCWNLKXEZPG-CJNGLKHVSA-N 326.465 5.121 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3c(F)cccc3Cl)co2)cc1 809159184 KDGABIVHMTVBGF-KTKRTIGZSA-N 341.769 5.339 30 20 EKED CCCCCC1=C(C)CCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776033283 YKCLNGYVYLAFIS-UHFFFAOYSA-N 334.847 5.497 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776805980 MJYVTEKNYUYBOO-VAWYXSNFSA-N 342.822 5.277 30 20 EKED CC[C@H]1CCCCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 159277748 UMERCLMQMHAJDH-HOTGVXAUSA-N 345.512 5.125 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc2ccccc12 195656638 OHTOXTQAXLXDQG-KRWDZBQOSA-N 330.431 5.695 30 20 EKED CC1(C)CCC(CC(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 352198378 LGNVRIMJKIDQIV-IBGZPJMESA-N 326.484 5.144 30 20 EKED C[C@H](C#N)CSc1ccccc1NCC#Cc1ccc(Cl)cc1 443541999 MERNFCPVUYTUIE-OAHLLOKOSA-N 340.879 5.055 30 20 EKED CC(C)(C#N)CCCCNC(C)(C)c1ccc(OC(F)(F)F)cc1 444696629 WANXPBHDECXAJT-UHFFFAOYSA-N 342.405 5.130 30 20 EKED C=CC[C@H]1N(C(=O)Nc2cccc(SC)c2C)CCCC1(C)C 444942102 NJYHYSBCKZKRLU-QGZVFWFLSA-N 332.513 5.316 30 20 EKED Cc1cccnc1[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(C)C 481670565 PDBCGNVDUCVXRM-NHCUHLMSSA-N 333.479 5.016 30 20 EKED C[C@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(C#N)c(F)c1 482070912 GAKJTSQIVDZKEC-YTRMGSRMSA-N 346.808 5.029 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](c1ccccc1)C(C)C 482407703 MAHJYBPKLXEOBN-JOCHJYFZSA-N 348.490 5.127 30 20 EKED CO[C@H](CSCCCCC(C)(C)C#N)c1ccc(Cl)cc1 509147259 SCBYWMORWHPFKY-MRXNPFEDSA-N 325.905 5.481 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCc2cccc(C#N)c2)c1 531152134 LBMLRYYWFAMOQK-UHFFFAOYSA-N 336.382 5.133 30 20 EKED CC(C)(NCc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 542209784 MNEJIFXGVPYFMC-UHFFFAOYSA-N 333.262 5.084 30 20 EKED CCC[C@@H](C)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944687 TYRLJGPIWSWSEU-IAGOWNOFSA-N 349.478 5.116 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@H](C#N)c1ccc(Cl)cc1 595414568 FFOXWHNZESIHPJ-RDTXWAMCSA-N 328.843 5.043 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccc(F)cc3)n2)c(F)c1 610165719 IEXVYXPKCUBPRU-UHFFFAOYSA-N 344.411 5.252 30 20 EKED N#Cc1ccc(CN[C@H]2CCCSc3ccc(Cl)cc32)c(F)c1 610812492 GYUBXAAGKXYBBO-KRWDZBQOSA-N 346.858 5.068 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(COC(C)(C)C)cc1 674575210 IZGPQXMIUJQIJW-UHFFFAOYSA-N 332.488 5.212 30 20 EKED C=CC[C@@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 681709035 QVYBRWSACVILHX-GOSISDBHSA-N 347.380 5.024 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C\c3cccs3)c2)cc1 729375839 UZCOSHMDQCGVQA-KHPPLWFESA-N 346.411 5.064 30 20 EKED Cc1ccc(O)c([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c1 756785309 CSYRGQSHEVSWJN-QGZVFWFLSA-N 342.442 5.090 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc(C)ccc1OC(F)F)c1ccccc1 773106953 NHLFGESNVKXICW-YJBOKZPZSA-N 329.390 5.012 30 20 EKED CC[C@@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(C#N)cc1 774275767 YKRMNSROJSCGDP-QGZVFWFLSA-N 334.341 5.063 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)nc2ccccc12)c1ccccc1 814658286 AMSGCNFBWQRMAR-LJQANCHMSA-N 349.865 5.413 30 20 EKED Oc1ccc(C2CCC(=NNc3nccc4sccc34)CC2)cc1 814808906 LCJQSTFFLZXNNI-UHFFFAOYSA-N 337.448 5.128 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2ccc(C(F)F)cc2)n1 870224771 KMXBBDCVLAKDEG-AWEZNQCLSA-N 348.418 5.013 30 20 EKED C=Cc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776194416 DSGPXCNQKFGJIV-GHXNOFRVSA-N 344.366 5.184 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cc1O 18065491 OXFMTNGYNJEPHZ-VQHVLOKHSA-N 336.412 5.025 30 20 EKED CC1(C)C[C@H](c2ccccc2Br)Nc2ccc(C#N)cc21 91691868 BDUXCPJFSPQVAN-QGZVFWFLSA-N 341.252 5.155 30 20 EKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1cccc(-c2ccccc2)c1 98055532 KOKOTARCUDTBNM-KTKRTIGZSA-N 335.384 5.219 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/c2nc3cc(Cl)ccc3s2)cc1 110970260 QRNQLIGIZCMJSL-KFRNIWOLSA-N 340.835 5.411 30 20 EKED C[C@@H](NCc1ccc(OCC#N)cc1)c1cccc(-c2ccccc2)c1 180558893 WAHSVEFUSDKSRD-GOSISDBHSA-N 342.442 5.107 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(OC)c1 189900284 INBCMSXIYKQGMH-MRXNPFEDSA-N 337.463 5.289 30 20 EKED C=CCCC[C@@H](C)NC(=O)C(C)(C)c1csc(-c2cccs2)n1 410013165 SGYYTQRMHLRRID-CYBMUJFWSA-N 348.537 5.010 30 20 EKED CCCCSc1nnc(S[C@H](C)c2cccc(C#N)c2)s1 442906251 XCOZQRDHHRFECO-LLVKDONJSA-N 335.523 5.155 30 20 EKED Cc1cccnc1[C@H]1CCC[C@H](Nc2cccc(OCCCC#N)c2)C1 467330024 FPEPFEOTSNDLJF-OALUTQOASA-N 349.478 5.211 30 20 EKED Cc1ccccc1-c1noc([C@H](C)S[C@H](C)c2ccc(C#N)cc2)n1 476171407 XXLBINGBWDLQDX-CABCVRRESA-N 349.459 5.472 30 20 EKED C=CCC[C@H](NCc1ccc(CC)nc1)c1ccc(C(F)(F)F)cc1 512050001 BEXGTCSWSYDKLY-IBGZPJMESA-N 348.412 5.460 30 20 EKED C[C@H](SCC(=O)Nc1cccc(C#N)c1)c1cccc2ccccc12 518745363 OKQAVSBRHQHLDO-HNNXBMFYSA-N 346.455 5.144 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(N2CCCCCC2)c1 524931678 FRUGCECBZVJGNY-UHFFFAOYSA-N 343.515 5.277 30 20 EKED CCCC[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(OC)cc1 565532659 LNWUCESFSWPRKG-FGZHOGPDSA-N 334.463 5.075 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC(F)(F)F)cc1 586790324 SMDIWGQVQHEGBF-FZKQIMNGSA-N 348.368 5.259 30 20 EKED C=CCC(C)(C)C(=O)Nc1ccc(NC(=O)C(C)(C)CC=C)c(C)c1 619324787 VIGZFPMYROMKBY-UHFFFAOYSA-N 342.483 5.077 30 20 EKED CCOc1ccc(/C=N\[C@@H](C)c2ccc(-c3ccncc3)cc2)c(O)c1 746392925 GDQUGOHUWPZODO-PHQOBFFQSA-N 346.430 5.033 30 20 EKED N#Cc1c(F)ccc(/C=C(\Cl)c2nc3ccccc3o2)c1Cl 761478253 OEMYMMNNHKWTNN-XFFZJAGNSA-N 333.149 5.229 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc2cc(OC)ccc2c1)c1ccncc1 766018922 JRQAUOVRQFNZQY-AOMKIAJQSA-N 332.447 5.211 30 20 EKED Cc1nn(C(C)C)cc1/C=C1/CCSc2ccc(Cl)cc2C1=O 798370732 WAQLVMHVPDDNJZ-JYRVWZFOSA-N 346.883 5.188 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352876 OJAZRNJUFIOUFE-RTWAWAEBSA-N 347.462 5.138 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2ccccc12 189880732 BVZIGDVIMMFEMY-UHFFFAOYSA-N 332.447 5.201 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1OCCc2ccccc21 189901259 JHSDYOSKEDMBDQ-OAQYLSRUSA-N 349.474 5.181 30 20 EKED CC(C)(C#N)CCCCN[C@@H](c1cccc(Cl)c1)c1ccccn1 277870583 YOCUPZYUAKYTPE-IBGZPJMESA-N 341.886 5.134 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCC(F)(F)C1 281144028 WAGKNZWFLQBOMX-CQSZACIVSA-N 336.426 5.095 30 20 EKED Cc1cc(N[C@H](CCC#N)c2ccccc2)c(Cl)cc1[N+](=O)[O-] 301797943 REGBPSJKEMFBSV-OAHLLOKOSA-N 329.787 5.014 30 20 EKED N#CCCC[C@H](N[C@H]1CCC[C@@H](c2cccnc2)C1)c1ccccc1 340440777 CTGYCODLRZWUAS-HJNYFJLDSA-N 333.479 5.133 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 451016935 JFMVYIPXKVFQKU-KRWDZBQOSA-N 344.890 5.073 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)s1 477863741 PCTRTAHJMBFTLB-LLVKDONJSA-N 340.473 5.145 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1C 510073534 OSBUFAXSGOBWHZ-JKSUJKDBSA-N 349.434 5.003 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccccc1Oc1c(C)cccc1C 520722458 ABRRUSARDWHPDZ-KRWDZBQOSA-N 339.435 5.015 30 20 EKED N#Cc1ccsc1C(=O)Nc1cccc(CSC2CCCC2)c1 525385240 VPKJBOJNGVDHME-UHFFFAOYSA-N 342.489 5.048 30 20 EKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 728764510 RYYQEQFJZPTEOR-UXHICEINSA-N 342.442 5.241 30 20 EKED Cc1cc(C)cc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1 730437538 RWZWVPFGDHOFKB-ARJAWSKDSA-N 325.458 5.385 30 20 EKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1ccsc1 749101163 BVPKRKZLJALRSB-WAYWQWQTSA-N 331.849 5.421 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@H]1c1cn(C)nc1C 775183489 VROZJBPABJVJBK-PXNSSMCTSA-N 347.547 5.169 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCC(C)(C)c3ccccc32)c1 795804457 WEJPXOGRNZXDGL-XMSQKQJNSA-N 348.490 5.270 30 20 EKED CC#CC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1Cl 801278108 DPIPFQQQIGQBAU-UHFFFAOYSA-N 338.621 5.276 30 20 EKED C=CCC1(C(=O)Nc2cccc(NC(=O)OC(C)(C)C)c2C)CCC1 862718403 INZAJYLFUWSGKM-UHFFFAOYSA-N 344.455 5.027 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1 1776038053 POLHIFRSLOCQJC-RDTXWAMCSA-N 330.472 5.415 30 20 EKED Cc1ccccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777465336 RSVNJPNYUNZNED-ZRDIBKRKSA-N 348.423 5.318 30 20 EKED CCCN(C(=O)c1cccc(CC#N)c1)[C@@H](C)c1cc2ccccc2o1 54283819 YYSJVTIPHZCPFV-INIZCTEOSA-N 346.430 5.112 30 20 EKED CC(C)[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 155961304 FYLCCDUAIFVDQY-RDJZCZTQSA-N 345.512 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(C)cc1Cl 189873567 SVKPBIOEYVYQCX-UHFFFAOYSA-N 341.882 6.061 30 20 EKED Cc1c(Cl)cccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 192505712 GQEZHWSAQFQZRU-GFCCVEGCSA-N 344.867 5.153 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCC[C@@H](OC)C1 282033328 YAUTVGPMZZIXOX-SJLPKXTDSA-N 329.484 5.072 30 20 EKED Cc1ccc(-c2nc(N=C(O)[C@@H]3CCC(=O)[C@H](C)C3)sc2C)s1 329006686 XWRXHXOSMFJIOA-BXKDBHETSA-N 348.493 5.082 30 20 EKED CC[C@@H]1C[C@@H](/C(O)=N/C[C@@H]2C[C@@H](C(C)C)c3ccccc32)CC(O)=N1 329881092 OBBAIBMUEXBFBY-OLMMMNRUSA-N 342.483 5.015 30 20 EKED Cc1ccc(C)c2c1CCC[C@@H]2N[C@H](CCCC#N)c1ccccc1 340431020 BMGFKVVMCLCUJG-YADHBBJMSA-N 332.491 5.706 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cc(F)ccc1Cl 438294701 KHVAKOAUSDIDLB-GFCCVEGCSA-N 334.847 5.485 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(CC(F)(F)F)cc1 438378544 YWZDCTBRHPMALK-UHFFFAOYSA-N 328.378 5.002 30 20 EKED C[C@@H](Sc1ccccc1C#N)c1nnc(-c2cccc(Cl)c2)o1 439689183 BQMLOGNFHGIPJT-LLVKDONJSA-N 341.823 5.115 30 20 EKED C[C@@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1 443146437 OWKMPHZKKCCODI-CHWSQXEVSA-N 344.867 5.033 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 444685044 QDPDHNPUCSBJQI-SFHVURJKSA-N 345.490 5.596 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 470196269 XYRSERFTIVVHQC-WMLDXEAASA-N 339.401 5.361 30 20 EKED Cc1ccc(-c2csc3ncnc(S[C@@H](C)CCC#N)c23)cc1 470442342 OABCVMUBARAVBD-ZDUSSCGKSA-N 339.489 5.451 30 20 EKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cccc2ccccc12 474205559 KBFOGOVJXQSTDO-XLIONFOSSA-N 342.442 5.105 30 20 EKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)cc1Cl 483439872 LKVVAVLJPGMFBG-CYBMUJFWSA-N 340.835 5.057 30 20 EKED Cc1ccccc1[C@H](C)Nc1ccc(Oc2ccnc(C#N)c2)cc1 515024467 PYEBQFVLUDQXOF-INIZCTEOSA-N 329.403 5.227 30 20 EKED CC[C@H](CC(=O)Nc1sc(C)c(C)c1C#N)c1ccc(C)cc1 523102635 UOSILDQIXJANMF-OAHLLOKOSA-N 326.465 5.067 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 524567228 KDESFBAFBRQVKC-RTWAWAEBSA-N 347.483 5.220 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1 536842110 WGTAMCMSPHQEJY-PXNSSMCTSA-N 337.463 5.206 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 556203540 RUNMMQOUXMYNBP-HNAYVOBHSA-N 346.396 5.791 30 20 EKED Cc1cc([C@H](C)N[C@H](C)c2cccc(C#N)c2)sc1Br 586778353 ZYXVJUWMRMXYQN-NEPJUHHUSA-N 349.297 5.103 30 20 EKED C[C@H](NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccc(C#N)cc1F 593721589 QIFABSIKJZUOKS-LBPRGKRZSA-N 348.343 5.056 30 20 EKED C[C@H](N[C@@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 609825274 OUQOQQZCZUMABJ-CYFREDJKSA-N 340.470 5.583 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1F 610008000 BROSUHUZOKSFEZ-LJQANCHMSA-N 330.378 5.211 30 20 EKED Cc1sc2ncnc(S[C@@H](C#N)c3ccc(Cl)cc3)c2c1C 619863810 GQVUAVDGZMTOAQ-ZDUSSCGKSA-N 345.880 5.319 30 20 EKED C#Cc1cccc(NC(=S)N(CCCC)[C@@H](C)c2ccc(C)o2)c1 726484969 HJWVAUYBSGLZNL-INIZCTEOSA-N 340.492 5.129 30 20 EKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2c(C)noc2C)cc1 727781171 GETBQDFULDNIPJ-OUKQBFOZSA-N 347.414 5.075 30 20 EKED CCCN(Cc1ccc(OCC#N)cc1)[C@H](C)c1cc2ccccc2o1 731211836 DGKGRQZKNWPNBG-QGZVFWFLSA-N 348.446 5.308 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3ccsc3)cc2)c1 731331813 RISWIUDYQBOPNV-WTKPLQERSA-N 346.411 5.064 30 20 EKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 735398759 MBYXUFJFBJQXKK-ZIAGYGMSSA-N 347.409 5.214 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(Oc2ccccc2)c(F)c1 742432738 GGVVNMFCHJJKFK-NTMALXAHSA-N 339.391 5.279 30 20 EKED CC(=NNc1c(C)cc(C)cc1C)c1c(C)nn(-c2ccccc2)c1C 743445197 IVDAOCALCBLAFM-UHFFFAOYSA-N 346.478 5.251 30 20 EKED CC1CCN(c2cccc(N[C@@H](C)c3ccc(C#N)c(F)c3)c2)CC1 777697480 SUMIJFWEIGHCLL-INIZCTEOSA-N 337.442 5.107 30 20 EKED C/C(=C/c1ccc(C)cc1)C(=O)Nc1ccccc1SCCC#N 778717429 CQIDUOOQNHEDTL-PEZBUJJGSA-N 336.460 5.043 30 20 EKED C#CCCCCCC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 779996706 VOIFETZJEDYYJJ-UHFFFAOYSA-N 349.927 5.007 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=S)N(C)CC(C)(C)C#N 840750231 PQHNBRXDPNNDNB-UHFFFAOYSA-N 331.529 5.112 30 20 EKED C=C(Cl)CSCC(=O)Nc1c(C(C)C)cccc1C(C)C 853783518 VFVXVGDXBATRGM-UHFFFAOYSA-N 325.905 5.358 30 20 EKED CCC[C@H](C=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1 1776033432 GFBRRHIQWQOAIG-CQSZACIVSA-N 330.815 5.020 30 20 EKED Cc1ccc(-c2cccc(/C=C\C(=O)c3ccc(C(=O)O)s3)c2)cc1 1777429666 DSNKYDYGFUOYDP-YFHOEESVSA-N 348.423 5.318 30 20 EKED N#CCCCOc1cccc(NC(=O)Nc2cccc3ccccc23)c1 56333664 ISVGXJPBCSSZPK-UHFFFAOYSA-N 345.402 5.166 30 20 EKED CC(C)c1noc([C@@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 66903745 NIMWUYXVDUYSMY-CQSZACIVSA-N 348.406 5.030 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1csc(C(C)(C)C)n1 153873084 KGCOPHCBGVCEEW-ZDUSSCGKSA-N 345.537 5.304 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CCC(C)(C)c2ccccc2)n1 155618977 SZNDVWGEEFFQPL-MRXNPFEDSA-N 340.492 5.201 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCCCC(C)(C)C#N 184343535 KKABPXNMTIUKNJ-ZDUSSCGKSA-N 345.487 5.238 30 20 EKED CC[C@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 193341884 LGFCVVPOMBKIBK-RDJZCZTQSA-N 338.476 5.213 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCSC(C)(C)CC1 278771999 OYFAPFCFAPOWCN-UHFFFAOYSA-N 346.540 5.288 30 20 EKED OC1=Nc2cc(N=C(O)C3C4CC5CC(C4)CC3C5)c(F)cc2CC1 329266569 FSQKJUZUMDRXOE-UHFFFAOYSA-N 342.414 5.020 30 20 EKED C=CCC(CC=C)C(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1 467518629 AYRPNBKFNVLTOQ-JOCHJYFZSA-N 331.459 5.081 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1coc2ccccc12 475585485 ROMODBDKGVTJTH-UHFFFAOYSA-N 348.446 5.606 30 20 EKED Cc1ccccc1COc1cccc(NCc2ccccc2C#N)c1 484663935 NRIYWBFYLRPVCD-UHFFFAOYSA-N 328.415 5.058 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)s1 503362879 ACZUHVMMWTUHSL-MOPGFXCFSA-N 346.455 5.078 30 20 EKED CCCc1ccc([C@@H](NCc2ccc(C#N)cc2)c2cccs2)cc1 512835997 WHJHIHWCMYNMKB-JOCHJYFZSA-N 346.499 5.451 30 20 EKED CC(C)(C#N)CCSCc1ccc(C(=O)Nc2ccccc2)cc1 516209631 FYNBGJRMIYKSKB-UHFFFAOYSA-N 338.476 5.112 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(-c2cccs2)o1 538948478 AXSDYIIXEOUNRL-UHFFFAOYSA-N 332.837 5.220 30 20 EKED COc1ccc(-c2ccc(CN[C@@H](C)c3cccc(C#N)c3)s2)cc1 539495974 BRCGNHLYOWLRJF-HNNXBMFYSA-N 348.471 5.146 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 588371701 AFRCGZINXPXEHR-GOSISDBHSA-N 332.875 5.258 30 20 EKED CC[C@@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 609378027 OTGDYZGDFKZROI-NVXWUHKLSA-N 338.476 5.071 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)cc(Cl)c2)cc1 755706005 QEGCPENISZSSQE-NTYUQYKDSA-N 346.213 5.180 30 20 EKED CSc1ccc(C(=O)/C=C/c2nc(Cl)cs2)c(Cl)c1 765614553 XVEUYNBPPVDISQ-SNAWJCMRSA-N 330.261 5.068 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775985743 PLYKIHSHKXDMHA-UWJYYQICSA-N 347.462 5.208 30 20 EKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1cccc2ccccc12 788343145 DIYOUSKOEVMYMY-CMDGGOBGSA-N 333.334 5.211 30 20 EKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 794926757 NXYBIUGKUVVNPL-BAQGIRSFSA-N 337.709 5.082 30 20 EKED C[C@@H](CCC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797568953 YSBGMLSKXFNNTN-GOEBONIOSA-N 340.492 5.201 30 20 EKED CCCC[C@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 810158505 NPPHADVHRMIPKV-UWJYYQICSA-N 349.478 5.384 30 20 EKED CC(C)(C)C(C)(C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 815913481 SQSOWTHESSUGNO-LLVKDONJSA-N 334.872 5.198 30 20 EKED Clc1cccc(C=NOCc2cc(-c3ccccc3)no2)c1Cl 913029508 RIEQXTZOHMXSLQ-UHFFFAOYSA-N 347.201 5.199 30 20 EKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 920790717 KJLLVLXMBTXGTN-BZPMIXESSA-N 346.883 5.342 30 20 EKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Nc1ccc(CCC#N)cc1 932563059 XKIQAAKOPZVEJV-FQEVSTJZSA-N 347.462 5.129 30 20 EKED Cc1cccc2c1[C@H](C)/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1777455843 FTVKNMKQPPPUOO-GFQQVXNGSA-N 348.423 5.291 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc2ccccc12 108238221 NSIWYDHLHYDLID-HNNXBMFYSA-N 346.455 5.344 30 20 EKED COc1cc(Cl)c(CN[C@H](CCC#N)c2ccccc2)cc1Cl 157930610 YBLFYYJYSZHWCQ-QGZVFWFLSA-N 349.261 5.137 30 20 EKED CCOc1ccc([C@H](NCCCCC#N)c2ccccc2Cl)cc1 180429046 ZBADWJWOOCYLIF-FQEVSTJZSA-N 342.870 5.112 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2ccc(OC)cc21 277650368 DQJHDUZMYQNVIX-FQEVSTJZSA-N 349.474 5.216 30 20 EKED CC1(C)CC[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340444162 GQASTBBTQVQZJD-FGZHOGPDSA-N 332.491 5.824 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(C)ccc1OC 340449172 LDOGILNZKIDBQL-NHCUHLMSSA-N 336.479 5.480 30 20 EKED CC(C)O[C@@H](CSCc1ccc(CC#N)cc1)c1ccccc1 427663177 CJJQEVAGTDZKMZ-FQEVSTJZSA-N 325.477 5.152 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccccc1 433025057 GZQIZTRUERFOPG-OAQYLSRUSA-N 346.499 5.940 30 20 EKED CC(C)(C)c1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 439297243 QHNJNPLFMSZNQC-IBGZPJMESA-N 335.451 5.151 30 20 EKED C=CCCC[C@H](C)Sc1nnc(-c2ccco2)n1Cc1ccco1 462417339 MMCHTQIDQPDWPX-AWEZNQCLSA-N 343.452 5.016 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 464435835 HCABVOLKDKDTPP-OAHLLOKOSA-N 333.435 5.079 30 20 EKED C=CC[C@H](CC)NCc1cccc(NC(=O)c2ccccc2Cl)c1 466400525 DITFEOBLPVLGGQ-INIZCTEOSA-N 342.870 5.037 30 20 EKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1Cl 469081991 XQLCSBQWJZLADB-LBPRGKRZSA-N 344.867 5.153 30 20 EKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(C)c(C)s1 473767914 VQMOANLDBKGBDX-UHFFFAOYSA-N 349.521 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C)c(F)c1 475553123 YAACCCASBMVQHZ-UHFFFAOYSA-N 340.442 5.308 30 20 EKED N#Cc1cc(Cl)ccc1CSCc1nc(C(F)(F)F)cs1 478921637 VTIIFFKLXOLZHZ-UHFFFAOYSA-N 348.802 5.120 30 20 EKED N#Cc1ccc(CCC(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 479097311 RYIHJQULXMHJHP-UHFFFAOYSA-N 340.382 5.029 30 20 EKED N#Cc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)cc1F 484054202 DAPJWDZRGQKIJY-HSZRJFAPSA-N 344.433 5.161 30 20 EKED CC(C)Oc1ccc2ccccc2c1CN[C@@H](C)c1ccc(C#N)cc1 546649922 VKHIMHAWYZKJHR-KRWDZBQOSA-N 344.458 5.349 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(SCC(F)F)cc1 554074781 FWEXEVAOYWCHKX-ZDUSSCGKSA-N 326.456 5.024 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(C(F)(F)F)c1 557518205 WHHFBYOIXDZDJS-BFUOFWGJSA-N 344.380 5.305 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccc(C#N)cc1 594011071 VPNNDIKZEPEYBY-QGZVFWFLSA-N 348.490 5.451 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC1CCCCC1 609434606 BZLLXRYHASQUQD-OAHLLOKOSA-N 345.512 5.173 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCC[C@@H](C)C1 609438549 JZFSYVFDIIOTII-OWCLPIDISA-N 345.512 5.029 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1)c1nnc(-c2cccc(Cl)c2)o1 609782700 LBKHRPAUZVZYFE-LLVKDONJSA-N 341.823 5.115 30 20 EKED COc1ccc2cc([C@@H](C)N[C@@H]3CCc4cc(C#N)ccc43)ccc2c1 618801815 BDDGLSVELKVGCQ-IQMFZBJNSA-N 342.442 5.058 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2)o1 618805176 DQRZHXKKKGLQLN-FOIQADDNSA-N 328.415 5.156 30 20 EKED N#Cc1ccc(CN[C@@H]2CCSc3c(Cl)cccc32)cc1Cl 619755050 RMVWXPLJVXYFQR-MRXNPFEDSA-N 349.286 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cnc(C)s1 640049297 PZLHQZKAUXXMAX-CYBMUJFWSA-N 343.496 5.186 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@H]1c1ccccn1 726884915 RVOWKTRANDNYMR-PDANQNNMSA-N 328.500 5.442 30 20 EKED CC(/C=C\C(=O)c1cccc(-c2ccncc2)c1)=C/c1ccccc1 741471179 XCMXHRMGLJPQJF-PWSVSTEKSA-N 325.411 5.591 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](c2ccc(F)cc2)C(C)C)n1 756571975 QSAFDGXVWAFDLA-NVXWUHKLSA-N 344.455 5.022 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2C[C@@H](C(C)C)c3ccccc32)c1 774243386 KJZBLQLPGQALEN-LEOXJPRUSA-N 348.490 5.342 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(N3CCCCC3)cc2)cc1 774276565 BMJSFDNNGYOTNZ-UHFFFAOYSA-N 333.479 5.090 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(Cl)cc1Cl 779712565 JESDPCFHBWQJCT-VXGBXAGGSA-N 335.234 5.457 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1ccc(N2CCCCC2)cc1 782887190 IRVSZVBKRGCYKA-FMIVXFBMSA-N 342.442 5.121 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCC(C)(C)c3ccccc32)c1 795804190 WEJPXOGRNZXDGL-AVRDEDQJSA-N 348.490 5.270 30 20 EKED CC1(C#N)CCC(Nc2cccc(CC[C@@H](O)c3ccccc3)c2)CC1 823543830 KADKZOLWRSLJKQ-GTMAMOSYSA-N 348.490 5.237 30 20 EKED COc1cc(/C=C/C(=O)c2ccc(C)o2)ccc1OCc1ccccc1 16975916 ZKPJYFSIEJKJKS-PKNBQFBNSA-N 348.398 5.072 30 20 EKED O=C(/C=C/c1csc(Br)c1)c1ccc(Cl)s1 48438993 UXHBTZDCLUVMPQ-OWOJBTEDSA-N 333.659 5.122 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C(\Cl)c2nc3ccccc3s2)cc1 171539758 HZNZKYHAOWPDCG-GQVHDAKQSA-N 340.835 5.324 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1OC 189881488 ACXYPCKABQVYDH-UHFFFAOYSA-N 337.463 5.118 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N(CCC#N)CCC(C)C 190001143 LZZIHFVXTGOQTF-UHFFFAOYSA-N 343.515 5.556 30 20 EKED C[C@H](CCNCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 237461020 FBCAEJPYZABJBX-CQSZACIVSA-N 326.406 5.119 30 20 EKED C=CCCc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CC1 410371876 FYEDPEXGZNYFDQ-UHFFFAOYSA-N 325.839 5.129 30 20 EKED CCCCN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@H](CC)c1ccccc1 455271781 JJJBZVUXQPOAMF-YSIASYRMSA-N 341.499 5.032 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(-c2ccco2)cc1F)c1ccccc1 477083780 DPICIMRRJKLGQM-MRXNPFEDSA-N 348.377 5.112 30 20 EKED CCN(C(=O)c1ccc(F)c2ccccc12)[C@H](C)c1ccc(C#N)cc1 483230455 GBWBWVRQOSQJMF-OAHLLOKOSA-N 346.405 5.074 30 20 EKED C=CCN(C(=O)[C@H](C)c1ccccc1)c1nc(-c2ccccc2)cs1 483936506 ZTZWAHYAMWGGAL-MRXNPFEDSA-N 348.471 5.133 30 20 EKED CCN(Cc1cc(Cl)cc2cccnc12)[C@H](C)c1ccc(C#N)cc1 497594481 ZGJJPUPHFAHFID-OAHLLOKOSA-N 349.865 5.343 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2ccc(Cl)cc2)cc1 515431322 BSEYDASANLZDOC-UHFFFAOYSA-N 340.854 5.057 30 20 EKED Cc1cc([C@@H](NCc2ccccc2C(C)(C)C#N)C2CC2)ccc1F 537218624 FELLSPBCVOOENG-NRFANRHFSA-N 336.454 5.176 30 20 EKED C[C@H](Nc1ccc(-c2cn3ccccc3n2)cc1)c1cccc(C#N)c1 540694870 IIIWUWJKJDGEAR-INIZCTEOSA-N 338.414 5.046 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619746879 PUORYSIJGZTGKS-NSHDSACASA-N 338.760 5.081 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1Cl 619754648 GQTOOXWPZHZOGW-JTQLQIEISA-N 339.653 5.369 30 20 EKED O=C(/C=C\c1cc(C(F)(F)F)ccc1F)c1ccc(F)c(F)c1 733206484 LSEUFHCBRRSLSC-KXFIGUGUSA-N 330.227 5.019 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cccc(OC(F)(F)F)c1 740765717 PCRBDOOXXVVASF-CMDGGOBGSA-N 343.304 5.030 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@H](C)C3)n2)cc1 744034358 HCAIYEUDEXNAPY-USXIJHARSA-N 338.476 5.121 30 20 EKED CC(C)(CCC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 754523293 FDTCYGCFDBGHBA-IBGZPJMESA-N 342.442 5.169 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2cccs2)cc1 766117157 LZYGHXRMGOGECQ-HNNXBMFYSA-N 334.444 5.318 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775985742 PLYKIHSHKXDMHA-UTKZUKDTSA-N 347.462 5.208 30 20 EKED O=C(/C=C\c1ccc(SCc2ccccc2)cc1)c1cncs1 787170925 DEGLYRUDOAHAJP-FLIBITNWSA-N 337.469 5.332 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccc(F)cc1 789723224 WXXQEGRONZQZQB-MRXNPFEDSA-N 339.454 5.495 30 20 EKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 805877014 BDTQYLYNSXIMGO-CYBMUJFWSA-N 332.444 5.218 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NC(=O)C1(C#N)CCCC1 57374699 LRRSYVXKCBZSTP-UHFFFAOYSA-N 336.460 5.169 30 20 EKED COc1cc(C(=O)/C=C/c2ccccc2C)ccc1SC(F)F 63874737 VTONJKZEXSJXGP-VQHVLOKHSA-N 334.387 5.214 30 20 EKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)oc2c(C)cccc12 66004925 VWLVCPBDAAPWMF-CQSZACIVSA-N 346.411 5.149 30 20 EKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2)nnc1-c1ccoc1C 72098939 SKROGJLMFMBZTE-ZDUSSCGKSA-N 343.427 5.025 30 20 EKED CC[C@H]1CC[C@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 439119241 QFHKORBDYPHXCR-JYJNAYRXSA-N 330.497 5.236 30 20 EKED Cc1ccc(C)c2c(C)c(C(=O)N[C@H](CCC#N)c3ccccc3)oc12 439659294 SJPLHHMOVXFKKV-GOSISDBHSA-N 346.430 5.133 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H](C)c1ccccc1 476122318 JZBUMYMQDWXRDA-SFHVURJKSA-N 335.491 6.061 30 20 EKED N#C[C@H](C(=O)c1cc2c(s1)CCCCC2)c1nccc2ccccc12 483204101 SMNGWRGMPIFLCJ-KRWDZBQOSA-N 346.455 5.055 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](CC)c1ccc(C)cc1 523115184 YQXYCCVRRYMKCH-NRFANRHFSA-N 348.490 5.189 30 20 EKED Cc1ccsc1[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 538113884 PLNOEZJEALJIAA-MRXNPFEDSA-N 332.472 5.446 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2s1 553294861 STKNXKALFFMABD-AUUYWEPGSA-N 332.472 5.501 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(C)CCCCC1 562021868 FWOYDAHFAIPZKU-OAHLLOKOSA-N 345.512 5.173 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2ccccc2C1 563215991 FGAFASVDJVMHPP-HXUWFJFHSA-N 333.475 5.282 30 20 EKED C[C@@H](SCCCOCCc1ccccc1)c1ccc(C#N)cc1 565506271 WQZRYHFBBZMICN-QGZVFWFLSA-N 325.477 5.002 30 20 EKED C=C(C)CN(CC)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 588726760 MBQTUXKICBHYBV-UHFFFAOYSA-N 342.870 5.115 30 20 EKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1 656688309 JDGHWLRIFGLYQC-SNVBAGLBSA-N 345.302 5.530 30 20 EKED CCOc1ccc(O)c(C=Nc2cccc(C3SCCS3)c2)c1 743333930 HBXZBAWXRGRQGA-UHFFFAOYSA-N 345.489 5.020 30 20 EKED N#C[C@@H](C(=O)CC1CCCCCC1)c1nc(-c2ccccc2)cs1 750686650 IDXGVFYJWKZDRF-KRWDZBQOSA-N 338.476 5.347 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1csc2ccccc12 754739477 RHTJWICITCAANY-OAHLLOKOSA-N 334.488 5.553 30 20 EKED C[C@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1cccc(C#N)c1 766349901 KPGCGVOSRCZCMT-OLZOCXBDSA-N 332.419 5.285 30 20 EKED CC(C)(C#N)c1ccccc1CSC1=Nc2ccccc2CS1 768285753 KRWYPKRZAOGLFX-UHFFFAOYSA-N 338.501 5.655 30 20 EKED Cc1csc([C@H](C#N)C(=O)[C@@H](CC(C)C)c2ccc(Cl)cc2)n1 850736419 JTBVTUHYRUUBLX-JKSUJKDBSA-N 346.883 5.111 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777477287 WPQXXNUFURFXGO-NYYWCZLTSA-N 348.423 5.318 30 20 EKED CCCCCCn1c(SCCC#N)nnc1-c1ccc(Cl)cc1 60382876 VKMWVOALSOKXNP-UHFFFAOYSA-N 348.903 5.185 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(C(F)F)c1 279989161 GKLGYPGWKMRZFI-ZDUSSCGKSA-N 332.419 5.488 30 20 EKED N#CCCCOc1cccc(N[C@@H](c2ccc(Cl)cc2)C2CC2)c1 324414396 WSLGIHPKUAIRTO-HXUWFJFHSA-N 340.854 5.586 30 20 EKED C[C@H]1Cc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@H](C)C1 411011344 LVKIACKQRZZBIM-GHMZBOCLSA-N 340.448 5.028 30 20 EKED CC(C)[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 431767873 BLJHKTOGJLBGFJ-LEWJYISDSA-N 349.478 5.118 30 20 EKED CC[C@H](c1ccccc1)c1nnc(SCCCCC(C)(C)C#N)o1 436204965 CDFDAFRWGMQNDU-MRXNPFEDSA-N 343.496 5.424 30 20 EKED N#CCC[C@H](Nc1ncnc2sc3ccccc3c12)c1ccccc1 440642900 RDGWACAQZFJAPW-INIZCTEOSA-N 344.443 5.301 30 20 EKED CCCCC[C@@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 494269364 XOJARQMOHQQPAW-GOSISDBHSA-N 327.472 5.064 30 20 EKED CC(C)(NCc1cc(C#N)ccc1F)c1ccc(Cl)c(Cl)c1 507351329 WDBRLTNCDZGFSD-UHFFFAOYSA-N 337.225 5.029 30 20 EKED Cc1cc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)sc1Br 512106621 OTTOTKQFCXTOOU-NWDGAFQWSA-N 349.297 5.103 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1F 512630888 ORXHWCHAEHPHKT-IVZQSRNASA-N 348.396 5.277 30 20 EKED CC(C)c1cccc(-c2ccc(C(=O)Nc3sccc3C#N)o2)c1 538449287 SKWHFNWYRNQVGH-UHFFFAOYSA-N 336.416 5.255 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1cc2cc(Br)ccc2o1 554363282 IGMARYYASCMCDH-GFCCVEGCSA-N 349.272 5.176 30 20 EKED COc1ccc([C@H]2C[C@@H]2[C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559860434 UNYQNVWYZZCWCZ-ULLYJBBUSA-N 348.490 5.212 30 20 EKED CC(C)(CCC#N)CN[C@H](c1ccccc1)c1ccc(Cl)cc1 567637596 BHXXPQNICBTGEX-LJQANCHMSA-N 326.871 5.349 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1cc(C#N)ccc1F 579288758 MHADYAQIVORKBX-UHFFFAOYSA-N 326.415 5.015 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 580101749 HHNMIBCCOXGUED-JPYJTQIMSA-N 328.459 5.926 30 20 EKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1oc2ccccc2c1C 606922540 VZERFQOKXREANZ-INIZCTEOSA-N 328.456 5.190 30 20 EKED C[C@H](Sc1ccc(Cl)cc1C#N)c1nc(-c2cccs2)no1 610655195 UFIUXSNEJNKMJF-VIFPVBQESA-N 347.852 5.176 30 20 EKED C=CCOc1ccc(CN[C@@H](CC(C)C)c2ccccc2)cc1OC 620439878 VURCVYABGOTVAS-FQEVSTJZSA-N 339.479 5.137 30 20 EKED Brc1ccccc1C=NNc1cccc2ccccc12 725422538 GWNFQKRLKUBZQP-UHFFFAOYSA-N 325.209 5.048 30 20 EKED Cc1cccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1C 734305227 MTPCGGRGTYPLRQ-SREVYHEPSA-N 325.458 5.385 30 20 EKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccsc1 737501381 AWRBELHFLJGPHX-MGPUTAFESA-N 346.455 5.146 30 20 EKED CC(=NNc1cccc2ncccc12)c1cccc(-c2ccncc2)c1 741460634 RAYXWCAUTOEFBR-UHFFFAOYSA-N 338.414 5.133 30 20 EKED CSc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1 741473190 NWTVWPYMDIOZHI-JXMROGBWSA-N 331.440 5.367 30 20 EKED COCc1ccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)cc1 741843111 YJLOHZCFFMZNAB-SEYXRHQNSA-N 349.455 5.161 30 20 EKED COc1ccc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cc1F 747151284 GGEZHLZSPQDBHR-DJWKRKHSSA-N 330.742 5.130 30 20 EKED O=C1/C(=C\c2cnc(-c3cccs3)s2)CCc2sccc21 751514152 PWWYRGZGDRFSDM-NTMALXAHSA-N 329.471 5.146 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1 753141078 GEOURJXNEADINZ-BQYQJAHWSA-N 334.444 5.225 30 20 EKED C=C(C)[C@H](NC(=S)Nc1ccc(C)cc1C)c1ccc(F)c(F)c1 774206918 PRGDZMRZUMAXPP-SFHVURJKSA-N 346.446 5.185 30 20 EKED COc1cc(N[C@H](C)c2ccc(C#N)c(F)c2)cc(OC)c1C(C)C 779184089 LEJSUBYVTJBKKH-CYBMUJFWSA-N 342.414 5.011 30 20 EKED Clc1ccc(-c2ncc(C=NOCc3ccccc3)s2)cc1 788975479 NRYQATWMJVHWSD-UHFFFAOYSA-N 328.824 5.014 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C/c2nc(Cl)cs2)cc1Cl 789156889 GDCHPNMLFYIZEO-GQCTYLIASA-N 342.247 5.133 30 20 EKED CCCCCCCC[S@@](=O)Cc1csc(-c2ccsc2)n1 790140632 VLVDIKZBEBEXFI-OAQYLSRUSA-N 341.567 5.481 30 20 EKED C=CC[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccncc1 808697120 WIXIIPVHKNJLCT-CTNGQTDRSA-N 331.463 5.156 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(C)C)cc1C 48121139 QAWWUAGXYOQZKB-UHFFFAOYSA-N 344.480 5.064 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 90665777 YWCDHEWNWSRGMW-PBHICJAKSA-N 341.524 5.445 30 20 EKED Cc1ccc2c(c1)OCCC[C@H]2Nc1cccc(OCCCC#N)c1 179825180 CKVMGOYJEDCJJK-HXUWFJFHSA-N 336.435 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 191432299 RGTLHWMQMYINIW-VGOFRKELSA-N 348.490 5.763 30 20 EKED C[C@H](/N=C(/O)C1CCCCC1)/C(O)=N/CC1CC(c2ccccc2)C1 328695650 KNJQJFNLERVEDS-LYGPFTKASA-N 342.483 5.062 30 20 EKED CC(C)(C/N=C(/O)[C@H]1CC12CCCC2)C/N=C(/O)[C@@H]1CC12CCCC2 329988667 HJTXPMXTPSJQNU-IYBDPMFKSA-N 346.515 5.086 30 20 EKED N#CCCCOc1cccc(CN[C@H](CC2CCC2)c2ccccc2)c1 350292827 ZRMGWUREVCKXLS-HSZRJFAPSA-N 348.490 5.390 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1 352179854 CTWLCQDMGCZSAU-WIYYLYMNSA-N 334.463 5.040 30 20 EKED N#CCCC[C@@H](NCc1cccc(OC(F)(F)F)c1)c1ccccc1 353911821 DAGGZDXTZLCQAM-GOSISDBHSA-N 348.368 5.110 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)C1CCC(C(F)(F)F)CC1 354559899 CEQBXFSABDCECI-OBHHBEAMSA-N 338.417 5.378 30 20 EKED N#Cc1ccc(CN(Cc2ccco2)Cc2cccs2)c(Cl)c1 439435554 DORNNEXBTFIJBE-UHFFFAOYSA-N 342.851 5.069 30 20 EKED CC[C@@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1 447533644 YBRCSWNDKKAGGQ-MSOLQXFVSA-N 332.369 5.293 30 20 EKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nc(-c2ccccc2)no1 465386713 CAFHIDKWAHKIPY-NSHDSACASA-N 341.823 5.115 30 20 EKED COCC[C@@H]1CCC[C@H]1N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 502413094 HRCDZGRASARRFI-JWNTYJGQSA-N 348.490 5.081 30 20 EKED CC[C@H](C)n1c(SCc2ccccc2C#N)nnc1-c1ccccc1 504307340 PLTGZLVUKUJGAI-HNNXBMFYSA-N 348.475 5.080 30 20 EKED CC(C)[C@@H](CNC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 505195316 GHUUKHREEKGDBS-HXUWFJFHSA-N 349.478 5.049 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc2cc(OC)ccc2c1 532466516 VJNVLKMMVDXXJF-MWTRTKDXSA-N 344.458 5.522 30 20 EKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1cccc(F)c1F 539061858 PZTOJEICKVRZQX-FPPRHVDESA-N 340.417 5.020 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCSc4ccc(Cl)cc43)CC2)c1 551806375 MUMSKYVKMJHSBY-KRWDZBQOSA-N 340.879 5.027 30 20 EKED N#CCCCCCC(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 588753246 DZHINGJVLOZOTM-UHFFFAOYSA-N 328.362 5.044 30 20 EKED CCc1nc(C)c([C@@H](C)N(C)Cc2ccc(C(C)(C)C#N)cc2)s1 614168753 SRLDQTJUSWIQKZ-OAHLLOKOSA-N 341.524 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1OCc2ccccc21 653760291 PVWYEAALTBXRKO-HXUWFJFHSA-N 335.447 5.139 30 20 EKED O=C(/C=C/c1c(OC(F)F)ccc2ccccc12)c1ccsc1 749101706 HUOGIIKARSHDMB-VOTSOKGWSA-N 330.355 5.399 30 20 EKED O=C1/C(=C/c2nc(Cl)cs2)CCSc2ccc(Cl)cc21 759082015 BBDNXLRCZCCJCY-VMPITWQZSA-N 342.272 5.212 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc2cc(Cl)ccc2o1)c1ccncc1 776158482 UGLCCMPPOJTRGK-GUYCJALGSA-N 326.827 5.449 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1c[nH]c2cc(Cl)ccc12 782331248 VAFGZGWYJHUEDP-QHHAFSJGSA-N 332.790 5.266 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ncccc1Cl 853294244 IWLDWSMNMKRJHY-UHFFFAOYSA-N 347.690 5.188 30 20 EKED C[C@H](NCCCCC#N)c1cc(F)ccc1Oc1cncc(Cl)c1 902790420 NWUISMBVLDYKRU-ZDUSSCGKSA-N 347.821 5.011 30 20 EKED CCCCCCCOc1cccc(CN[C@H](CCC(C)C)C(=O)O)c1 1776787467 WBNWWXGLJNFSBH-HXUWFJFHSA-N 349.515 5.015 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 117456756 ZVSVJTGNHJPHTI-JKSUJKDBSA-N 345.512 5.125 30 20 EKED C[C@@H](Nc1ccc2nc(C3CC3)sc2c1)c1ccc(OCC#N)cc1 182975263 GBGTVTANQLFFSR-CYBMUJFWSA-N 349.459 5.249 30 20 EKED CCCc1ccc([C@@H](NCc2ccc(C#N)o2)c2cccs2)cc1 236964844 BTPWETOURCQYOM-HXUWFJFHSA-N 336.460 5.044 30 20 EKED Cc1noc(C)c1C(C)(C)/C(O)=N/C1CCC2(CCCCC2)CC1 330285123 YKISSJAXRVNHHJ-UHFFFAOYSA-N 332.488 5.419 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340448769 KLMUODIKDVBPEV-WOJBJXKFSA-N 328.406 5.441 30 20 EKED N#CCCC[C@@H](NCc1sccc1Br)c1ccccc1 353912189 DVPUJOPXOKHWDP-OAHLLOKOSA-N 349.297 5.035 30 20 EKED CC(C)(C#N)CCC[S@](=O)Cc1ccc(Cl)c2ccccc12 421816447 XQFUDBXETYHVBA-QFIPXVFZSA-N 333.884 5.072 30 20 EKED CCN(C(=O)c1sc2ccc(C#N)cc2c1C)c1ccccc1C 431832677 HDRVEXXHTKAHQD-UHFFFAOYSA-N 334.444 5.057 30 20 EKED N#CCCCC(=O)N(Cc1ccc(Cl)cc1)c1ccccc1Cl 463459032 RMYBQOXHPZCXOB-UHFFFAOYSA-N 347.245 5.220 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 466569325 DHORDVFOIQJVKA-UHFFFAOYSA-N 328.843 5.355 30 20 EKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 467611050 QKWJYKUIBZVQGY-YJBOKZPZSA-N 349.434 5.003 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474888148 NTDTXMMUZOYASX-LLLHUVSDSA-N 344.911 5.528 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccccc1OC1CCC1 481649390 DWBVJISKDNTUHS-JOCHJYFZSA-N 346.474 5.047 30 20 EKED CCc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1CC 487607685 RJZXWNKPGJBSCU-UHFFFAOYSA-N 349.478 5.126 30 20 EKED C=CCCO[C@H](C)c1nc(-c2cccc(Oc3ccccc3)c2)no1 504597994 ORZYNTYAZYOSSK-OAHLLOKOSA-N 336.391 5.183 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1sc(C)nc1C 505011623 YAOSHQGVQCJSEW-CQSZACIVSA-N 343.496 5.103 30 20 EKED C=CCC(CC=C)C(=O)N(C(CC)CC)[C@H]1CCCc2cccnc21 511305373 ZKTMBCQLSZHPMI-FQEVSTJZSA-N 340.511 5.245 30 20 EKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)CCCCCC#N 588327681 KDRBORMOWNOAHP-IBGZPJMESA-N 334.463 5.250 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Cl)cc1 603969353 NGUXSMTWEHFCMQ-UHFFFAOYSA-N 338.819 5.192 30 20 EKED Cc1oc(-c2ccsc2)nc1CS[C@@H](C)c1ccc(C#N)cc1 609825828 WAZNBORIPRERAM-ZDUSSCGKSA-N 340.473 5.578 30 20 EKED C[C@H]1CCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 729143790 RKSGLSXSTNSEBG-NSHDSACASA-N 340.427 5.085 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cc(Cl)ccc1O)c1ccc(F)c(F)c1 775557792 KLMFEQZBHKEKPW-VOJFVSQTSA-N 337.797 5.292 30 20 EKED C#CCC1(C(=O)Nc2ccccc2CCC(F)(F)F)CCCCC1 788451345 ZUHAGOOTZBWENA-UHFFFAOYSA-N 337.385 5.094 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccsc2)cc1 790302172 HXXNTXFIEZOJBB-GOSISDBHSA-N 349.484 5.212 30 20 EKED C=CC[C@@H](OC(=O)c1coc(CC)n1)c1ccc(Cl)c(Cl)c1 797553401 HTTDZYKOMLHJKJ-CQSZACIVSA-N 340.206 5.018 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc(C)c(NC(C)=O)c1C 822926790 QOSJKDURDLXCKJ-INIZCTEOSA-N 346.515 5.587 30 20 EKED N#Cc1c(F)cccc1CNc1ccccc1SCc1ccccc1 864000968 KPNBCKJDDIETDO-UHFFFAOYSA-N 348.446 5.602 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccsc2)cc1 915179211 BFCDFGNJVOBRBE-HSSRVXSRSA-N 344.439 5.055 30 20 EKED N#CC1(c2ccccc2)CCC(=NNc2ccc3ccccc3n2)CC1 916594633 HAKUODQTBPXWBF-UHFFFAOYSA-N 340.430 5.038 30 20 EKED CCCC[C@@H](CC)CNC(=S)N(CC)[C@H](C)c1ccc(C#N)cc1 920993238 ALMRYYGFCWTKGY-IAGOWNOFSA-N 345.556 5.032 30 20 EKED C=CCCC(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 72080190 JKUNJRBEPNPKTR-UHFFFAOYSA-N 327.236 5.022 30 20 EKED CCCOCc1ccccc1CNc1ccc(C#N)cc1C(F)(F)F 78838009 ZOVQWOISEDPRSJ-UHFFFAOYSA-N 348.368 5.116 30 20 EKED CCC(CC)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccs1 236703720 DPELSCDOUJZQRR-QRWLVFNGSA-N 342.508 5.306 30 20 EKED C[C@@H]1CCC[C@@H](N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246249670 LGIWSUXQDMOQDS-BZUAXINKSA-N 345.512 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCC[C@H](OC)C1 282033332 YAUTVGPMZZIXOX-WMZOPIPTSA-N 329.484 5.072 30 20 EKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329223398 XZMODXHIVRZFQS-ZNFSNMQZSA-N 334.504 5.083 30 20 EKED Cc1cc(O)nc2cc(/C(O)=N/[C@@H]3CCCCC34CCCC4)ccc12 329615857 LEAJILNOELPIPT-GOSISDBHSA-N 338.451 5.056 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1F 447568240 IHSOTMYCCZNDKK-GHMZBOCLSA-N 337.225 5.416 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 449447161 WMYIWDNVNKUQKI-RUGDWHBFSA-N 336.401 5.013 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cc(Cl)ccc1F 469254662 WOTDJGOWRMOYKM-GFCCVEGCSA-N 334.847 5.343 30 20 EKED C=C(C)[C@H](NCc1cc2cc(OC)ccc2o1)c1ccc(F)c(F)c1 479405225 FWNPALQWTWCDGE-FQEVSTJZSA-N 343.373 5.127 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1c(C)cccc1C(C)C 484944954 IHNUBODVBIKOKP-UHFFFAOYSA-N 328.500 5.719 30 20 EKED Cc1c([C@H](C)NCc2ccccc2C(C)(C)C#N)oc2ccccc12 485000823 YAFSQJKWZZPSFO-INIZCTEOSA-N 332.447 5.393 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](OC)c1ccc(F)cc1 529137678 RPBPUPSTGIJRQX-FQEVSTJZSA-N 341.426 5.004 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 540149471 PNVCWXVCIJXNKT-KXBFYZLASA-N 348.412 5.767 30 20 EKED Cc1ccccc1C(NCc1ccc(CC#N)cc1)c1ccccc1C 545473301 GLUCHHMFQOKZOU-UHFFFAOYSA-N 340.470 5.249 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccsc3Cl)cc2)ccn1 570889419 PHGYQBOAMBDJOC-UHFFFAOYSA-N 341.823 5.073 30 20 EKED N#Cc1ccc2c(c1)[C@@H](NC(c1cccs1)c1cccs1)CC2 584201667 FNIIZRUQPSSNNV-INIZCTEOSA-N 336.485 5.048 30 20 EKED N#C[C@H](Cc1ccccc1)Sc1ncc(-c2ccc(Cl)cc2)o1 590690442 HPDWFVQEXKRYSW-INIZCTEOSA-N 340.835 5.222 30 20 EKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)CCCCC#N)c1 594057241 BOHPRQDWYXFCNP-UHFFFAOYSA-N 340.398 5.257 30 20 EKED Cc1cc(C(F)F)oc1C(=O)Nc1scc(C(C)(C)C)c1C#N 602350738 RGWFQKWPTAWQHU-UHFFFAOYSA-N 338.379 5.009 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C1C[C@@H]2CC[C@H](C1)S2 890165926 ROJVYCMMYKVZAD-ALOPSCKCSA-N 329.509 5.151 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 915086985 OLTXIIIKGAAQIF-QFIPXVFZSA-N 340.426 5.211 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc1O 916141847 WDJKPBBQFWDARO-QPEQYQDCSA-N 346.382 5.089 30 20 EKED C=CCN(C(=O)Nc1ccccc1Oc1ccccc1Cl)C(C)C 916706475 FTASNEWJIPVLEV-UHFFFAOYSA-N 344.842 5.561 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776700117 ZOWULIDSTHZSCA-RBJHHQRMSA-N 347.414 5.276 30 20 EKED CCCCCCC[C@H](C)CN=c1c(C(=O)O)c[nH]c2c(C)cccc12 1776782435 ZSFVHVOTQNEQCC-HNNXBMFYSA-N 342.483 5.072 30 20 EKED CCc1sc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 66800866 DSCAHXMILDMMGV-ZDUSSCGKSA-N 344.505 5.266 30 20 EKED CCCCCCCC(=O)Nc1c(C)cccc1-c1nc(C(C)C)no1 110638691 GOIFEKVRFGKWTF-UHFFFAOYSA-N 343.471 5.467 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1Cl)c1ccc(C#N)cc1 118445698 KTXQHMLWVQTYGD-QWHCGFSZSA-N 344.867 5.033 30 20 EKED C[C@@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Cl 190892410 FQQVTSXWCFBWHX-CHWSQXEVSA-N 344.867 5.033 30 20 EKED C[C@H](NCc1ccc(-c2ccc(F)cc2)s1)c1cccc(C#N)c1 237566973 KYDPMGAHFNYVAU-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)c1oc([C@@H]2CCCN2CCCCC#N)nc1-c1ccccc1 267336553 BCPAFXSJUOZKQT-SFHVURJKSA-N 337.467 5.296 30 20 EKED C/N=C(/O)c1ccc(C)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329006947 NEKQCQZFVVAQTG-BHYGNILZSA-N 328.456 5.124 30 20 EKED C=CCC(CC=C)C(=O)N(Cc1ccccn1)c1ccc(Cl)cc1 468675468 PBHQBSQLFHDREA-UHFFFAOYSA-N 340.854 5.037 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)C[C@@H](CC#N)c1ccccc1 476975607 SOCFQTHRDLPGAY-HXUWFJFHSA-N 348.490 5.789 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(COC(C)(C)CC)c1C 488907424 FLHHAPZOVQZJKM-SFHVURJKSA-N 344.499 5.273 30 20 EKED CC(C)(CCC#N)CN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 510426862 DANINBABHGPWDU-UHFFFAOYSA-N 349.453 5.030 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 512277682 CHNIPJSFYPHBFW-QWRGUYRKSA-N 337.225 5.416 30 20 EKED C[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)cc1 539692478 VBCYYXGNVTXEPY-LBPRGKRZSA-N 331.246 5.205 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cccc(F)c1F 588386928 QLDZJOKWAQCNLI-SREVYHEPSA-N 333.384 5.046 30 20 EKED C=CCCCN(C)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 605645031 PMAXWXQJRQKVQW-UHFFFAOYSA-N 349.430 5.050 30 20 EKED O=C(/C=C/c1ccc(OC(F)F)c(Cl)c1)c1ccc(F)c(F)c1 731489957 OSCZZOHFMRBJEX-ORCRQEGFSA-N 344.691 5.116 30 20 EKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 735396844 BFKIKJTXSMXZFR-JSGCOSHPSA-N 332.444 5.218 30 20 EKED COc1cccc2cc(/C=C3\C(=O)c4ccsc4S[C@H]3C)oc12 742437520 VFJSPOLOTGCPRZ-ADVUTCEVSA-N 342.441 5.263 30 20 EKED CC(C)C(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784491668 GQUXXYCQZFRDGS-CQSZACIVSA-N 346.883 5.322 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(C(F)F)cc1)c1ccccc1 933102172 XNXVJTDGYWNHGW-QGZVFWFLSA-N 343.377 5.181 30 20 EKED Cc1cc(C)c(CNc2ccccc2Oc2ncccc2C#N)c(C)c1 64948832 KBDWRCMPJWDTQI-UHFFFAOYSA-N 343.430 5.283 30 20 EKED C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1cccs1 78080763 CSMYFAFUGODJEG-LBPRGKRZSA-N 338.457 5.090 30 20 EKED CCOc1cc(/C=C\C(=O)c2ccc(C)s2)cc(Cl)c1OC 206429249 AWPMEIPCOURCEH-SREVYHEPSA-N 336.840 5.013 30 20 EKED CC(O)=Nc1ccc(C)cc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329086535 UVCRVUSKSJORDY-YESZJQIVSA-N 328.456 5.797 30 20 EKED CC(O)=Nc1ccc(C/C(O)=N/C[C@@H]2C[C@H]2C2CCCCC2)cc1 329322713 JPGLSZKNNVHLFJ-HKUYNNGSSA-N 328.456 5.010 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cccc3ccccc23)s1 430621813 KHJDCRAELASKJZ-INIZCTEOSA-N 334.444 5.084 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1ccccc1 431689431 BMJAAONDMQOLQM-KRWDZBQOSA-N 345.805 5.036 30 20 EKED CC[C@H](Nc1ccc(NC(=O)CC(C)C)cc1)c1ccc(C#N)cc1 447578501 FVWCCPZNZGJDNI-FQEVSTJZSA-N 335.451 5.106 30 20 EKED C=CCN(C(=O)CC(C)(C)CC)c1nc(-c2ccccc2)cs1 467105130 ZEXIZDWZICJZJV-UHFFFAOYSA-N 328.481 5.155 30 20 EKED C=CCCC1(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)CC1 475471360 MJKPEHFTESLNOP-KRWDZBQOSA-N 334.463 5.545 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 486667982 XCSJJSKCKIBUFZ-KRWDZBQOSA-N 347.418 5.067 30 20 EKED C=CCn1cccc1C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 489052520 OSDCJLFHGBZNEV-KRWDZBQOSA-N 345.446 5.100 30 20 EKED C=CCCc1ccccc1NC(=O)NCc1cc(C(CC)CC)no1 505004534 DUPBIKNFMGVJDY-UHFFFAOYSA-N 341.455 5.019 30 20 EKED C=CCC[C@@H](CCC)Nc1ccc(NC(=O)CC(F)(F)F)cc1 510935809 UEUOIMGKXIOHAC-CYBMUJFWSA-N 328.378 5.124 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2cc(C)ccc2C)c1 523423404 YGSJEFYJSXEVLD-QGZVFWFLSA-N 338.451 5.093 30 20 EKED N#Cc1cc(NCc2csc(-c3ccsc3)n2)ccc1Cl 530410983 ZHGXFJRRQZLYAX-UHFFFAOYSA-N 331.853 5.009 30 20 EKED C=CCC[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)C1CC1 537448257 OCZRUEVXKNIMGS-HXUWFJFHSA-N 341.499 5.251 30 20 EKED CC(C)COc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 540148535 SASNIUDWLLJKDW-GCJKJVERSA-N 336.479 5.417 30 20 EKED Cc1cc(Cl)ccc1Oc1ccc(CN2CCC(C#N)CC2)cc1 561715950 IDOOKUXURFGONN-UHFFFAOYSA-N 340.854 5.176 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)CCCCC#N)cc1 593989909 YKWLLDQWJYXDBZ-INIZCTEOSA-N 338.476 5.562 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(Sc2ccccc2)c1 594911792 GJPRHAPGGLZFRV-UHFFFAOYSA-N 326.465 5.268 30 20 EKED COc1ccc2cc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)ccc2c1 610343453 HOJHMPGVYRJPIM-HZPDHXFCSA-N 330.431 5.132 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@]12CCCC[C@H]1C2(F)F 613902280 ZATIJLYCPOSKOT-XLIONFOSSA-N 347.449 5.693 30 20 EKED N#Cc1csc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1 754689795 MWRWIRGFZBKWHM-RQOWECAXSA-N 341.741 5.188 30 20 EKED FC(F)(F)c1ccccc1ON=CCCCCOc1ccccc1 754709912 PFBSOIFEOPYQNR-UHFFFAOYSA-N 337.341 5.319 30 20 EKED Cc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)cnc1Cl 760265021 UFMCSVHFZCSNSX-IHWYPQMZSA-N 332.639 5.308 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3cc(SC(F)F)ccc32)cc1 775378657 NEJIWHZUPAXATN-SFHVURJKSA-N 344.430 5.040 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)c1ccc(C)cc1 789721394 RSQNBKWQKVIMCP-UHFFFAOYSA-N 343.417 5.577 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)c2nccc3ccccc23)cc1C 792092497 CAGNIMHUPVBVQP-SHBDEGQCSA-N 340.426 5.050 30 20 EKED CC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccc1OC 795782676 OIIVGQDIEAJJNY-NHCUHLMSSA-N 334.463 5.075 30 20 EKED COc1cccc2cc(/C=C/C(=O)c3c(F)cccc3Cl)oc12 809158790 DHYUIIIIFIURLZ-CMDGGOBGSA-N 330.742 5.130 30 20 EKED CCCC[C@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 810158503 NPPHADVHRMIPKV-LAUBAEHRSA-N 349.478 5.384 30 20 EKED CC1(C)CC[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762980 SCDZCESEWDZHHR-KGLIPLIRSA-N 344.867 5.076 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 917043021 FYNRQERHWYVPMX-VURMDHGXSA-N 339.372 5.121 30 20 EKED Cc1ccccc1[C@@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 932392993 SSKCRCLJNNIOMF-JKSUJKDBSA-N 338.476 5.132 30 20 EKED CCCCCCCOc1ccc(CNCCCCCCC(=O)O)cc1 1776787017 KNICVALADNWNFK-UHFFFAOYSA-N 349.515 5.161 30 20 EKED O=C(/C=C/c1cccc(O)c1)c1ccc(Cl)c(Cl)c1Cl 7745069 FALLFSXVTMEEOL-QPJJXVBHSA-N 327.594 5.249 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3cccc(C#N)c3)s2)cc1 107718479 UDCVVOCQEUIBLI-OAHLLOKOSA-N 347.487 5.149 30 20 EKED C[C@@H](CCC(=O)Nc1ccccc1SCCC#N)c1ccccc1 120012679 VEPQSCQOPXBOLE-INIZCTEOSA-N 338.476 5.215 30 20 EKED CCCCCCCCC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 139387705 FRXYHZNLXSWJKR-UHFFFAOYSA-N 341.499 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C[C@@H]1C 191445890 XMQMPBJKJZXTRV-KRWDZBQOSA-N 348.490 5.517 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(Cl)c1 192970285 ZPELXWNRSVJFGI-LIRRHRJNSA-N 328.843 5.044 30 20 EKED N#C[C@H](C(=O)CC1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 247703794 BYHHXOQFWYSFOA-OAHLLOKOSA-N 344.867 5.220 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(C(C)=O)c1 349561929 JLDVYRDXEFYYQI-UHFFFAOYSA-N 327.449 5.055 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 376867059 QBPGBDBMHDDGDX-SJORKVTESA-N 327.431 5.032 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccoc3C3CC3)cc2)cc1 409579249 YMCJZDFWAXZKQT-UHFFFAOYSA-N 344.370 5.073 30 20 EKED C[C@H]1C[C@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccsc2S1 417375069 YZLJTHUGSVFIOQ-IGNZVWTISA-N 340.517 5.212 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)CS[C@@H](C)c1cccc(C#N)c1 443126842 AITSGTGSNQXFCT-AWEZNQCLSA-N 334.444 5.025 30 20 EKED C=CCN(CC=C)C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 467948482 KAKHPINRQGDDCP-UHFFFAOYSA-N 345.801 5.086 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 514681981 CRUDNJNGIVDCHL-AOMKIAJQSA-N 332.422 5.675 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(OC)c1)c1ccccc1 537950070 HKNSNMINBHSMON-VQIMIIECSA-N 325.452 5.062 30 20 EKED CCc1c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)oc2ccccc12 539506989 IRFSLSLUAODJSL-UZLBHIALSA-N 332.447 5.691 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2cccc(C(F)F)c2)CC1 539935456 KBZACLCNTOZRPF-UHFFFAOYSA-N 326.390 5.440 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1 540146810 MOKCEECWFOCUIW-PXNSSMCTSA-N 339.479 5.370 30 20 EKED C=C(C)[C@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccc(F)c(F)c1 575158126 WPUROFXWUJFFAF-PXNSSMCTSA-N 347.380 5.007 30 20 EKED N#Cc1ccccc1SCc1cc(-c2ccc(Cl)cc2)no1 610207655 IDRYZXUZIOUJEV-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CSc1ccc(C(=O)/C=C\c2cccc(OC(F)F)c2)cc1F 741847613 QUHLDBORBCBHMD-ALCCZGGFSA-N 338.350 5.045 30 20 EKED C=CCN(C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1)C(C)C 743220378 NDOZPIHGHMEDAY-UHFFFAOYSA-N 331.485 5.022 30 20 EKED CCCC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCC1 759541356 YBYIOSTUWFAYRH-LBPRGKRZSA-N 332.856 5.096 30 20 EKED CC(C)CCOc1ccc(CNc2ccccc2O[C@@H](C)C#N)cc1 779990950 CFTKBUTXYGOBCJ-KRWDZBQOSA-N 338.451 5.014 30 20 EKED C=CCCC[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccccc1 883209096 VOSFELLKQWTHFP-CODAWKSHSA-N 341.520 5.172 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)SCC3CCC(C#N)CC3)o2)cc1 902565919 MXQBFIFDFNYIQP-QQFBHYJXSA-N 341.480 5.169 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)c1ccc2ccccc2c1 915918015 XXXDEFOGEXCBJJ-UHFFFAOYSA-N 329.325 5.090 30 20 EKED CCCCCCCCC(=O)N(CC(F)(F)F)c1nc(C)cs1 920007276 JBAGIUBUCGTCKP-UHFFFAOYSA-N 336.423 5.097 30 20 EKED Cc1cc(C)c(C(=O)O)cc1/C=C/C(=O)c1ccc(C(C)(C)C)cc1 1776119664 IFUWZYBPXXNUDO-DHZHZOJOSA-N 336.431 5.195 30 20 EKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)C(C)(C)CC)cc1 1776787894 CZLLXSWUOOGOGM-LJQANCHMSA-N 349.515 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)o1 189885942 RFWINBNYXKJKEE-UHFFFAOYSA-N 348.240 5.146 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1cccs1 191513972 SJQNBKPITPBMGK-OAHLLOKOSA-N 342.508 5.825 30 20 EKED CC(=NNc1nncc2ccccc12)c1ccc(-c2ccccc2)cc1 254483386 BADVJZJJVGEWPH-UHFFFAOYSA-N 338.414 5.133 30 20 EKED Cc1cccc(C)c1Oc1ccccc1NC(=O)c1sccc1C#N 303039987 PSCALYOSLDKVBX-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1C 328979272 CTYHNHLKOMUBBI-YESZJQIVSA-N 328.456 5.797 30 20 EKED N#CCCC[C@H](NC(=O)c1cccc(Cl)c1Cl)c1ccccc1 352168002 UBZZHCWVHBKSKU-INIZCTEOSA-N 347.245 5.158 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(SCCCCC(C)(C)C#N)o1 436204964 CDFDAFRWGMQNDU-INIZCTEOSA-N 343.496 5.424 30 20 EKED Cc1cc(Cl)c(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 443948782 WEYCWXKROKYPCX-NSHDSACASA-N 348.233 5.056 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 470196270 XYRSERFTIVVHQC-YOEHRIQHSA-N 339.401 5.361 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1cccc(C)c1C)c1ccc(F)c(F)c1 479767593 JUEVJTXGYFNGDU-GOSISDBHSA-N 330.378 5.021 30 20 EKED COc1cc(Cl)ccc1CNc1ccccc1SC[C@H](C)C#N 480144939 PRFYKAIQCKZFLF-CYBMUJFWSA-N 346.883 5.212 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1 532466049 KWBMDCKZUVRDHF-JKSUJKDBSA-N 332.472 5.699 30 20 EKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1cccc(F)c1F 539061873 PZTOJEICKVRZQX-NNDYNSRJSA-N 340.417 5.020 30 20 EKED C=CCC[C@H](NCc1nc(-c2cccs2)oc1C)c1ccccc1 539360809 TZNCCRHPFWCDLM-KRWDZBQOSA-N 338.476 5.509 30 20 EKED Cc1cccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1Cl 572439530 ZHUOTQATKGJOOS-INIZCTEOSA-N 341.842 5.205 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2ccccc2)s1 574349938 HWXSXOPMHFUQDD-INIZCTEOSA-N 344.483 5.627 30 20 EKED C[C@H](S[C@H](C)c1nc(-c2cccs2)no1)c1ccc(C#N)cc1 609825204 LEAMLZAJPMYWBB-NWDGAFQWSA-N 341.461 5.225 30 20 EKED CC[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 734079316 NYTSAGRFSMQPCB-IEBWSBKVSA-N 334.463 5.408 30 20 EKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 741110486 DLXLWYYBMAJJMX-IAGOWNOFSA-N 348.471 5.302 30 20 EKED O=C1/C(=C/c2nc(Cl)cs2)CCc2c1sc1ccccc21 759084853 YMDSYFPLJUGZRN-VQHVLOKHSA-N 331.849 5.224 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(N2CCCCCC2)cc1)c1ccncc1 766022879 YKHBHATWWWAYSO-CVDCTZTESA-N 349.522 5.430 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1ccccc1 773115646 NRLDSINSDSKVGH-DNVCBOLYSA-N 345.458 5.459 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1cccc(C(F)(F)F)c1 782880754 NPVVCXAPAXLFGJ-BQYQJAHWSA-N 327.305 5.150 30 20 EKED C=CCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCC1 790291643 DQDIMTAGVHZWJN-HXUWFJFHSA-N 330.431 5.027 30 20 EKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nccc2ccccc12 792106627 SHBHWUPRBCMRCV-IBGZPJMESA-N 348.471 5.276 30 20 EKED CC[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(F)cc1F 795994364 WQVNLQBAXDMGRG-KXBFYZLASA-N 343.373 5.047 30 20 EKED Cc1cccc(C)c1NC(=S)N[C@H](CCCC#N)c1ccccc1 814209835 GRTGAKREURZLNS-GOSISDBHSA-N 337.492 5.025 30 20 EKED C=CCN(C(=O)c1oc2ccccc2c1COc1ccccc1)C(C)C 914683023 BJUDDDVKTXDIKE-UHFFFAOYSA-N 349.430 5.048 30 20 EKED O=C(/C=C\c1cc(Br)cs1)c1cccc(Cl)c1 916137559 LHLPLNHCUSZWFO-PLNGDYQASA-N 327.630 5.060 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc([C@@H](C)CC)cc1 1776784304 STISTECVKFCCFS-PXNSSMCTSA-N 333.516 5.494 30 20 EKED CCCc1ccc([C@@H](Nc2ccc(C#N)cn2)c2cccs2)cc1 58489058 GPZSMTGIVVEVNG-HXUWFJFHSA-N 333.460 5.169 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3cc(F)ccc3s2)n1 80455151 SSMOWWKTJDWAIX-GFCCVEGCSA-N 344.436 5.110 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C#N)cc1 191454916 CXOMCTNKIKXCGU-UHFFFAOYSA-N 347.462 5.074 30 20 EKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1C 328979269 CTYHNHLKOMUBBI-BRWVUGGUSA-N 328.456 5.797 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(Oc2ccncc2)c1 410365109 JVZZBPMOSJIEIK-UHFFFAOYSA-N 344.414 5.245 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3c(Cl)sc(Cl)c32)s1 421895092 YKGVOFZGPQALHZ-NSHDSACASA-N 343.304 5.155 30 20 EKED CC[C@H](N[C@H](CC(F)(F)F)c1ccccc1C)c1ccc(C#N)cc1 447576859 CYTUTTNBXIYPBW-RBUKOAKNSA-N 346.396 5.601 30 20 EKED CC[C@H]1C[C@]1(NCc1cccc(OCCCC#N)c1)c1cccc(C)c1 500512199 IVEUHYNKWOKOFR-NZQKXSOJSA-N 348.490 5.093 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(F)c(CSC)c1 504283522 DPNSYYPYRBQIMA-UHFFFAOYSA-N 329.440 5.060 30 20 EKED CC[C@@H](CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1)c1ccccc1 504329827 VONNMRBUPUPUQS-MJGOQNOKSA-N 334.463 5.052 30 20 EKED CCC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 538508714 ZXINPMVJGXWNDE-BUXKBTBVSA-N 332.369 5.168 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@@H](CC(F)(F)F)c1ccccc1 539276854 LLHYBJIVUHLJGS-SFHVURJKSA-N 346.396 5.271 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1nc(-c2ccccc2)cs1 564428796 YHSSMDFQMYHNSO-IFXJQAMLSA-N 345.471 5.020 30 20 EKED N#Cc1cc(Cl)ccc1CNc1ccc(Oc2cccnc2)cc1 575215180 CHCCKWYTMAOJDZ-UHFFFAOYSA-N 335.794 5.011 30 20 EKED N#CCCC1CCN(C(=O)Nc2cccc(Oc3ccccc3)c2)CC1 592225042 MRPMDHNLTSDZFE-UHFFFAOYSA-N 349.434 5.027 30 20 EKED CCc1cc(C#N)c(NC(=O)c2oc3c(Cl)cccc3c2C)s1 604027550 CRJDXQVMNJUHFO-UHFFFAOYSA-N 344.823 5.143 30 20 EKED CCCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@H](C)c1ccccc1 604495655 XEPYRHQVOMKQJW-ZWKOTPCHSA-N 349.478 5.192 30 20 EKED CC(C)C[C@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608861136 WIKKUGIRBCAYPC-IBGZPJMESA-N 346.396 5.454 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1nc(-c2ccccc2)cs1 730086308 ZQFHOENUSFAHGA-ZHACJKMWSA-N 345.423 5.025 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1nc(-c2ccccc2)cs1 732571202 NKWZPLFECHWQGG-LUAWRHEFSA-N 342.423 5.254 30 20 EKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccco1 769770285 GTMQTRNMSDWJER-FPLPWBNLSA-N 349.333 5.318 30 20 EKED CC(C)O[C@@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 793033959 HPIBAUYRDXPBAB-KRWDZBQOSA-N 337.341 5.236 30 20 EKED N#CCCC[C@H](NCc1cc2c(O)cccc2s1)c1ccccc1 894854666 IZZLAOZZHCZNIK-SFHVURJKSA-N 336.460 5.132 30 20 EKED N#C[C@H](C(=O)C=C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 918489774 NMLUOTJKHBWISE-OAHLLOKOSA-N 342.851 5.140 30 20 EKED CC1(C)C(=NNc2ccc(Cl)c(C(=O)O)c2)C[C@H]1c1ccccc1 1776033694 SRVJDVLYEXGAQN-HNNXBMFYSA-N 342.826 5.020 30 20 EKED Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776127034 FYINHAZYOKJFRH-PKNBQFBNSA-N 348.423 5.318 30 20 EKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1C(C)C 56539836 BAEQXGGGYOISRW-UHFFFAOYSA-N 338.451 5.039 30 20 EKED C[C@@H](Nc1ccc(NC(=O)C2(C#N)CCCCC2)cc1)c1ccccc1 64738392 KMZIISOODPWNEI-QGZVFWFLSA-N 347.462 5.272 30 20 EKED C=CCC[C@H](NCc1nnc(-c2ccccc2)s1)c1ccccc1 119151793 CQDCHCMQIDPBPJ-SFHVURJKSA-N 335.476 5.002 30 20 EKED N#CCCCOc1cccc(CNc2ccc(-c3nccs3)cc2)c1 156175971 ZQLMBFCHQGNCMK-UHFFFAOYSA-N 349.459 5.105 30 20 EKED C[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1SC[C@H](C)C#N 303525632 FZOSQDSYLBXWHM-CVEARBPZSA-N 344.524 5.483 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340438981 BEMQFORMJPDVHQ-VQTJNVASSA-N 328.406 5.441 30 20 EKED C[C@@H](N[C@@H](CC(C)(C)C)c1ccccc1)c1ccc(OCC#N)cc1 392270330 LADIAKOBQZYVGC-UTKZUKDTSA-N 336.479 5.417 30 20 EKED CC[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)s1 439435409 FATVJYRBLNPIEQ-CYBMUJFWSA-N 325.264 5.167 30 20 EKED C=CCC[C@H](NC(=O)Nc1cc2[nH]ccc2cc1C)c1ccccc1 444970876 VWOALGUWLAQVPO-SFHVURJKSA-N 333.435 5.305 30 20 EKED CC[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 457489838 MFEPNZZTTGUNEN-SFTDATJTSA-N 349.478 5.181 30 20 EKED C[C@@H](C(=O)N(Cc1ccccc1)C1CCCCC1)c1cccc(C#N)c1 463461351 NMAKLMBQCLPWTE-GOSISDBHSA-N 346.474 5.023 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(OCC2CC2)cc1 486225540 CJHXDRQKQVVIHA-UHFFFAOYSA-N 339.460 5.006 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 512277676 CHNIPJSFYPHBFW-GHMZBOCLSA-N 337.225 5.416 30 20 EKED Cc1csc(-c2ccc(N[C@@H](C)c3ccc(C#N)cc3F)cc2)n1 512283604 RFOMDWKJWFDRAG-ZDUSSCGKSA-N 337.423 5.302 30 20 EKED C=C[C@H](CC(=O)N(C)Cc1ccccc1C(F)(F)F)c1ccccc1 536087636 IJPDCCFZUOEKKQ-OAHLLOKOSA-N 347.380 5.024 30 20 EKED C[C@H](N[C@@H](COc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 539510970 QPVWTZRWXWBZFW-MBSDFSHPSA-N 342.442 5.029 30 20 EKED CCc1c([C@@H](C)NC2(c3cccc(C#N)c3)CC2)oc2ccccc12 572742787 PWXWOHCJEPCSMK-OAHLLOKOSA-N 330.431 5.207 30 20 EKED N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc2ccccc2s1 584322616 YXCHEWHHSOWMGB-QGZVFWFLSA-N 344.439 5.354 30 20 EKED CC(C)Sc1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 591861704 CJCQLAISWLFPIL-KRWDZBQOSA-N 346.455 5.225 30 20 EKED N#Cc1ccccc1CN[C@H](c1ccccc1)c1cccc2ccccc12 609535846 ABLGKKLZKSVWAD-RUZDIDTESA-N 348.449 5.591 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCc2cc(C#N)cs2)c1 610911091 PDVQFFPTADAYKY-UHFFFAOYSA-N 342.411 5.195 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC=C)C1 666866094 HQGJTFVNGSFLBY-KRWDZBQOSA-N 326.484 5.359 30 20 EKED C=CCCC(=O)O[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734729767 QGBAYUBQAQHZGZ-GFCCVEGCSA-N 335.856 5.342 30 20 EKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1ccccc1F 735232803 CJOAPPOTQPIDAA-LBPRGKRZSA-N 335.831 5.376 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/C2CCCCC2)cc1 735427625 DOTOPVDIERLWFV-GSTVHYHFSA-N 344.458 5.417 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\Sc1ccccc1 789718944 LDGIVHJMCYSWOA-PFONDFGASA-N 337.488 5.783 30 20 EKED C(=NN=C1c2ccccc2-c2ccccc21)c1cccc2cccnc12 818268417 GQVCYFPBCLNDQY-UHFFFAOYSA-N 333.394 5.087 30 20 EKED C=CCC[C@H](N[C@H]1CCC[C@H](CCCC(=O)O)C1)c1ccccc1 902325803 MTMCTYNHMNBMNP-HOJAQTOUSA-N 329.484 5.097 30 20 EKED Cc1nc(CN[C@@H](CCCC#N)c2ccccc2)sc1C(C)(C)C 930570105 PTWDECOFDMIUME-KRWDZBQOSA-N 341.524 5.274 30 20 EKED COc1cccc(/C=C/C(=O)c2ccc(Cl)s2)c1OC(C)C 6339862 MHRXBZZNJYUDKW-BQYQJAHWSA-N 336.840 5.093 30 20 EKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c(Cl)c1 7277523 FFKZPMOZYRREBY-UHFFFAOYSA-N 346.817 5.439 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2occc2-c2ccccc2)cc1 25440115 NDDVVZKFIQPIER-UHFFFAOYSA-N 330.387 5.000 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66157860 USBIDDILDWUQNO-UHFFFAOYSA-N 349.478 5.433 30 20 EKED N#CCCn1cc(-c2csc(-c3ccccc3O)n2)c2ccccc21 68479957 ZCNXUOXEPXZXKX-UHFFFAOYSA-N 345.427 5.051 30 20 EKED C[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 174067373 HHTJAXOPIUKPGL-GJZGRUSLSA-N 333.460 5.094 30 20 EKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(C(C)C)c1 330323965 TXOXPWOXMQXWNA-HNNXBMFYSA-N 344.480 5.105 30 20 EKED C=CCCc1ccccc1NC(=O)C1(CCOCc2ccccc2)CC1 410345521 BTNZZLJRJMQENL-UHFFFAOYSA-N 349.474 5.131 30 20 EKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)ccc1C(F)(F)F 414450553 GOFJXUDAOHTXRB-IBGZPJMESA-N 346.396 5.539 30 20 EKED C[C@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 442787848 AWIOGEJNKYSTAV-AWEZNQCLSA-N 349.821 5.572 30 20 EKED N#Cc1cccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 471433455 QEDBFKDQHMJLLH-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1Cl 476149719 NEHFYMKMGBYPTQ-UHFFFAOYSA-N 341.882 5.763 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccccc2)C(C)(C)C)cc1 503350677 WWUZFEODTAKOHE-LJQANCHMSA-N 349.478 5.397 30 20 EKED N#Cc1cccc(CSCc2coc(-c3cccc(Cl)c3)n2)c1 521566972 JVFGABJMUMJYLH-UHFFFAOYSA-N 340.835 5.300 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccccc2CC1 530553299 ASUQMHFPVMOJDU-UHFFFAOYSA-N 348.490 5.171 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc2cc(OC)ccc2c1 532466515 VJNVLKMMVDXXJF-HJPURHCSSA-N 344.458 5.522 30 20 EKED Cc1cc2c(SCc3ccccc3C(C)(C)C#N)ncnc2s1 551319334 PGCMILBKLSDAJO-UHFFFAOYSA-N 339.489 5.093 30 20 EKED Cc1ccc2nc(-c3ccc(NC(=O)CCCCC#N)cc3)sc2c1 593935488 YYNSSTHXFFTXLH-UHFFFAOYSA-N 349.459 5.294 30 20 EKED N#Cc1c(F)cccc1NCc1cccc(COCc2ccccc2)c1 603856095 FEEOUYSYKVFJSP-UHFFFAOYSA-N 346.405 5.026 30 20 EKED CCCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@H](C)c1ccccc1 604495653 XEPYRHQVOMKQJW-QZTJIDSGSA-N 349.478 5.192 30 20 EKED N#Cc1nnc2ccccc2c1Oc1ccc(Oc2ccccc2)cc1 610128504 SHWKXBKIUNAHOB-UHFFFAOYSA-N 339.354 5.086 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618805854 PIHWMCKBOLNPMM-QVKFZJNVSA-N 336.504 5.397 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(Cl)c(C(F)(F)F)c1 727264382 QBGVTAOPLKDSOG-HWKANZROSA-N 331.746 5.020 30 20 EKED O=C(/C=C\c1cnc2ccccn12)c1ccc(-c2ccc(F)cc2)s1 740764956 LKUJNWDHOITISY-HJWRWDBZSA-N 348.402 5.098 30 20 EKED C(=NN(c1ccccc1)c1ccccc1)c1cnc([C@H]2CCCO2)s1 755465030 FATJWRKPMFQTRO-LJQANCHMSA-N 349.459 5.167 30 20 EKED Cc1ccc(-c2nc(C=NOc3ccccc3C(F)(F)F)co2)cc1 755817248 WZMNRMARNOIRMN-UHFFFAOYSA-N 346.308 5.082 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1cc(Cl)sc1Cl 760261381 APFTZHQTCMDDTB-SNAWJCMRSA-N 344.288 5.675 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc(O)c(Cl)c1 768751582 HEMVSWUJIBPINW-GQCTYLIASA-N 347.848 5.127 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C=O)c(C)cc1C 793948831 OOHAEFQEAZOXQO-UHFFFAOYSA-N 335.447 5.220 30 20 EKED N#Cc1sc(N[C@H](c2ccccc2)c2ccc(F)cc2)nc1Cl 804352661 VSDIHDOYZOPYPD-OAHLLOKOSA-N 343.814 5.009 30 20 EKED N#CCCC[C@@H](NCc1cc2ccccc2nc1Cl)c1ccccc1 814658497 FDWBHACLWUVODL-LJQANCHMSA-N 349.865 5.413 30 20 EKED CC(C)CN(CCC#N)C(=S)Nc1c(C(C)C)cccc1C(C)C 915995219 LLHHNCGLOPSDQE-UHFFFAOYSA-N 345.556 5.502 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C\c1ccc(Cl)cc1 1776783038 DIAXIELBSIGYFD-ZEVQVBBLSA-N 337.891 5.147 30 20 EKED CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C 58647579 CAIDRDKSFKVEEU-FPOVZHCZSA-N 347.462 5.057 30 20 EKED Cc1scc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 180099662 LDMBMGPVJRJEQB-NSHDSACASA-N 330.478 5.012 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(C#N)c1 181887071 CTQHMWDWOZPPGB-KSFYIVLOSA-N 330.406 5.138 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1Cl 189897750 JIRFHYXFOZFIIO-UHFFFAOYSA-N 348.273 6.098 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C=C)c1ccccc1 189913166 UWMSCNZSZVPPTR-GOSISDBHSA-N 333.475 5.837 30 20 EKED Cc1ccc(CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 290767015 KRWGPFBGOKVVPE-AWEZNQCLSA-N 344.505 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C)[C@H](C1)C2(F)F 297754725 KNPROFUFUMRMGV-QFBILLFUSA-N 348.437 5.048 30 20 EKED CCCCCCCC(=O)N[C@@H](C)c1nc2ccccc2n1C(C)C 303755457 JGKIOKKAXPGSFZ-INIZCTEOSA-N 329.488 5.155 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2cccc(F)c2C#N)cc1 428312277 FBKSLWHDGHIYQY-CQSZACIVSA-N 328.456 5.049 30 20 EKED CCOc1ccc(C(C)=O)cc1CSCCCCC(C)(C)C#N 435880605 KFORSIZILACSPP-UHFFFAOYSA-N 333.497 5.241 30 20 EKED CC(C)(C#N)CCCCN1CC[C@H](c2cccc(C(F)(F)F)c2)C1 444679799 CJOOODYWJFGBPM-INIZCTEOSA-N 338.417 5.215 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Cl)cc1-c1ccc(Cl)cc1 471380340 PQALZWKFIUDOPE-UHFFFAOYSA-N 347.245 5.539 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(C)ccc1Cl 475036776 ZWCQANIXKJTANY-UHFFFAOYSA-N 332.806 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1cccs1 475551460 WWZRIFIYFPVIFM-UHFFFAOYSA-N 342.508 5.657 30 20 EKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480809730 YUCRTINFKKFMFE-DNVCBOLYSA-N 349.434 5.003 30 20 EKED Cc1c([C@H](NCc2ccc(C#N)cc2F)C(C)C)oc2ccccc12 533445860 YZOIIEUXKTUWLD-HXUWFJFHSA-N 336.410 5.239 30 20 EKED CO[C@H](C)c1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 537732760 YEJHJHHZZMGLGA-FEPNQTLGSA-N 334.463 5.210 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 539048524 NMHVZMVNSMAJSH-RDTXWAMCSA-N 334.385 5.459 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 604629662 RUUIYHLHPCSQNK-KRWDZBQOSA-N 338.451 5.257 30 20 EKED N#Cc1ccccc1CN[C@@H](c1ccccc1)c1cccc2ccccc12 609535847 ABLGKKLZKSVWAD-VWLOTQADSA-N 348.449 5.591 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C#N)Cc1ccccc1 609918800 PHDRUTPCCGLHLK-SFTDATJTSA-N 346.499 5.065 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1c(F)cccc1Cl 611394317 CDNQKBABEFFHIE-XIKOKIGWSA-N 328.818 5.079 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2cccnc2)C2CC2)cc1 773119288 ODJNUMNFBPNLEQ-QRWLVFNGSA-N 342.870 5.015 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(Br)cc1F)c1ccccc1 783258119 APBLQESWVRPSTN-SCLBCKFNSA-N 346.243 5.003 30 20 EKED N#Cc1c(NC(=O)C=C2CCCCC2)sc2c1-c1ccccc1CC2 920004399 HPNRDCHZAASLTQ-UHFFFAOYSA-N 348.471 5.214 30 20 EKED CC(C)c1ccsc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108238302 HQVGUWDLBPGQNZ-ZDUSSCGKSA-N 344.505 5.376 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(-c2ccncc2)cc1 154327406 QIQSXNSPXUNHJX-SJORKVTESA-N 327.431 5.032 30 20 EKED CC1(C)C(O)=Nc2ccc(/C(O)=N/[C@H]3CCCc4sccc43)cc21 329795726 DCOPIZOTKTTXLG-AWEZNQCLSA-N 340.448 5.010 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1 438855120 ILUYQIPQHKBYJD-WIYYLYMNSA-N 349.478 5.051 30 20 EKED C=CCCN(C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 466395929 MEUAYJMSLQAGGD-UHFFFAOYSA-N 337.448 5.003 30 20 EKED CC[C@@H](C)n1c(SCc2ccccc2C#N)nnc1-c1ccccc1 504307341 PLTGZLVUKUJGAI-OAHLLOKOSA-N 348.475 5.080 30 20 EKED Cc1c(C(=O)Nc2ccc3ccoc3c2)sc2ccc(C#N)cc12 504881846 JVZYIINQIWCBBH-UHFFFAOYSA-N 332.384 5.080 30 20 EKED N#C[C@H](Nc1ccc(F)cc1OCCC(F)(F)F)C1CCCCC1 507712737 DKFKXYCNYBNQNM-HNNXBMFYSA-N 344.352 5.041 30 20 EKED N#Cc1ccccc1CN[C@@H](c1cccc2ccccc12)C(F)(F)F 510426809 QGFQCAFGTULFDN-IBGZPJMESA-N 340.348 5.105 30 20 EKED Cc1cccc([C@H](NCc2ccccc2C(C)(C)C#N)C(F)(F)F)c1 510452348 GDSLTIMNAOGROD-SFHVURJKSA-N 346.396 5.189 30 20 EKED C=CCOc1ccc(CN[C@@H](c2cccs2)C2CC2)cc1Cl 521823073 AFRYISZWYRNPDF-GOSISDBHSA-N 333.884 5.207 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 540604856 ALUCFZLUQNYVIX-JXFKEZNVSA-N 332.472 5.254 30 20 EKED C[C@H](N[C@H](C)c1cncs1)c1ccc(-c2cccc(C#N)c2)cc1 542105936 HTJUSZKDJYIXDY-LSDHHAIUSA-N 333.460 5.094 30 20 EKED CC(C)n1ncc2cc(NCc3ccc(C(C)(C)C#N)cc3)ccc21 594505735 XMYNTEZWBABZQC-UHFFFAOYSA-N 332.451 5.030 30 20 EKED C[C@H](NCc1ccc(N(C)c2ccccc2)cc1)c1cccc(C#N)c1 610346058 JGJGDSCOXGUHLH-SFHVURJKSA-N 341.458 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)[C@@H]1CCCCO1 654047735 UWDPNXKQCCBLBX-OALUTQOASA-N 344.499 5.008 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1ccc(Cl)cc1Cl 726742518 ROSDBULZVMEDCS-VMPITWQZSA-N 331.198 5.208 30 20 EKED CC(C)(C)c1ncc(/C=C2\CCOc3c(Cl)cccc3C2=O)s1 736433522 FXXIQWNDCGOYIH-PKNBQFBNSA-N 347.867 5.143 30 20 EKED C#Cc1cccc(NC(=O)N(C2CC2)[C@H](C)c2ccccc2Cl)c1 743084607 PFKGLHASCRAULI-CQSZACIVSA-N 338.838 5.079 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc2cc(OC)ccc2c1)c1ccncc1 766018927 JRQAUOVRQFNZQY-OPAMFIHVSA-N 332.447 5.211 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 766022461 VZQTVBQHIMPGET-GTNSWQLSSA-N 339.241 5.496 30 20 EKED CCc1cnc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)s1 783710928 PJWPPJWPUVFFEP-SEYXRHQNSA-N 349.455 5.277 30 20 EKED N#Cc1sc(N[C@H](c2ccccc2)c2cccc(F)c2)nc1Cl 804543367 UBUXZBRRVNQLSC-OAHLLOKOSA-N 343.814 5.009 30 20 EKED CCC[C@H](CC(C)C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 835074385 RIJMSXJZWMLFFO-KGLIPLIRSA-N 347.409 5.070 30 20 EKED CC(C)c1ccc(NCc2cc(C#N)ccc2Br)cc1 863997357 VNNCELKFCTZUKI-UHFFFAOYSA-N 329.241 5.056 30 20 EKED N#Cc1cccc(NC(=O)[C@@H](Sc2ccccc2)c2ccccc2)c1 7265585 QZOORWBRSIRQDL-FQEVSTJZSA-N 344.439 5.030 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1ccc(O)c(Cl)c1 60132762 QAQPAAPBGNQACI-SOFGYWHQSA-N 335.856 5.004 30 20 EKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(CC#N)cc1 77672591 WOWAYSWLNLRLHN-QGZVFWFLSA-N 347.462 5.148 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2ncccc2c1 189901420 NEUNKWWNBDLYCS-UHFFFAOYSA-N 330.431 5.339 30 20 EKED CC(C)c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 236739918 FNMXHZHBCXQAJJ-UHFFFAOYSA-N 344.462 5.199 30 20 EKED CSc1c(F)cccc1C(=O)Nc1sc(C(C)(C)C)cc1C#N 411003995 BJPMQJAUWSRZSJ-UHFFFAOYSA-N 348.468 5.031 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccccc1F)c1ccccc1 435095604 IOSRSFUJTCJEPO-JXFKEZNVSA-N 340.442 5.236 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 446827412 OAWZJKSOBAYDDJ-BVPBIZIASA-N 336.401 5.013 30 20 EKED CC[C@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1 447573775 JHBZNNSUNYCLJX-INIZCTEOSA-N 338.501 5.512 30 20 EKED N#Cc1cc(Cl)ccc1CNC(c1ccccc1)c1ccccc1 478338185 HKHZNOKQXWCIEN-UHFFFAOYSA-N 332.834 5.091 30 20 EKED C[C@@H](N[C@@H](COc1ccccc1)c1ccccc1)c1cccc(C#N)c1 540609555 UPJZSCZJEGUNRM-JPYJTQIMSA-N 342.442 5.029 30 20 EKED C=CCC[C@@H](NC1CCC(OC)CC1)c1ccc(C(F)(F)F)cc1 542485039 GQNFAIYFZSYNBE-DAWZGUTISA-N 341.417 5.260 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1 572166254 IHBOKBWSTJPHDJ-XLIONFOSSA-N 339.479 5.370 30 20 EKED CC(C)(CCC#N)CN[C@@H](c1ccc(F)cc1)c1ccccc1Cl 577204790 NYOIMORDRJYHNZ-IBGZPJMESA-N 344.861 5.488 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NCc1ccc(C#N)c(Cl)c1 588959461 CBZBNXAMKLOSTL-FQEVSTJZSA-N 349.865 5.169 30 20 EKED C=CCN(C(=O)N[C@@H](CCC)c1cccc(C(F)(F)F)c1)C(C)C 726851935 YEHFYQZAACXETJ-INIZCTEOSA-N 342.405 5.153 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2ccc(C#N)cc2)o1 734303045 BGJOKUIIHKMXJQ-YFHOEESVSA-N 331.346 5.162 30 20 EKED C[C@@H]1CCC[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 741537423 DMKSGTOGAJHVDT-PBEJRMEISA-N 332.447 5.107 30 20 EKED COc1ccc(C=NOc2ccccc2C(F)(F)F)c2ccccc12 754712250 HZVBBBJSNWRCKA-UHFFFAOYSA-N 345.320 5.280 30 20 EKED C[C@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)c(F)c1 777695904 MOCYYPHTLLPFSF-INIZCTEOSA-N 337.442 5.251 30 20 EKED CC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCCC1 780346924 VRJIOEDSFWONNE-FQEVSTJZSA-N 332.447 5.251 30 20 EKED O=C1/C(=C\c2scnc2C2CC2)Cc2c1ccc(Cl)c2Cl 782327565 RPQHZZRBJVUDBT-TWGQIWQCSA-N 336.243 5.150 30 20 EKED CC(=NOCc1coc(-c2cccs2)n1)c1cc2ccccc2o1 852754766 LIHRUKRCNNTDJI-UHFFFAOYSA-N 338.388 5.090 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(c2ncco2)CC1 862108296 DEGJDPNFUXJXSG-QGZVFWFLSA-N 334.504 5.157 30 20 EKED CC[C@@H]1c2ccccc2CN1C(=O)N[C@H](CCCC#N)c1ccccc1 895042012 QHYWLQIDNCKNSA-NHCUHLMSSA-N 347.462 5.098 30 20 EKED CCCOc1ccc(/C=C\C(=O)c2cc3ccccc3o2)cc1OC 916138392 JOBWDSSBUFTFHL-NTMALXAHSA-N 336.387 5.126 30 20 EKED C[C@@H]1CCCC[C@H]1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 920790718 KJLLVLXMBTXGTN-DYEKYZERSA-N 346.883 5.342 30 20 EKED CC(C)[C@@H]1/C(=C/c2cccc(C(=O)O)c2Cl)C(=O)c2ccccc21 1776308594 HCMWPJJMGOSING-RNIVLKNTSA-N 340.806 5.058 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)Nc1ccccc1SCCC#N 116021994 JKUBOXUPZXJJOE-MRXNPFEDSA-N 338.476 5.133 30 20 EKED C=C(C)C[C@H](C)C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 186105888 NKPPHERUWWGTOZ-NSHDSACASA-N 338.835 5.203 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(-c2ccoc2)c1 189913205 DLCHKQFSBNBZNL-UHFFFAOYSA-N 345.442 6.051 30 20 EKED Cc1ccc(C)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303314299 GMKGYSBXVGAACZ-UHFFFAOYSA-N 342.398 5.220 30 20 EKED OC1=Nc2cc(Cl)cc(N=C(O)[C@H]3C[C@H]3C3CCCCC3)c2OC1 329205147 DHQCAEGWOAOUMX-STQMWFEESA-N 348.830 5.125 30 20 EKED CCc1ccc2occ(C(=O)N[C@H](CCCC#N)c3ccccc3)c2c1 352174223 LTAAHOAPTOYGLF-HXUWFJFHSA-N 346.430 5.160 30 20 EKED N#C[C@@H]1CC[C@@H](N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)C1 429696347 IKMRMHMZPZLGTF-RHSMWYFYSA-N 335.278 5.165 30 20 EKED C=CCNC(=O)Nc1ccc(N[C@@H](CC)c2ccc(Cl)cc2)cc1 439549464 KALHMUDIHMXMPZ-SFHVURJKSA-N 343.858 5.211 30 20 EKED C=CCC[C@H](N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 467737634 MFZCXLRPOXEOGJ-OCCSQVGLSA-N 340.414 5.520 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1C 468168355 LEPYZJCRSUWVEW-KRWDZBQOSA-N 326.484 5.081 30 20 EKED N#C[C@H](C(=O)c1ccc(F)c2ccccc12)c1nc2ccccc2s1 483438995 JVTFPNKZHRGTEB-OAHLLOKOSA-N 346.386 5.079 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(Cl)c1 506045753 KJURIFXHZFNSCU-UHFFFAOYSA-N 343.854 5.453 30 20 EKED COc1ccc(CN(Cc2ccccc2)CC(C)(C)CCC#N)cc1 508821270 FCTCGDLHWRXAJM-UHFFFAOYSA-N 336.479 5.027 30 20 EKED C=C[C@@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 536124507 FZUSYXBMAAYKFI-YJBOKZPZSA-N 347.380 5.156 30 20 EKED Cc1coc(-c2cc(NCc3ccc(C4(C#N)CC4)cc3)ccc2C)n1 594959120 TWIHRTFFJMBRTD-UHFFFAOYSA-N 343.430 5.126 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)cc1 609535912 OJVBXKWYKQIYOW-RUZDIDTESA-N 348.449 5.591 30 20 EKED C[C@@H](SCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C#N)cc1 609825538 CZRCAYOIFZUDPR-LLVKDONJSA-N 332.812 5.114 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619754851 MMTKXGUWCMJPFI-CQSZACIVSA-N 344.911 5.563 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc2cc(Cl)ccc2o1 619755339 XJYLXFXGBNFNCT-LLVKDONJSA-N 345.229 5.462 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1cccc(-c2ccncc2)c1 741467878 AVZLTOSTRLRYAH-XQRVVYSFSA-N 325.820 5.360 30 20 EKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 752393970 UOXBJHXCAHUNRN-HXUWFJFHSA-N 347.422 5.260 30 20 EKED C=CC[C@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccncc1 766020607 QOUAIDOFMOMETG-KXBFYZLASA-N 336.435 5.113 30 20 EKED N#CCOc1cccc(NCc2ccc(-c3ccccc3Cl)o2)c1 779587633 DUWMKYCWPPYVSP-UHFFFAOYSA-N 338.794 5.114 30 20 EKED COc1cccc(/C=C\C(=O)c2cc(C)sc2C)c1OC(C)C 916155892 KUJFVKNODMRIBA-KTKRTIGZSA-N 330.449 5.057 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Br)c1 90664486 VSYSXZGPYQORBP-RDTXWAMCSA-N 343.268 5.145 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@@H](C)CC[C@H]1C 135546363 GNOOWHMWLIJNQV-IYBDPMFKSA-N 349.434 5.064 30 20 EKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C#N)c1 182102861 LXMVGXVDBACJSI-SJCJKPOMSA-N 336.332 5.042 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(-c2ccncc2)ccc1C)c1ccccc1 187425111 ZUDDCQGQCTUDDM-OAQYLSRUSA-N 342.442 5.355 30 20 EKED OC(CC/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)=Nc1ccccc1 329169467 JPMXMPYVZQCCTD-RYQLBKOJSA-N 328.456 5.228 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(-c2cccs2)c1 429062621 UTTKQRDQCZLWLU-UHFFFAOYSA-N 341.480 5.209 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 466641597 KNWXVFODJLEKMP-CABCVRRESA-N 342.508 5.206 30 20 EKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)NCC(C)(C)CCC#N 513145962 ANTNYKUIYUISRL-KRWDZBQOSA-N 349.906 5.008 30 20 EKED C=CCC[C@@H](NCc1csc(-c2ccc(C)o2)n1)c1ccccc1 538259012 TZBVBKFMJFYDTN-GOSISDBHSA-N 338.476 5.509 30 20 EKED CC(C)c1cccc(-c2ccc(C(=O)N(C3CC3)C3(C#N)CCC3)o2)c1 551307640 ODZSTSMDGKGISC-UHFFFAOYSA-N 348.446 5.121 30 20 EKED CC(C)(C#N)CC[S@](=O)[C@@H](c1ccccc1)c1ccc(Cl)cc1 555509382 QYQDOEHALDXHGX-MBSDFSHPSA-N 345.895 5.118 30 20 EKED C[C@@](C#N)(NC(=O)c1cc2c(Cl)cccc2s1)C1CCCCC1 609638752 CQLWMKUSYFEPDE-SFHVURJKSA-N 346.883 5.147 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccs2)cc1 610829995 WBLGCHSDMVOOHA-JKSUJKDBSA-N 332.472 5.699 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cccc(O)c2)CC3)cc1 727654109 HOQPMBRKOVAROZ-LFIBNONCSA-N 347.439 5.037 30 20 EKED C=C(C)CNC(=S)N[C@@H](c1ccc(C(C)C)cc1)c1cccs1 730595936 CSIXMYCMIPCGTQ-SFHVURJKSA-N 344.549 5.001 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1cccc(Cl)c1C 732625726 SBRSOHPTNYNOHW-UHFFFAOYSA-N 336.932 5.414 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C=C2CCC2)cc1Cl 755174409 HCNOMDRDAMZNIY-GOSISDBHSA-N 336.822 5.044 30 20 EKED C=C[C@H](CC(=O)O[C@@H](c1ccccc1)c1cccnc1)c1ccccc1 759315105 NHQVXKZPZWXIBW-JPYJTQIMSA-N 343.426 5.074 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CC[C@H](C)C3)n2)cc1 759538948 NYVDPVZKSBJKRD-ZMSDIMECSA-N 338.476 5.121 30 20 EKED C[C@@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 776518788 XIWARNQCHLWIGW-OSAQELSMSA-N 344.867 5.076 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC(C)(C)C3)n2)cc1 781768123 VNDJWPGELJDGPT-HZPDHXFCSA-N 338.476 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCC(C)(C)CO1 890165475 FHQHBJVARUMGMB-QGZVFWFLSA-N 329.484 5.072 30 20 EKED Cc1c([C@@H](N[C@H](C)c2cc(C#N)ccn2)C(C)C)oc2ccccc12 902800816 UMYKMLDPZLEOMW-QRWLVFNGSA-N 333.435 5.056 30 20 EKED CCCCCOc1ccc(/C=C\C(=O)c2ccc(OCC#N)cc2)cc1 916152079 OXAWEWJEPFVXGG-AUWJEWJLSA-N 349.430 5.054 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(Cl)c1Cl 1776783733 GTRCJBHSBZKHKV-CQSZACIVSA-N 346.298 5.287 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)[nH]1 328797903 WESITVSBTPABHJ-GVDBMIGSSA-N 337.467 5.580 30 20 EKED CCc1cccc(CC)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432740367 AMQALIRRELDOMV-FQEVSTJZSA-N 349.478 5.368 30 20 EKED CC(C)(C#N)CCCCN(Cc1cccc(-c2cccnc2)c1)C1CC1 444671484 GIKLTBMSSJOODH-UHFFFAOYSA-N 347.506 5.433 30 20 EKED CC[C@H](NCc1cc(Cl)sc1Cl)c1ccc(C#N)cc1 447574209 LVYJEKQHXVSKFN-ZDUSSCGKSA-N 325.264 5.167 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(F)c(C)cc1F 451329111 JLPIRSZGQGAWNR-UHFFFAOYSA-N 343.417 5.306 30 20 EKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)CCCC#N)c1 463087451 LTKNEIQQCOYTBG-UHFFFAOYSA-N 328.799 5.073 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cscc1C 486657963 OJCNLABDEJRJQN-UHFFFAOYSA-N 348.427 5.281 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 487595525 UWMMUSJGJPYZFT-GOSISDBHSA-N 334.444 5.109 30 20 EKED Cc1sc(NC(=O)c2oc3c(C)ccc(C)c3c2C)c(C#N)c1C 512374969 JNANIMUDHIPWHB-UHFFFAOYSA-N 338.432 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccc(OC)cc2[nH]1 530563712 YWYUJPBAIWVBIJ-UHFFFAOYSA-N 348.446 5.281 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccc(OCc2ccccc2)cc1 561438076 OFDYXFHBSPPNAE-INIZCTEOSA-N 348.471 5.050 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H](c2nc3ccccc3s2)C1 580931623 JRSRMOKFVRYNRG-INIZCTEOSA-N 341.524 5.196 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1sccc1C(C)C 604490840 IMWOXWPWFDEXFG-UHFFFAOYSA-N 340.492 5.042 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(F)cc1C(F)(F)F 606948514 KXOXQUFOSIUUGY-UHFFFAOYSA-N 332.341 5.055 30 20 EKED N#Cc1c(F)cccc1Oc1ccc2ccc(C(F)(F)F)nc2c1 608778973 FHLCUWXHCVVNFT-UHFFFAOYSA-N 332.256 5.057 30 20 EKED N#C[C@H](Nc1ccccc1COCc1ccccc1)C1CCCCC1 609676919 FVNMVTAOXUKNBD-QFIPXVFZSA-N 334.463 5.288 30 20 EKED Cc1oc(-c2ccsc2)nc1CON=Cc1ccc(C(C)C)cc1 726787566 OUSUTGZNZNKTAQ-UHFFFAOYSA-N 340.448 5.386 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1cncc(F)c1 737444417 RKUOSYOYHXDQIN-ALCCZGGFSA-N 327.742 5.030 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 742432226 UOBMMBSWVVHGOH-VOTSOKGWSA-N 329.421 5.215 30 20 EKED CC(C)[C@H]1/C(=C\c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 766505494 JCICBZDKIHKZGE-WAGPWIPHSA-N 346.455 5.225 30 20 EKED Cc1cncc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)c1 767366646 IKRRQPYSSKKUAV-VOTSOKGWSA-N 340.835 5.063 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1cc2ccccc2o1 916138543 VWWGXEPYFUHARN-KHPPLWFESA-N 331.396 5.452 30 20 EKED C=C(C)COc1cc(CN[C@@H](CC)c2ccc(C)cc2)ccc1OC 60926918 RWONGCSDJXTQKJ-FQEVSTJZSA-N 339.479 5.199 30 20 EKED Cc1ccc(-c2nnc([C@H](C)Sc3ccccc3C#N)o2)cc1C 177354519 BRLOWHJPBTXJGI-AWEZNQCLSA-N 335.432 5.078 30 20 EKED C=CCN(CC(=O)Nc1c(C)cccc1C(C)C)CC1CCCCC1 303467945 PWLADEGGLCMRSV-UHFFFAOYSA-N 342.527 5.125 30 20 EKED C=C[C@@H](CC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccccc1 437451720 KHLCGTQRRRLUSG-QSFXBCCZSA-N 339.866 5.062 30 20 EKED CC[C@H](F)CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 440493813 YDBKTNFBBULBBS-NWDGAFQWSA-N 331.275 5.037 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 445990809 CQAZGKFZODTGBM-WBVHZDCISA-N 338.417 5.261 30 20 EKED C[C@@H](N[C@@H]1CCCc2occc21)c1ccc(-c2cccc(C#N)c2)cc1 447593276 QUQBDWVBROWMKT-OPAMFIHVSA-N 342.442 5.546 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc2ccccc12 476135643 HDKPOJBSASLLSR-UHFFFAOYSA-N 349.499 5.934 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(CC)c1CC 487606548 KSAPSLUAUWGJEH-UHFFFAOYSA-N 328.481 5.093 30 20 EKED N#CCCCOc1cccc(NC(c2ccccc2)c2ccccc2)c1 494953080 PRISHGRZMNZMOU-UHFFFAOYSA-N 342.442 5.571 30 20 EKED C[C@@H](NCc1ccc(-c2cccc(F)c2)s1)c1ccc(C#N)cc1 509569408 LOJZRPJGATZKIL-CQSZACIVSA-N 336.435 5.277 30 20 EKED N#CCCCOc1cccc(NCc2ccc(-c3ccccc3)cc2)c1 513175972 NAXAJKOLFNGKPK-UHFFFAOYSA-N 342.442 5.648 30 20 EKED N#Cc1ccc(OCc2csc(-c3ccccc3F)n2)c(Cl)c1 524457397 GDLFEWZSOKKFMI-UHFFFAOYSA-N 344.798 5.053 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc2ccccc12 537042198 ZTTTUDDFTYHIDS-KRWDZBQOSA-N 328.459 5.492 30 20 EKED C[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)c(F)c1 539607225 DIZXJSUWPLDNMR-BMLIUANNSA-N 349.236 5.342 30 20 EKED CC(C)c1ccoc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 560041391 MRIKZQARKHVKAW-UHFFFAOYSA-N 336.416 5.255 30 20 EKED CC(C)Oc1cccc([C@H](C)N[C@H](C#N)c2ccc(Cl)cc2)c1 595415297 LNIOHEUVWFTGBA-IFXJQAMLSA-N 328.843 5.043 30 20 EKED Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c(C)c1 603968447 SMCBDFYOZSDWFH-UHFFFAOYSA-N 332.428 5.156 30 20 EKED Cc1ccc2c(c1)C(=O)/C(=C/c1cnc(-c3ccccc3)s1)CCO2 727264376 PUOBHRNHLKQBCO-FOWTUZBSSA-N 347.439 5.167 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 731114224 KDLACQUVMDQPIR-LSDHHAIUSA-N 333.501 5.029 30 20 EKED CCCN(CCC)c1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1 743495139 AXKJGSCVKOZOCH-GOSISDBHSA-N 335.495 5.035 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1cnc(C(C)C)s1 758430955 SZQGEEVFGXOVKN-FPLPWBNLSA-N 334.510 5.225 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2cccs2)cc1 915180966 UKSMTKCZFRNLHY-CBUFDYBVSA-N 344.439 5.055 30 20 EKED Fc1ccc2[nH]c3c(c2c1)C(=NNc1cccc2ncccc12)CCC3 915964811 PPKYPZCOGKANPJ-UHFFFAOYSA-N 344.393 5.008 30 20 EKED CCCCCCCCC(=O)Nc1ccc(Oc2ncccn2)cc1C 920883874 XHUPFNRTDKAKKD-UHFFFAOYSA-N 341.455 5.266 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2cccc(CCC(F)(F)F)c2)cc1 151043622 ZMLCIFRXKLRMMW-AWEZNQCLSA-N 348.368 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C(C1CC1)C1CC1 191517258 RGYJVQYTXWTRLN-UHFFFAOYSA-N 326.484 5.191 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340443165 FLNJWOBEIHTEHJ-VQTJNVASSA-N 326.871 5.816 30 20 EKED CC1(C)CCC[C@@H](CC(=O)N[C@@H](CCCC#N)c2ccccc2)C1 352206558 NUEJLQWXOAXPPG-HKUYNNGSSA-N 326.484 5.144 30 20 EKED C[C@@H]1C[C@H](N[C@@H](CCC#N)c2ccccc2)c2ccsc2S1 358346893 DELGUWZUKWGUOZ-COXVUDFISA-N 328.506 5.308 30 20 EKED C=CCOc1cccc(CN[C@H](CC(F)(F)F)c2ccccc2C)c1 444015033 ZLWKMFWLXFKDPB-LJQANCHMSA-N 349.396 5.343 30 20 EKED CC(C)C[C@@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458794594 BHWBPPPLFAJFHM-PMACEKPBSA-N 341.499 5.032 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@H](c1ccccc1C)C(C)C 490685949 XMKYJMUZEORBMQ-FQEVSTJZSA-N 335.451 5.036 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)c(Cl)c1 517461641 ZERIBAOGCLCTGO-CHWSQXEVSA-N 348.874 5.904 30 20 EKED C=CCCC(=O)Nc1cccc(Cl)c1Sc1nc(C)cs1 522600243 CMNQRRYSGOCJFF-UHFFFAOYSA-N 338.885 5.161 30 20 EKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1CCC1 524131550 YFNDQDFMVLTAPI-UHFFFAOYSA-N 349.434 5.065 30 20 EKED CCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 538508949 OYGKZRKDAPCAFR-KGLIPLIRSA-N 328.456 5.221 30 20 EKED Cc1sc([C@H](C)N[C@@H]2CC[C@@H](C#N)C2)nc1-c1ccc(Cl)cc1 555424516 HJKVWUAODRWBIP-NORZTCDRSA-N 345.899 5.115 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 559862963 FWOHLLWTQDPULN-WIYYLYMNSA-N 344.458 6.032 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(Cl)cc1Cl 566684864 CFHHUOQOMCFTRL-GFCCVEGCSA-N 331.246 5.205 30 20 EKED N#CC1(c2ccc(CN[C@H]3CCCc4sc(Cl)cc43)cc2)CC1 594940432 CNAWNNJXKPLYGQ-INIZCTEOSA-N 342.895 5.124 30 20 EKED C=CCCCN(C)C(=O)c1ccc(SCc2ccccc2)cc1 605645550 XVONAVBPHPXEIH-UHFFFAOYSA-N 325.477 5.017 30 20 EKED COc1ccc(C(=O)/C=C/c2nccc3ccccc23)c2ccccc12 740764676 BMFZPLOCCDVPHX-VAWYXSNFSA-N 339.394 5.293 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cnc1Cl 760266425 UPIGGEUQCBFLLE-FARCUNLSSA-N 334.806 5.002 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(OC)c2ccccc12)c1ccncc1 766022562 XDJPHWHFJGPXFC-IERDGZPVSA-N 332.447 5.211 30 20 EKED N#CCCC[C@H](NCc1cc2ccccc2c(Cl)n1)c1ccccc1 814658869 HSFWMUYVXWHLTF-FQEVSTJZSA-N 349.865 5.413 30 20 EKED CC(=NNc1ncccc1Cl)c1sc(-c2ccccc2)nc1C 814810262 FELKWDOEBNULIO-UHFFFAOYSA-N 342.855 5.003 30 20 EKED COc1cccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)c1 853283190 GDTLTONJWYNXAM-UHFFFAOYSA-N 342.283 5.148 30 20 EKED CCCCCc1ccc(C(CC)=NNc2cccc(C(=O)O)c2)cc1 1776036783 PPBCHYGSOWDMCN-UHFFFAOYSA-N 338.451 5.344 30 20 EKED Cc1nc(SCc2cccc(C#N)c2)n(C2CCCCC2)c1C 10870819 RXJDVUVTVAYONN-UHFFFAOYSA-N 325.481 5.169 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 186448055 RZYUNLVCIUNREG-IAGOWNOFSA-N 334.435 5.014 30 20 EKED C[C@H](CCC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 352173790 GIAREYFKLDMNMU-WIYYLYMNSA-N 334.463 5.122 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2cccc(SC)c2C)CCCC1(C)C 444942101 NJYHYSBCKZKRLU-KRWDZBQOSA-N 332.513 5.316 30 20 EKED CN(CCCC1(C#N)CCOCC1)c1ccc2c(c1)oc1ccccc12 451300359 UXFDTYCYVXMFOS-UHFFFAOYSA-N 348.446 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCC[C@H](SC)C1 475552189 BSOMDRFNDSWGFF-SJORKVTESA-N 346.540 5.334 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2F)s1 480794383 BJHJNESSEHGILH-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)(C)c1ccc(CSCCCC2(C#N)CCOCC2)cc1 507504060 BRQGHRNFESZACU-UHFFFAOYSA-N 331.525 5.318 30 20 EKED Cc1cccc(-n2c(SCCCCC#N)nnc2-c2ccccc2)c1 510416332 YBINRNCYFVEUIW-UHFFFAOYSA-N 348.475 5.029 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 511186788 HUTABOZREIGBCC-UHFFFAOYSA-N 345.402 5.054 30 20 EKED Cc1ccc(CN(Cc2cccc(OCCCC#N)c2)C(C)C)s1 511887530 HGORWOIPTCURLN-UHFFFAOYSA-N 342.508 5.150 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)NCC(C)(C)CCC#N)c(C)c1 515354033 HSWKWLBWOGWTQA-OAHLLOKOSA-N 347.528 5.337 30 20 EKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)(C)C 521812582 YXZPOXYAYKQFLY-CZUORRHYSA-N 333.501 5.027 30 20 EKED COc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(C#N)c(F)c1 538508663 XHEHMIUFBBHDOB-FOIQADDNSA-N 340.442 5.144 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 539495739 CDWCTOVPDRQJAO-GAJHUEQPSA-N 344.433 5.332 30 20 EKED C=CCC[C@H](N[C@@H]1CCCc2nc(CC)sc21)c1ccccc1 540146137 AKJMYNVQXNNEIA-DLBZAZTESA-N 326.509 5.380 30 20 EKED Cc1cc(Cl)c(NC(=O)c2ccc(Cl)c(C#N)c2)cc1Cl 542528035 NVBRMYKCYJNVME-UHFFFAOYSA-N 339.609 5.079 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 543508894 ZHEDVSVJPUZJNI-LBPRGKRZSA-N 335.781 5.576 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@@H]1CCc2ccc(Cl)cc21 544046158 PEXCSKMDXCZGBW-CXAGYDPISA-N 342.895 5.691 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C 558640239 PUMBPKIJTQCBLP-OAHLLOKOSA-N 338.426 5.096 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)ccc1Cl 618806863 STKOJDVXLADHIU-VOJFVSQTSA-N 331.246 5.203 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)Cc1cc(Cl)ccc1OCC#N 735311085 JMFNPGKQANSHNF-FQEVSTJZSA-N 342.870 5.071 30 20 EKED CC(C)Oc1ccccc1C=NOCc1csc(C2CCCC2)n1 746352980 KHROLNIKKYPCBK-UHFFFAOYSA-N 344.480 5.139 30 20 EKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2)s1 756686021 QROBAVXWESLJLA-INIZCTEOSA-N 348.471 5.168 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccccc2F)s1 765008447 CLGDDKIGHAUXFG-CQSZACIVSA-N 336.435 5.277 30 20 EKED C[C@H](CCC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797568952 YSBGMLSKXFNNTN-GDBMZVCRSA-N 340.492 5.201 30 20 EKED C[C@H](Nc1cccc(F)c1C(C)(F)F)c1ccc(OCC#N)cc1 866605509 OMQPEWPYOBMPMW-LBPRGKRZSA-N 334.341 5.013 30 20 EKED C=CC(C)(C)CCCNc1ccc([S@](=N)(=O)C(F)(F)F)cc1 882715109 LKJPQPNNIIIXGU-QFIPXVFZSA-N 334.407 5.016 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(F)cc3)cc2)cc1 1776131067 GHHNHQUSZLTRBY-LZWSPWQCSA-N 346.357 5.087 30 20 EKED CC(C)(C)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776272511 RPVURYBWMODBRX-LGMDPLHJSA-N 348.442 5.285 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc2c(C(=O)O)c[nH]c2c1 1776786157 SJRWEEBIMJLOSZ-CQSZACIVSA-N 344.455 5.191 30 20 EKED C=CCCC(=O)N(Cc1cccc(F)c1)[C@H](CC)c1ccc(F)cc1 60365036 GXBOPBMOSZJJOG-HXUWFJFHSA-N 343.417 5.411 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(Cl)c1 125234470 RLQIJVFHJWNILZ-LLVKDONJSA-N 348.830 5.126 30 20 EKED Cc1ccc(Cl)c(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1C 434483875 NMBAVIYRUZIAEL-KRWDZBQOSA-N 341.842 5.123 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 447509274 FFAVXWWDEUNVJJ-UGSOOPFHSA-N 332.369 5.379 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)ccc1F 451330495 MBNQAHWVHXYQGV-UHFFFAOYSA-N 325.427 5.167 30 20 EKED CC(C)(C)C[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458804759 SWTJCSVYVZYIEO-RBUKOAKNSA-N 341.499 5.032 30 20 EKED N#Cc1cccc(Cl)c1NCc1ccc(Oc2ccccc2)nc1 462794376 XPWMUQZHLISKBC-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCC[C@@H](SC)C1 475552184 BSOMDRFNDSWGFF-IAGOWNOFSA-N 346.540 5.334 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC(C)(C)CC1 475553881 PVEBHXZJIXCOMM-UHFFFAOYSA-N 328.500 5.583 30 20 EKED CSc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1Cl 476233690 FICVVMZHYKBKAI-CQSZACIVSA-N 344.867 5.088 30 20 EKED C=CCc1cc(CN[C@@H](CC(C)C)c2ccccc2)cc(OC)c1O 500258249 RQKLBJBUHKKOJP-FQEVSTJZSA-N 339.479 5.006 30 20 EKED C=CCCc1ccccc1NC(=O)c1[nH]c2ccc(F)cc2c1Cl 504283670 HDDHYKSGKDLDRY-UHFFFAOYSA-N 342.801 5.331 30 20 EKED CCN(C(=O)[C@@H](C)CC1CCCCC1)[C@@H](C)c1ccc(C#N)cc1 510303932 AXHHCHRIUZDCNF-IRXDYDNUSA-N 326.484 5.074 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 512668777 WOAREHQSZDWJHR-SBUREZEXSA-N 344.433 5.332 30 20 EKED C=CCC[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccccc1 539356862 NEHDHCROSMBVIC-IBGZPJMESA-N 336.410 5.278 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 550829414 FXEAIYWWCLMYJV-AUUYWEPGSA-N 330.834 5.565 30 20 EKED Cc1ccc2cc([C@H](C)N[C@@H](CCCC#N)c3ccccc3)oc2c1 551214051 ALLUYBQHCZWQPZ-PXNSSMCTSA-N 332.447 5.827 30 20 EKED C=CC[C@H](C)NCc1cn(C(C)(C)C)nc1-c1ccccc1Cl 604892963 SBMKFZPVNXPIIQ-AWEZNQCLSA-N 331.891 5.013 30 20 EKED CCO[C@H](C)c1nc(CSc2ccc(Cl)cc2C#N)cs1 610654675 PZUWPTZBJVNTLQ-SNVBAGLBSA-N 338.885 5.058 30 20 EKED C[C@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccc(C#N)cc1 611167001 NQYXGDBCKRNGIV-GTNSWQLSSA-N 331.246 5.203 30 20 EKED C#Cc1cccc(NC(=S)N(CC)c2ccc3ccccc3c2)c1 726488261 VAVQACTUIJSYJT-UHFFFAOYSA-N 330.456 5.044 30 20 EKED COc1cccc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)c1 734303415 OEOOQLDGAPMQOW-KHPPLWFESA-N 335.428 5.023 30 20 EKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 736348800 YBMSFFQEONIEOF-INIZCTEOSA-N 346.405 5.449 30 20 EKED C=CC[C@@H](NC(=O)N1C[C@@H](C(C)(C)C)c2ccccc21)c1ccncc1 770625316 KBRBSJMBGWOUAA-RTBURBONSA-N 349.478 5.058 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(C)c(C)c1O)c1ccc(F)c(F)c1 775556749 ACKNVTOLCVVZSS-AUUYWEPGSA-N 331.406 5.255 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CC/C=C/c2ccccc2)s1 797566294 FLBRDMYJSFLAKW-BPLPYTOXSA-N 338.476 5.110 30 20 EKED N#CC1(c2ccccc2)CCC(=NNc2nc3ccccc3s2)CC1 916587995 CNBOMFIVGFBEIF-UHFFFAOYSA-N 346.459 5.100 30 20 EKED CC[C@@H](C)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776698346 LJZZBQXZNWXKTF-DQPIFXJKSA-N 348.442 5.501 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(F)cc1 189898303 NKCNUMJZRDGEBT-UHFFFAOYSA-N 325.427 5.249 30 20 EKED CC1(C)CCC(CC(O)=Nc2cccc([C@H]3CN=C(O)C3)c2)CC1 328649137 INLKPSRSYIXMPD-MRXNPFEDSA-N 328.456 5.325 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C(C)C)nc2onc(C)c12 410361810 FDEBNTYKENQEMS-UHFFFAOYSA-N 349.434 5.026 30 20 EKED CC(C)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](C)c1ccccc1 410894856 WGBXMCTZWFWOJA-GHTZIAJQSA-N 334.463 5.072 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@@H](Nc2cccc(OCCCC#N)c2)C1 467330026 FPEPFEOTSNDLJF-RTBURBONSA-N 349.478 5.211 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cncc(C)c1)c1ccc(C(F)(F)F)cc1 467746278 NDENTTJMGSIWNV-KXBFYZLASA-N 348.412 5.767 30 20 EKED C[C@H](S[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 471412245 PZZBWFWQJNWEOT-LSDHHAIUSA-N 334.444 5.769 30 20 EKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)c1 476315944 VWPMTFKVMPCFTO-UNMCSNQZSA-N 346.474 5.055 30 20 EKED Cc1ccc([C@H](Nc2c(Cl)cccc2C#N)c2ccccn2)cc1 480579646 LEXAPVUYFXGWFP-FQEVSTJZSA-N 333.822 5.117 30 20 EKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@@H](CCC#N)c1ccccc1 489003811 ACJBVQYYIHYGIW-QFUCXCTJSA-N 346.474 5.137 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 534751544 GWFBSXKKIZBVTC-OAQYLSRUSA-N 347.462 5.359 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1 538394586 GNNLERXLMKQBFQ-BFUOFWGJSA-N 328.406 5.274 30 20 EKED CSc1c(F)cc(NCc2ccccc2C(C)(C)C#N)cc1F 542221903 PPKDAMNPRPQKQD-UHFFFAOYSA-N 332.419 5.100 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(F)c2ccccc12 556151004 SGRHHACVZSEROS-HNNXBMFYSA-N 330.406 5.190 30 20 EKED CC(C)c1cccc(-c2ccc(C(=O)NCC(C)(C)CCC#N)o2)c1 557982109 MGXKHULYRMKWEQ-UHFFFAOYSA-N 338.451 5.130 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1 572166253 IHBOKBWSTJPHDJ-PXNSSMCTSA-N 339.479 5.370 30 20 EKED CC(C)OCc1ccccc1CN[C@@H]1CCCCc2cc(C#N)ccc21 573657002 ODPSQGGFABUJNG-HSZRJFAPSA-N 348.490 5.041 30 20 EKED CC(C)CC[C@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588299714 BLLWQYQSVOMGDO-SFHVURJKSA-N 334.891 5.408 30 20 EKED CC(C)Oc1ccc(C#N)cc1N[C@@H](C)c1ccc(OC(F)F)cc1 604435565 FKVUUHAHCZPOLO-ZDUSSCGKSA-N 346.377 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cnccc1C 682777801 RZACWPIBLCFHAI-INIZCTEOSA-N 337.467 5.125 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1Cl 727627997 FRINMFGFCPVEIQ-ABDJAZHISA-N 346.817 5.168 30 20 EKED C/C(=C/C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)C(C)(C)C 742629397 CLSUHBMHQKAWSR-VBKFSLOCSA-N 348.446 5.068 30 20 EKED CC(=NNc1nc2ccccc2s1)c1cc(Cl)sc1Cl 744535888 TXCQSAXMZOITLP-UHFFFAOYSA-N 342.276 5.501 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1O)c1ccncc1 756585073 WYNMVASCGDOQHU-IAQYHMDHSA-N 337.250 5.062 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2ccccc2C(F)(F)F)s1 758423630 NXMTUKIYCSJJRI-BQYQJAHWSA-N 325.355 5.181 30 20 EKED C[C@H](C=NOc1ccccc1C(F)(F)F)c1cccc(Cl)c1 763370312 NZXMNROSWXPWFL-LLVKDONJSA-N 327.733 5.527 30 20 EKED CC(C)c1nc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cs1 771743329 BRNANWOYNWHVRZ-ARJAWSKDSA-N 346.502 5.348 30 20 EKED CC(C)(C#N)CCCSCc1cccc(NC(=O)OC(C)(C)C)c1 776207883 PRCLIYUZNRBFPF-UHFFFAOYSA-N 348.512 5.597 30 20 EKED CC(=NNc1ccc(C#N)c(Cl)c1)c1sc(C(C)(C)C)nc1C 783877264 HJVSFCLXAYSCNQ-UHFFFAOYSA-N 346.887 5.110 30 20 EKED C[C@@H](C=NOCc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 789036966 KQHYIPYDJXRJHI-LBPRGKRZSA-N 325.305 5.151 30 20 EKED CC/C(=C\C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 817318640 FKPUXNDNKQCXAG-RURFIKTLSA-N 332.447 5.031 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccccc2Oc2ccccc2)c1 917573500 AIDSEMYKAVZCMH-UHFFFAOYSA-N 344.439 5.269 30 20 EKED C=CCN(C(=O)c1cnc(-c2ccc(C)cc2C)s1)c1ccccc1 61137284 ZMBOZBZKWIBMEL-UHFFFAOYSA-N 348.471 5.260 30 20 EKED C[C@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 174067397 HHTJAXOPIUKPGL-LSDHHAIUSA-N 333.460 5.094 30 20 EKED Cc1cc(C)c(-c2nnc(SCCCC(C)(C)C#N)o2)c(C)c1 177292387 QUQXLTQPOSEXBM-UHFFFAOYSA-N 329.469 5.084 30 20 EKED CC(C)(C#N)CCCSc1nnc(-c2cccc3ccccc23)o1 177305698 NTZKWIVOCKIMOY-UHFFFAOYSA-N 337.448 5.312 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1Cl 189908652 QZMPLKQWGHKOBD-UHFFFAOYSA-N 327.855 5.373 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ncc(C)s1 191508226 JQDRCBMAMRNJEF-CQSZACIVSA-N 343.496 5.186 30 20 EKED C[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 443597053 YRTFTLQIIZABGI-OAGGEKHMSA-N 345.512 5.171 30 20 EKED CCCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](C)c1ccccc1 462014733 ICQLVCBXYIFZDY-ZWKOTPCHSA-N 334.463 5.052 30 20 EKED CCCCOC1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1 464852248 QRRRRDDHNXJIAT-UHFFFAOYSA-N 348.490 5.006 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=O)CCc3ccc(C#N)cc3)c2)o1 477583899 MJLWGOVMQZETPW-UHFFFAOYSA-N 344.414 5.006 30 20 EKED CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 510869745 YEGKTRLHFGUKCQ-DOTOQJQBSA-N 344.524 5.483 30 20 EKED N#Cc1cccc(CNCc2ccc(-c3ccc(Cl)cc3)s2)c1 520207439 YFADTCVNYJEHIF-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 606973536 PYKVIWCHRSXFMK-MRXNPFEDSA-N 342.405 5.068 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1nc(-c2ccccc2)cs1 618807176 VEABSVSSIXQZIM-IFXJQAMLSA-N 345.471 5.020 30 20 EKED CC1=CC(=NNc2ncnc3scc(-c4ccc(C)cc4)c23)CC1 725826626 HCUHDNYLZKLJEO-UHFFFAOYSA-N 334.448 5.175 30 20 EKED C#CCCOc1ccc(CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc1 733326383 ZQBWPPARIYVIPR-NRFANRHFSA-N 339.454 5.105 30 20 EKED Cc1cc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc(C)c1F 741466851 GFOPNENTAKHFMM-HJWRWDBZSA-N 337.394 5.021 30 20 EKED C#CC[C@@H](NC(=S)Nc1ccc(Cl)cc1Cl)c1ccccc1 756856916 NGDFQAKYJXPEIW-OAHLLOKOSA-N 349.286 5.044 30 20 EKED CC(/C=C\C(=O)c1ccc(C#N)s1)=C/c1ccccc1OC(F)F 811694230 UMLMTVQCKHXCMV-CQSVFKTNSA-N 345.370 5.064 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC 886895094 SZXCXYXXTDMMHO-LJQANCHMSA-N 347.499 5.118 30 20 EKED Fc1cc(CON=Cc2cccc(Cl)c2Cl)c2ncccc2c1 914684036 YNLBQHLWPNVOMK-UHFFFAOYSA-N 349.192 5.231 30 20 EKED CC(C)(C#N)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 917816902 XKHUFWRMSSJIMO-UHFFFAOYSA-N 333.218 5.149 30 20 EKED Cc1ccc(C2CCC(=NNc3cccc(C(=O)O)c3C)CC2)cc1 1776089807 IAWOHOYWUPXWQA-UHFFFAOYSA-N 336.435 5.127 30 20 EKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2)c1 1777686181 UQWSBYRYYOMSFS-DHZHZOJOSA-N 334.396 5.009 30 20 EKED CC(C)c1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c(C(C)C)c1 58051946 UEDOGYLTZCAYKC-INIZCTEOSA-N 349.478 5.688 30 20 EKED C=CCC(CC=C)C(=O)N1CCc2sccc2[C@@H]1c1cccs1 121497676 YRKDMZGFQVYWBO-GOSISDBHSA-N 343.517 5.052 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(F)F)c1 171819483 URQPDCSDXKSLHX-GFCCVEGCSA-N 346.402 5.271 30 20 EKED C[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1cccc(C#N)c1 193002061 RJLUMNRTQPDUKP-SJCJKPOMSA-N 328.868 5.099 30 20 EKED Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 298848096 KVGSCERHCSCPAH-INIZCTEOSA-N 335.451 5.021 30 20 EKED C=CCC[C@@H](NCc1nc(C)c(C)o1)c1ccc(C(F)(F)F)cc1 342232386 YQCDOIVYUACBMM-MRXNPFEDSA-N 338.373 5.107 30 20 EKED Cc1ccc(SCC(F)(F)F)c(N[C@@H]2CCC[C@@H](C#N)C2)c1 463289980 RKOBYBMMFNEGMH-CHWSQXEVSA-N 328.403 5.144 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2cc3ccccc3o2)C1 463301038 MBIJUTOJFKORHK-GTCCEBARSA-N 330.431 5.194 30 20 EKED CN(CC1CCCCC1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 484780711 WVIWRQDMJFHYQX-UHFFFAOYSA-N 348.446 5.003 30 20 EKED CCCC(C)(C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 522621608 GGAQOHJQFBYFHW-UHFFFAOYSA-N 337.423 5.051 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1cccc(C)c1C)c1ccccc1 534665221 SDFFSFSPGUUYKM-UGKGYDQZSA-N 333.475 5.327 30 20 EKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1ccc(C2(C#N)CC2)cc1 538522671 IMGVAGWPYYVOGC-NRFANRHFSA-N 346.474 5.020 30 20 EKED CC(C)(CCC#N)CNC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1 566729810 VTZOZZIBENQWDX-UHFFFAOYSA-N 348.490 5.077 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 588756298 PMFDPWWRHMCHBQ-UHFFFAOYSA-N 346.352 5.183 30 20 EKED C[C@@H](Nc1cccc(COC2CCCCC2)c1)c1cccc(C#N)c1 600851368 ZXFNGRRXTBTDQW-QGZVFWFLSA-N 334.463 5.581 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 609434016 XQEQQOROAQKIQD-INIZCTEOSA-N 349.434 5.004 30 20 EKED C[C@H](N[C@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 609825277 OUQOQQZCZUMABJ-YADARESESA-N 340.470 5.583 30 20 EKED CCC[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 733680926 JKWUUBJWZIFQLS-IAGOWNOFSA-N 338.451 5.391 30 20 EKED CCc1ccc([C@H](NCc2ccc(N(C)CCC#N)cc2)C(C)C)cc1 743767437 QKSPXIVPFKMDJN-HSZRJFAPSA-N 349.522 5.086 30 20 EKED N#C[C@H](C(=O)c1cc(Cl)cs1)c1nc(-c2ccccc2)cs1 759436894 NHBCBYGCSIZNEH-GFCCVEGCSA-N 344.848 5.015 30 20 EKED Cc1ccccc1[C@H](NCc1cc(Cl)ccc1OCC#N)C(C)C 775406116 FUPGVDLESOLJAQ-HXUWFJFHSA-N 342.870 5.038 30 20 EKED Cc1ccccc1[C@H](CC(C)C)N[C@H](C)c1ccc(OCC#N)cc1 776159234 WCAFFJLKNOZROF-GCJKJVERSA-N 336.479 5.335 30 20 EKED CCCCCCC[C@H](C)CN[C@@H]1CCN(C(C)=O)Cc2ccccc21 779021053 XCTLQZONZURXQB-PGRDOPGGSA-N 344.543 5.066 30 20 EKED C[C@H]1/C(=C\c2ccc(OCc3ccncc3)cc2)C(=O)c2ccccc21 809159846 XWSABSOKNLARIB-CAUNFOBBSA-N 341.410 5.044 30 20 EKED C=C(Cl)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 819930008 PXZUUDLALAYVDK-UHFFFAOYSA-N 335.306 5.161 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC2CCCC2)cc1 915349925 AZCKKMXDKQSZOO-NRFANRHFSA-N 347.462 5.044 30 20 EKED CCOc1cccc2cc(C(=O)/C=C/c3ccc4ncccc4c3)oc12 916130121 IPAYOAPVBCJZTJ-PKNBQFBNSA-N 343.382 5.276 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776120137 WSCHOBRAWVSIRI-XFXZXTDPSA-N 342.822 5.232 30 20 EKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)c(F)c1 1776784554 FLRWKIBBWJTSOV-UHFFFAOYSA-N 337.479 5.487 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)o2)c(C)c1 118177012 UXMNKGHKMIGYQN-OAHLLOKOSA-N 349.459 5.387 30 20 EKED Cc1cccc(C)c1[C@H](C)/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330019339 UXVCAYZPUAKNIM-ZLPCBKJTSA-N 342.483 5.246 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1 352199062 UJKFMBFEGWDYAM-KRWDZBQOSA-N 347.245 5.158 30 20 EKED CCC[C@@]1(C)CCCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458797812 GWWRYTAPQNOLTR-CTNGQTDRSA-N 341.499 5.033 30 20 EKED Cc1sc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)c(C#N)c1C 503132319 CAAGYWRVORNVIR-ZWKOTPCHSA-N 346.455 5.132 30 20 EKED C[C@H](SCC(=O)Nc1ccc(C#N)cc1)c1cccc2ccccc12 518014229 USWJAVQRKOQVNN-HNNXBMFYSA-N 346.455 5.144 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2ccc(F)cc2C#N)cc1 537101891 GBNZECQCKGVNMZ-AWEZNQCLSA-N 328.456 5.049 30 20 EKED C[C@H](NCCCC#N)c1ccc(-c2ccc(Br)cc2)s1 544385324 KGABBAAODDWJSM-LBPRGKRZSA-N 349.297 5.132 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 554364532 HXSMLRXBGCHNFN-IAGOWNOFSA-N 338.417 5.261 30 20 EKED C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554391606 ULBUVNARSGMAKI-WBVHZDCISA-N 341.499 5.166 30 20 EKED C=CCC[C@@H](Nc1cccc(COCc2ccco2)c1)c1ccco1 560544416 QETHMOKHTGSCTC-HXUWFJFHSA-N 337.419 5.709 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C\c1csc(-c2ccc(F)cc2)n1 731321922 OATKATOSAAPDNO-CLFYSBASSA-N 341.382 5.293 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734059814 IWTFVKFIIUIJQK-DYESRHJHSA-N 347.462 5.138 30 20 EKED CC1=CC(=NNc2nc3cc(C(F)(F)F)ccc3s2)CCC1 743445291 NIZAOOJAMUCIHA-UHFFFAOYSA-N 325.359 5.213 30 20 EKED CCc1ccc(C=NOCc2coc(-c3ccc(Cl)cc3)n2)cc1 749283673 NYWCPCQWSSCFAS-UHFFFAOYSA-N 340.810 5.108 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(OC(C)(C)C)cc2)cc1 764921343 RXNIAYXBDKCZDM-KAMPRCONSA-N 349.430 5.051 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2ccsc2)cc1 766767752 XXQMBLDXHGHHRZ-OAHLLOKOSA-N 334.444 5.318 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(SCC(F)F)cc1)c1ccccc1 773115648 NRLDSINSDSKVGH-HNAYVOBHSA-N 345.458 5.459 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)OC(=O)c1ccc(C#N)c(Cl)c1 777775964 GABDINGFHQPMMN-LLVKDONJSA-N 348.855 5.018 30 20 EKED O=C(/C=C\c1sccc1Cl)c1ccc(-c2ccncc2)cc1 782341441 JTSWRFOTHXSGDS-WAYWQWQTSA-N 325.820 5.360 30 20 EKED C[C@@H](OC(=O)CCCCC#N)c1ccc(Cl)c(C(F)(F)F)c1 846943165 MLKCMOZVODORFM-SNVBAGLBSA-N 333.737 5.047 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(Cl)nc1 189896244 KVSAPHJUOXVYFY-ZRDIBKRKSA-N 340.854 5.239 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\c2nc3cc(Cl)ccc3s2)cc1 208265990 QRNQLIGIZCMJSL-TWLAMCEISA-N 340.835 5.411 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)[S@](=O)CCCCC(C)(C)C#N 278365172 XIDVVKAWWRHDFO-XUSGNXJCSA-N 346.323 5.523 30 20 EKED Cc1ccc(C)c([C@H](NCc2cccc(C#N)c2)c2ccccc2)c1 327410042 WXMYCCGDCBUGON-HSZRJFAPSA-N 326.443 5.054 30 20 EKED COc1cc(N=C(C)O)ccc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329209890 ZGHXRSUVQYAEBO-USXIJHARSA-N 344.455 5.498 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCC(C)(C)C1 432073115 BLONMWUOYGLJML-LSDHHAIUSA-N 345.512 5.123 30 20 EKED C[C@H](SCc1cc(-c2cccs2)on1)c1cccc(C#N)c1 443143290 JQRLMBSDIUKZER-LBPRGKRZSA-N 326.446 5.269 30 20 EKED Cc1cccc(C)c1[C@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 458643180 DOVCXGJBLRAIGP-ICSRJNTNSA-N 349.478 5.099 30 20 EKED Cc1ccc(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)s2)cc1 477319790 HMMJHBPIVQTVCE-INIZCTEOSA-N 332.472 5.446 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 480669533 BVEZLXPUWTZLBK-DJJJIMSYSA-N 346.377 5.149 30 20 EKED N#C[C@H](C(=O)c1cscc1-c1ccccc1)c1nc2ccccc2o1 519847433 JIXOAJBCWHRKHS-CQSZACIVSA-N 344.395 5.046 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccccc1OCc1ccccc1 538020421 FROYPAPEFJCUFK-MRXNPFEDSA-N 348.471 5.050 30 20 EKED Cc1ccc(C)c([C@@H](NCc2ccc(C#N)s2)c2ccccc2)c1 553711808 KUNPJOHSHQHDCC-NRFANRHFSA-N 332.472 5.116 30 20 EKED C=CC[C@@H]1CC[C@H](NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C1 651672561 DUFQNKGQZKNEQY-LPWJVIDDSA-N 343.355 5.230 30 20 EKED C=CCC[C@@H](NC(=O)CCC(C)(F)F)c1ccc(C(F)(F)F)cc1 676730193 BSILJVOBHKHVQE-CQSZACIVSA-N 349.343 5.264 30 20 EKED O=C(/C=C\c1cnn2ccccc12)c1ccc(-c2ccc(F)cc2)s1 729644642 ZFCPBADRKYATKO-TWGQIWQCSA-N 348.402 5.098 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@@H]1c1cc(C)on1 737789944 NCIWQJFFKXDIFC-FIIODCPWSA-N 332.488 5.343 30 20 EKED C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 743059767 QKHFNMOIYVVKKD-INIZCTEOSA-N 341.414 5.108 30 20 EKED CC(=NNc1nc(C(F)(F)F)cs1)c1oc2ccccc2c1C 755903755 KDCGRYJSIVAJRN-UHFFFAOYSA-N 339.342 5.053 30 20 EKED Cc1ccoc1C(=O)/C=C\c1cnc(-c2ccc(Cl)cc2)s1 789144635 WIXKQPJSLVUKAY-SREVYHEPSA-N 329.808 5.261 30 20 EKED C=CC[C@H](OC(=O)CC(F)(F)F)c1ccc(Cl)c(Cl)c1 797553090 RDUPHHBDLSLJKH-NSHDSACASA-N 327.129 5.106 30 20 EKED N#Cc1sc(N2CCC[C@@H]2c2cccc3ccccc23)nc1Cl 804371584 GWMBAOMMQXZGQO-OAHLLOKOSA-N 339.851 5.163 30 20 EKED C[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1ccc2ccccc2c1O 848567502 XDNLLCHYXLRMSA-INIZCTEOSA-N 342.442 5.147 30 20 EKED N#Cc1ccc2c(c1)[C@H](Nc1cccc(OCc3ccccc3)c1)CC2 864022203 INFDXVFOMJMVTE-HSZRJFAPSA-N 340.426 5.237 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)c1cccc2ccccc12 915917507 FCXSSCUJOMVDCM-UHFFFAOYSA-N 329.325 5.090 30 20 EKED C(=NNCc1cccc2cccnc12)c1cc(-c2ccccc2)cs1 917548869 SPASOOJXZJGJLU-UHFFFAOYSA-N 343.455 5.087 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCCc2c(Cl)ccnc21)c1ccccc1 926482066 XIDUQSIRZBGDMI-RTBURBONSA-N 339.870 5.137 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1C 1777433867 GUNZKVYQXONMLX-ALCCZGGFSA-N 336.412 5.112 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2cc(C#N)ccc2F)cc1 90117365 SSUAFYGLMCPYOS-CQSZACIVSA-N 328.456 5.049 30 20 EKED N#Cc1ccc(SCc2nnc(-c3ccccc3)s2)c(Cl)c1 125823679 DVAZJVOQGLTYEM-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1csc(C(C)(C)C)n1 153883337 IIEQCCVMZCATJR-CYBMUJFWSA-N 345.537 5.447 30 20 EKED CC(C)[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 155961410 FYLCCDUAIFVDQY-DOTOQJQBSA-N 345.512 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)OC1CCCCCC1 189912581 WEXKYKFNOLOCHC-KRWDZBQOSA-N 343.511 5.605 30 20 EKED C#CCCCC(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 192245571 CYKJDMUBOZWEOS-GFCCVEGCSA-N 343.414 5.338 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(OC(C)C)cc2)ccc1SC 207746019 UADJDSNKLOXNIM-XFFZJAGNSA-N 342.460 5.100 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)s1 271515646 UDBSPVGNIPTCJQ-WFASDCNBSA-N 334.872 5.106 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCO[C@@H](C(C)C)C1 276460197 NTRKHCBUIOUPBP-YLJYHZDGSA-N 343.511 5.318 30 20 EKED Cc1cccc(C(C)(C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c1 330015667 OIOJICABPZOGOF-UHFFFAOYSA-N 342.483 5.112 30 20 EKED C[C@@H](CC(C)(C)c1c[nH]c2ccccc12)NCC(C)(C)CCC#N 462812415 NPBHMWLQCGFWAF-INIZCTEOSA-N 325.500 5.144 30 20 EKED C=CCCCC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1cccnc1 480826902 IJQXRKPQPCXNOY-HXUWFJFHSA-N 342.870 5.029 30 20 EKED CCN(C(=O)C[C@@H](c1ccccc1)C(C)C)[C@@H](C)c1ccc(C#N)cc1 482411356 XCLQLLLRTDNMRN-PGRDOPGGSA-N 348.490 5.298 30 20 EKED C=CCN(C(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1 484267810 YHSJNTHQNMYBQX-UHFFFAOYSA-N 337.806 5.433 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2ccc[nH]2)cc1 485515820 LYEUUHNTYYFKIT-UHFFFAOYSA-N 334.444 5.212 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1F 512614414 VQPBEEZQMLACPC-CVEARBPZSA-N 345.421 5.171 30 20 EKED N#Cc1ccc(NC(=O)Nc2cccc(COC3CCCCC3)c2)cc1 520737349 JKMAFFQFQJDTQM-UHFFFAOYSA-N 349.434 5.052 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1Cl 572581816 YRSKOEZUVOUUNN-LSDHHAIUSA-N 342.870 5.411 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)c1ccc(OC)cc1 584235345 PQEPVOYZCOXMAN-UHFFFAOYSA-N 338.451 5.215 30 20 EKED N#CCCCCCC(=O)N[C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1 588166428 WATPWBOZPUCAEP-RBUKOAKNSA-N 346.902 5.347 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc1 590675851 CJZVYEWIGGWKGL-AVYPCKFXSA-N 336.460 5.028 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(C)c1 596710133 ICKYBBPCFCZCCV-JKSUJKDBSA-N 345.512 5.043 30 20 EKED N#CCC[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 611337014 FSOFYIBJYMLGFX-MSOLQXFVSA-N 345.273 5.615 30 20 EKED C=CCC[C@@H](NCc1cccc(COC(C)(C)C)c1)c1ccco1 671745583 MXYKAZSFEUSYQI-LJQANCHMSA-N 327.468 5.392 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@H]1C[C@@H](O)c1cccs1 769729662 KICOIRVCJMDNQP-ZWKOTPCHSA-N 348.556 5.136 30 20 EKED CC[C@@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(C#N)cc1 774224242 NVYSNUWNHJGQTE-UXHICEINSA-N 332.447 5.045 30 20 EKED O=C1/C(=C/c2cnc(-c3ccco3)s2)CCc2[nH]c3ccccc3c21 789147039 FROIBBIJCUKKCJ-ZRDIBKRKSA-N 346.411 5.097 30 20 EKED C#CC[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccccc1 808709215 VVTJCDNEMVZJSC-RBBKRZOGSA-N 328.459 5.208 30 20 EKED CCCCCCCCCC(=O)N[C@@H]1CCO[C@@H](c2cccs2)C1 836998400 MPBAJPDNHKWNQP-IAGOWNOFSA-N 337.529 5.225 30 20 EKED O=C1/C(=C\c2csc(-c3ccccc3)n2)CSc2ccccc21 916154894 WOWHGXOBSWRIKX-UVTDQMKNSA-N 335.453 5.182 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776699962 KYXMFWVPGBSKMQ-ANYFNZRUSA-N 348.851 5.509 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776805999 PVEQJWCQWWEHJA-XFFZJAGNSA-N 348.398 5.370 30 20 EKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCCCC(C)(C)C#N)cc1 177616235 PFSKTQSWCJZQHB-OAHLLOKOSA-N 345.487 5.014 30 20 EKED N#C[C@@H](Sc1nnc(-c2cccc3ccccc23)o1)C1CCCCC1 303916436 SEPMTICYJMBQQP-GOSISDBHSA-N 349.459 5.454 30 20 EKED C[C@@H]1C(=O)CC[C@H](C(O)=Nc2ccc3c(Cl)cccc3n2)C1(C)C 329335989 XWSMIDCTJNVLQX-DGCLKSJQSA-N 344.842 5.118 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccccc1F)c1ccccc1 435095607 IOSRSFUJTCJEPO-UZLBHIALSA-N 340.442 5.236 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2cc(SC)ccc2C)CCCC1(C)C 444944136 QPRKACYSDZYAPR-KRWDZBQOSA-N 332.513 5.316 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1C(C)C 475581580 PGNZQXQNVZAULI-LJQANCHMSA-N 328.500 5.581 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485724295 QZHBDJNNHZPQEF-ZDUSSCGKSA-N 347.817 5.066 30 20 EKED C=CC[C@H](C(=O)Nc1ccc2nc(C3CC3)oc2c1)c1ccccc1 489670863 BZJSBFAVUDMKRR-KRWDZBQOSA-N 332.403 5.004 30 20 EKED C[C@@H](c1ccccc1)N(C(=O)c1cccc(CC#N)c1)c1ccccc1 502745780 XLUDDXYNLZAIAZ-SFHVURJKSA-N 340.426 5.161 30 20 EKED CC(C)OCc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 539929236 QMFGPDZCJSKODL-UHFFFAOYSA-N 348.490 5.428 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2F)s1 554360021 OARUTRVVBDKZPX-CQSZACIVSA-N 330.472 5.535 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 559864130 NPZUVFDVPDWEDJ-IFMALSPDSA-N 343.474 5.570 30 20 EKED Cc1cc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c(C)s1 571575371 GNHPBXIYHFSJGF-LLVKDONJSA-N 338.398 5.106 30 20 EKED CC1=C(C)C[C@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 581192299 KUTOSUSOSJBLTC-JKSUJKDBSA-N 328.481 5.156 30 20 EKED Cc1cc2occ(CC(=O)Nc3ccccc3CC#N)c2cc1C(C)C 583013430 ZJUXMOFGDHWBPT-UHFFFAOYSA-N 346.430 5.112 30 20 EKED N#CCCCCCC(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 588371153 KMPPBNQQVSMJHZ-IBGZPJMESA-N 332.875 5.162 30 20 EKED C[C@H](SCC1(C#N)CCC1)c1nnc(-c2ccc3ccccc3c2)o1 601055852 CYTRPCVXLDKUHM-AWEZNQCLSA-N 349.459 5.378 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc2cc(OC)ccc2c1 610829870 QCYQYAYRSDGRMV-MWTRTKDXSA-N 344.458 5.522 30 20 EKED Cc1ccc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] 734982155 XYBTWVGYQFANBI-BQYQJAHWSA-N 336.174 5.106 30 20 EKED C[C@H](N[C@@H](C)c1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 751924370 PDTZZKMRMHLZRN-STQMWFEESA-N 332.419 5.285 30 20 EKED C[C@@H](ON=Cc1cccc(Cl)c1Cl)c1ncc(C(C)(C)C)o1 756850629 XLGVZXDVQBAZHB-SNVBAGLBSA-N 341.238 5.391 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N[C@@H]1CCCc2nc(O)ccc21 774812287 ZVKAWAOJBFPHQW-VQIMIIECSA-N 346.515 5.058 30 20 EKED Cc1ccc(Cc2ccccn2)cc1NCc1ccc(Cl)cc1C#N 800879365 XHYDTWNGPYYXAA-UHFFFAOYSA-N 347.849 5.118 30 20 EKED C=CCN(C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(C)C 815398456 IZIWCQLJSQOVAC-UHFFFAOYSA-N 337.341 5.002 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NC[C@@H]1CCC(F)(F)C1 926343930 HWIQWPRKEVQZBV-SECBINFHSA-N 341.286 5.065 30 20 EKED C/N=C(/O)c1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1Cl 328989934 HYQBWNHVTQEZMN-NWANDNLSSA-N 348.874 5.469 30 20 EKED CC(C)[C@H]1C[C@H](C/C(O)=N/[C@@H](C)c2ccc3ncsc3c2)CCO1 330121011 GRLWQOACECDGJW-JJRVBVJISA-N 346.496 5.155 30 20 EKED C=CCC[C@H](NCc1ccc(-c2csc(C)n2)o1)c1ccco1 353402078 JQKNEZCRKUWBCH-HNNXBMFYSA-N 328.437 5.102 30 20 EKED N#Cc1cccc(SCc2csc(-c3ccccc3F)n2)c1 435031708 CVZZVLNZXXSIPZ-UHFFFAOYSA-N 326.421 5.113 30 20 EKED C=CCC[C@H](NC(=O)c1occc1C)c1ccc(C(F)(F)F)cc1 441588865 MISNJOCIQAOOER-HNNXBMFYSA-N 337.341 5.044 30 20 EKED Cc1cc(CNc2cccc(CSc3ccccn3)c2)ccc1C#N 444003116 LXJBWYIEOTZGQW-UHFFFAOYSA-N 345.471 5.166 30 20 EKED CC(C)CC[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458806827 WOQNDFPDOAWVPL-PMACEKPBSA-N 341.499 5.032 30 20 EKED COc1ccc(Cl)cc1CNc1ccccc1S[C@H](C)CC#N 466387426 JVNHVNMPOGWKDO-CYBMUJFWSA-N 346.883 5.355 30 20 EKED CC(C)[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 482414866 NIBJDMRZTRMMML-JOCHJYFZSA-N 348.490 5.125 30 20 EKED C[C@H](C(=O)Nc1ccccc1Nc1ccccc1)c1cccc(C#N)c1 486990547 XMGBDRLEKKARLD-INIZCTEOSA-N 341.414 5.044 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)c(F)c1 489889973 XMVPRXZGWMSSSO-ZIAGYGMSSA-N 336.385 5.401 30 20 EKED CCCNc1ccccc1NC(=O)c1sc2ccc(C#N)cc2c1C 498913676 OWXJTQIHBDRQNE-UHFFFAOYSA-N 349.459 5.156 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(C)C 519904866 HIQFWFSTGWEKKP-UHFFFAOYSA-N 349.478 5.372 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)c(F)c1 537407153 IYJCPKVHPFHDGQ-OYHNWAKOSA-N 348.396 5.277 30 20 EKED N#Cc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1Cl 548288307 XZIDFGSKNGUBJD-UHFFFAOYSA-N 341.144 5.055 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 550826190 BMASHXZRWDNELB-FDDCHVKYSA-N 328.459 5.926 30 20 EKED C[C@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccsc2S1 551205765 MDNRCZHJYVSMCT-WBAXXEDZSA-N 342.533 5.698 30 20 EKED C[C@H]1CCC[C@@H](OCc2cccc(NCc3ccc(C#N)s3)c2)C1 552554252 BFTWLKZPXMXLBF-MAUKXSAKSA-N 340.492 5.327 30 20 EKED Cc1ccc2oc(-c3noc(C[C@H](CC#N)c4ccccc4)n3)cc2c1 570855273 LHYSMKJPMBYQCM-INIZCTEOSA-N 343.386 5.031 30 20 EKED N#CC1CCC(CNCc2ccc(-c3ccc(Cl)cc3)o2)CC1 574475406 GPJNABUOEBEYBX-UHFFFAOYSA-N 328.843 5.020 30 20 EKED Cc1ccnc2ccc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)cc12 576904031 WANABZBKHIEXRA-UHFFFAOYSA-N 349.459 5.026 30 20 EKED CC(C)c1ccc(C2(CNC(=O)CCCCCC#N)CCCC2)cc1 588157469 WAARBQSQKGNFNC-UHFFFAOYSA-N 340.511 5.212 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 594011070 VPNNDIKZEPEYBY-KRWDZBQOSA-N 348.490 5.451 30 20 EKED N#C[C@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccccn1 642280773 KVWMTIFWDYQLJD-VIFPVBQESA-N 347.226 5.093 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(-c2ccc(F)cc2)s1 728697955 ADHXTVVFFSFYQM-VMPITWQZSA-N 343.810 5.499 30 20 EKED COc1ccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)cc1 732714363 YDIWGZNSOYEQSQ-VZUCSPMQSA-N 345.398 5.087 30 20 EKED CCc1c(C(C)=NNc2cccc(C(F)(F)F)n2)oc2ccccc12 739421189 GKOUEWPIEAUFMM-UHFFFAOYSA-N 347.340 5.245 30 20 EKED CC(=NOCc1cccnc1)c1ccc2c(c1)Nc1ccccc1S2 746576748 MYKWFDBIFLYHNE-UHFFFAOYSA-N 347.443 5.231 30 20 EKED CCCC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCC1 759541355 YBYIOSTUWFAYRH-GFCCVEGCSA-N 332.856 5.096 30 20 EKED CCCC(=CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)CCC 771282320 IRZARVIFVIMDLS-CQSZACIVSA-N 330.428 5.138 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cc(Cl)sc2Cl)cn1 806567166 FGUHQBPPYWNVDQ-PLNGDYQASA-N 341.263 5.039 30 20 EKED N#CCCCOc1cccc(CNc2ccc(F)c(C(F)F)c2)c1 865757942 RWTRFFFJMBYPSW-UHFFFAOYSA-N 334.341 5.058 30 20 EKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)[C@H](C)Cc1ccccc1 1776034772 YAHRZYQOBQVRDL-CYBMUJFWSA-N 344.842 5.095 30 20 EKED CCSc1cccc(C(=O)Nc2ccccc2SCCC#N)c1 153995795 STBUCESSMJWXFW-UHFFFAOYSA-N 342.489 5.057 30 20 EKED Cc1ccc(-c2noc([C@@H](C)SCCCC(C)(C)C#N)n2)cc1F 161440386 YYOBAWDCIJADBM-CYBMUJFWSA-N 347.459 5.308 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCCCCC#N 171383570 JHSFDBOTNYFSSA-UHFFFAOYSA-N 345.512 5.235 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)[S@](=O)CCCC(C)(C)C#N 177118031 HGDRLWCHKAWVBP-BIBXISHDSA-N 332.296 5.133 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)OC 191422698 OGDCSPYIQSDRGT-UHFFFAOYSA-N 338.451 5.134 30 20 EKED N#CCC1(CNC2CCC(c3cccc(C(F)(F)F)c3)CC2)CC1 430764532 SIGKLQAPRJIRQF-UHFFFAOYSA-N 336.401 5.015 30 20 EKED CC[C@H](F)CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 440493814 YDBKTNFBBULBBS-RYUDHWBXSA-N 331.275 5.037 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1 443155556 QGMYDNVUMAFSSB-OLZOCXBDSA-N 344.867 5.033 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2ccc(C#N)s2)o1 477910876 GUSMBEGTJOITQR-UHFFFAOYSA-N 342.807 5.094 30 20 EKED CC(C)c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 502258590 OLMJPMJEZGNCAV-UHFFFAOYSA-N 337.423 5.137 30 20 EKED C=C[C@H](CC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccccc1 534982964 XNODCQQWERVNKN-JKSUJKDBSA-N 337.467 5.030 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 539497208 YOCSPCROMONZAV-VBKZILBWSA-N 336.435 5.199 30 20 EKED COc1ccc([C@H](C)[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 563671531 YWNOZGHCXQWQJZ-HMFYCAOWSA-N 336.479 5.212 30 20 EKED C[C@@H](NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 567063534 HFMRSDQWVHLICQ-MRXNPFEDSA-N 346.405 5.340 30 20 EKED C[C@H](C#N)CSc1ccccc1NCC#Cc1ccccc1Cl 574896990 VOYGIHDAPBSMAW-OAHLLOKOSA-N 340.879 5.055 30 20 EKED CC(C)N(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CCCC1 577800318 PSBQGVYFKCRASN-UHFFFAOYSA-N 347.462 5.095 30 20 EKED C=CCCCCCN(C)C(=O)c1ccccc1SCc1ccco1 606816062 LVYCRGRUOSSJJB-UHFFFAOYSA-N 343.492 5.390 30 20 EKED Cc1ccc(F)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609985816 LSTAEKIAZODHIZ-UHFFFAOYSA-N 345.377 5.002 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cnc(OC)c(Cl)c1)c1ccccc1 671298263 LMLNIIMMVASBLU-RDTXWAMCSA-N 330.859 5.102 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc3ccccc23)cc1 728694731 HIFHVMVFDWBLSB-SYCZXOQXSA-N 327.383 5.027 30 20 EKED CC(C)n1ncc2cc(N=Cc3cc(Cl)cc(Cl)c3O)ccc21 735228513 CPLPECCMLASPRX-UHFFFAOYSA-N 348.233 5.380 30 20 EKED Cc1ccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)COC4)o2)cc1 742436947 OXFKGXHHCPOBRQ-CSKARUKUSA-N 330.383 5.181 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(F)c(Cl)c1Cl 762455163 PRYASFCNVYSVGU-JTQLQIEISA-N 339.197 5.035 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc(Br)ccc1F)c1ccccc1 773117141 UDZHJTLDETVWSY-FZKQIMNGSA-N 346.243 5.003 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1O 775513124 NVYOLURGBGYYEM-ZBEGNZNMSA-N 349.261 5.373 30 20 EKED N#C[C@@H]1CC[C@H](Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 799724422 MFEDGLNHFOBRIG-AGIUHOORSA-N 341.307 5.077 30 20 EKED C=C[C@H](CC(=O)O[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803060432 VZUIYMRRGQFYOD-UONOGXRCSA-N 349.352 5.065 30 20 EKED CCOc1cc(/C=C\C(=O)c2cccc3ccccc23)ccc1OC 916134831 JAAKIOIJQACJAT-QBFSEMIESA-N 332.399 5.143 30 20 EKED CCCC[C@@H](CC)CC(CC)=NNc1ccc(C(=O)O)cc1OC 1776051569 PWEBPRVVVIYIFW-CQSZACIVSA-N 334.460 5.178 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 41537679 NGXUOHCXMPKDOI-YJBOKZPZSA-N 346.455 5.180 30 20 EKED CCc1c(C(=O)/C=C/c2c(C)nn(CC)c2C)oc2ccc(C)cc12 60378427 SRGAHMGMLUTRQY-MDZDMXLPSA-N 336.435 5.033 30 20 EKED C[C@H](SCCC(=O)Nc1ccccc1Cl)c1ccc(C#N)cc1 118446332 PUDWYYBCJNLXRA-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 445988388 NQSMRACMXBXXBA-DLBZAZTESA-N 338.417 5.261 30 20 EKED CC1(C#N)CCC(Nc2cccc(CSc3ccccn3)c2)CC1 449048427 GIDQKPRREMZGMN-UHFFFAOYSA-N 337.492 5.258 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 467516291 IJTQQLDNKQAAFC-UHFFFAOYSA-N 345.364 5.478 30 20 EKED COc1ccc2c(c1)CN(CCCC(C)(C)C#N)[C@@H](c1ccccc1)C2 469026295 OMCPMFBHBPCHPO-JOCHJYFZSA-N 348.490 5.125 30 20 EKED C[C@@H](N(Cc1ccccc1)C(=O)Nc1ccc(CC#N)cc1)C(C)(C)C 469475427 ZQLZTTIWBXOPLR-QGZVFWFLSA-N 349.478 5.221 30 20 EKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 476037941 BWSWXQBCWAIZNF-CQSZACIVSA-N 347.245 5.044 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c2ccccc2n1 476110852 NTQAZLPVMPFXCB-UHFFFAOYSA-N 344.458 5.647 30 20 EKED C=C[C@@H](CC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 478542039 LHNAPTGJCHMGLS-QSFXBCCZSA-N 339.866 5.062 30 20 EKED C=CCCO[C@@H](C)c1nc(-c2cccc(Oc3ccccc3)c2)no1 504597993 ORZYNTYAZYOSSK-HNNXBMFYSA-N 336.391 5.183 30 20 EKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(C#N)cc3F)c2)cs1 512613247 REDVMPGUXQGPSZ-LBPRGKRZSA-N 337.423 5.302 30 20 EKED CCCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(OC)cc1 512620689 SDAVHVSIDJBYAT-YCRPNKLZSA-N 340.442 5.288 30 20 EKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(C#N)cc1 542936549 SLAOMEAIUKYYHY-NSHDSACASA-N 332.350 5.302 30 20 EKED CC(C)c1ccc(CC2CCN(C(=O)CCCCCC#N)CC2)cc1 588164025 CIGXRSYWNYJXFH-UHFFFAOYSA-N 340.511 5.065 30 20 EKED C[C@@H](Nc1ccccc1NC(=O)C[C@H]1C=CCC1)c1cccc(C#N)c1 601920387 GAZQIZPIOZQESD-SJORKVTESA-N 345.446 5.026 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCF)CC1 640048771 JKGDPYHEPLSEBA-UHFFFAOYSA-N 332.463 5.142 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)CCc2ccc(C#N)cc2)cc1 726761287 WIHXZYSENZBQAJ-UHFFFAOYSA-N 338.476 5.020 30 20 EKED CC[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 734078918 FIOQAKOAIKASFP-HZPDHXFCSA-N 340.492 5.469 30 20 EKED CCC(CC)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccs1 776161694 ZIDGYUHUHBVAGK-YWZLYKJASA-N 342.508 5.479 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(C(F)(F)F)cc1 788096346 AWUXCZRZXDANBF-BQYQJAHWSA-N 349.333 5.318 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCCCCC1 836389176 YAXDLLURAYOIFX-MRXNPFEDSA-N 345.512 5.269 30 20 EKED O=C(/C=C\c1ccc(C(=O)O)s1)c1cc2c(ccc3ccccc32)o1 1777569864 WLWPGXRUKFPKAM-VURMDHGXSA-N 348.379 5.242 30 20 EKED CC[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccccc1 6121792 GFGXDPAZANFFRO-OAHLLOKOSA-N 338.476 5.021 30 20 EKED Cc1csc([C@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)n1 41521727 JIMCNILSWBBAEB-MRXNPFEDSA-N 346.411 5.149 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)c2ccc3ccccc3c2)n1 84695990 XAIBETWTKWQCOH-KSSFIOAISA-N 348.471 5.400 30 20 EKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 131163188 GZZDQJYAECZMAX-JQVXPOPVSA-N 344.867 5.200 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 188563890 HLBJLIFPTPKLPP-LJQANCHMSA-N 346.430 5.257 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)cc1Cl 329032969 XSJYXVLRMHPHPM-FVQBIDKESA-N 348.874 6.142 30 20 EKED C[C@@H](N[C@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 376868187 YJBMDIFIDWXGAB-IAGOWNOFSA-N 327.431 5.032 30 20 EKED N#CCCC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 431514191 XOGJNBVPKDLYFA-HNNXBMFYSA-N 329.787 5.095 30 20 EKED CCCN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 475904156 XJPGPFWKFMBGNP-QGZVFWFLSA-N 340.854 5.171 30 20 EKED C=CCC(C)(C)C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 476728428 APHOEYXENWRXEB-UHFFFAOYSA-N 339.401 5.014 30 20 EKED C=C(C)[C@@H](NC(=O)c1scc(C)c1Cl)c1ccc(F)c(F)c1 480422402 UAWOSTWVQBLHCP-CQSZACIVSA-N 341.810 5.035 30 20 EKED CC(C)(C#N)CCCNC1(c2cc(C(F)(F)F)ccc2Cl)CC1 485025455 JORUBCOGCFYFFF-UHFFFAOYSA-N 344.808 5.267 30 20 EKED C[C@H](Nc1cccc(Cl)c1OCC(F)F)c1cccc(C#N)c1 487487905 SZNJNZCJXLBDAS-NSHDSACASA-N 336.769 5.029 30 20 EKED CCN(C(=O)c1ccc2ccccc2c1)c1ccc(C#N)c(Cl)c1 534384072 NHHGDMCVQYYBEM-UHFFFAOYSA-N 334.806 5.032 30 20 EKED Fc1ccc([C@@H](CC(F)(F)F)NCCCCC(F)(F)F)cc1 537078889 VVIMLWYIUNBVMD-GFCCVEGCSA-N 331.275 5.141 30 20 EKED CCC[C@H](NCCCSCC#N)c1ccc(Cl)c(Cl)c1 538158988 JTVXQZXNNRCUAC-HNNXBMFYSA-N 331.312 5.071 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 563643132 UBLPEWKZOPIDAL-PGRDOPGGSA-N 336.479 5.560 30 20 EKED CCC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 583665908 SRQBHPMEEKSXEX-GOSISDBHSA-N 332.369 5.208 30 20 EKED N#CCCCCCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 588299861 NCPSEYSXJCDNFW-INIZCTEOSA-N 339.266 5.131 30 20 EKED COCCSc1ccc([C@H](C)Nc2cc(Cl)ccc2C#N)cc1 609892902 IZERGSISZFUIFO-ZDUSSCGKSA-N 346.883 5.123 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cccc(Br)c1 610830286 KAOCDGQRPZVATR-UGSOOPFHSA-N 343.268 5.123 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(SCc2ccccc2)cc1 614556900 ZQWWQKCNZBSUBE-UHFFFAOYSA-N 325.477 5.017 30 20 EKED Cc1ccc([C@@H](NCc2ccc(C#N)c(Cl)c2)C2CCCC2)o1 619755382 GXQGKMFKOCJTMZ-IBGZPJMESA-N 328.843 5.134 30 20 EKED Cc1cccc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)c1C 734305645 ZANSBLLPPFDCNI-FLIBITNWSA-N 343.426 5.174 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)COC2 742435593 VSMGBEFWPKHGOT-MDWZMJQESA-N 326.395 5.280 30 20 EKED CC1(C)CCC[C@H](CC(=O)[C@@H](C#N)c2nc3ccccc3s2)C1 756506088 SUVRQOMPUDWFNY-ZIAGYGMSSA-N 326.465 5.079 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 765333479 VFZBKXPGULHXJL-HZPDHXFCSA-N 340.854 5.101 30 20 EKED CC[C@H](NCc1ccc(N2CCC(C)CC2)cc1)c1ccc(C#N)cc1 774172893 FPGRTZYCXSOQQY-QHCPKHFHSA-N 347.506 5.035 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(-c2ccncc2)cc1 782343138 VCJKRTGTZRLUJH-WAPJZHGLSA-N 336.394 5.193 30 20 EKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(SC(C)(C)C)cc1C 782403364 NGJMOFAFHKXQRO-LJQANCHMSA-N 335.513 5.053 30 20 EKED CC(/C=C/C(=O)c1ccnc(F)c1)=C\c1ccccc1C(F)(F)F 794720814 IEEWPSQMNCDBSQ-AOQSKOSGSA-N 335.300 5.082 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)o1)c1ccc(F)cc1F 916127517 BSTJBBRLNPDHAS-TWGQIWQCSA-N 328.289 5.260 30 20 EKED CSc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 24392138 BVNOQFJJNZXSRY-UHFFFAOYSA-N 344.439 5.199 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccsc1Cl 189294809 WSTQEUQNUKMHAB-UHFFFAOYSA-N 347.292 5.337 30 20 EKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1F 303436994 ABOZSNFPCQYYMR-INIZCTEOSA-N 346.405 5.449 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)N(C)[C@@H](C)CC#N)c1 435180277 DKPRHGLDHNZJEH-AWEZNQCLSA-N 341.842 5.081 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)CS[C@H](C)c1cccc(C#N)c1 443126846 AITSGTGSNQXFCT-CQSZACIVSA-N 334.444 5.025 30 20 EKED N#CC[C@H](CC(=O)N(c1ccccc1)C1CCCC1)c1ccccc1 483478864 DAUMCTOAFYJFQF-LJQANCHMSA-N 332.447 5.050 30 20 EKED N#CCc1ccc(NC(=O)N2CCC[C@@H]2CCC2CCCCC2)cc1 495113335 YLGWLDUHQYHIJT-HXUWFJFHSA-N 339.483 5.109 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccccc1Oc1ccccc1 508079472 QEGBDQNXKOVMDD-QGZVFWFLSA-N 328.415 5.201 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cc(C#N)ccc1F 520174207 YVZDIIMVTCECRA-NSHDSACASA-N 337.225 5.197 30 20 EKED N#CCCC[C@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1 570150346 YUCCIAHBNNQSRL-DEOSSOPVSA-N 340.470 5.878 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(C)CCCCC1 570246929 COARLUCEASEDGP-OAHLLOKOSA-N 345.512 5.030 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccc(Cl)s3)cc2)ccn1 573610124 JYMASUFQNHKPGJ-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CC[C@H](C#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 593447352 DEGJUJUSVAKIJV-ZIAGYGMSSA-N 341.842 5.001 30 20 EKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccccc1 602774130 BPHSNDAULLIOHO-AWEZNQCLSA-N 338.476 5.021 30 20 EKED Cc1ccc(C)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603968416 OUYGRCDSJOJVRF-UHFFFAOYSA-N 332.428 5.156 30 20 EKED Cc1cc(C)cc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)c1 730437575 SNHOWQMWAODFQN-VMPITWQZSA-N 343.426 5.174 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@H]1c1cc(C)no1 737801424 CDCZOZBRWSBRRF-RMHQSFGDSA-N 332.488 5.343 30 20 EKED CCCN(C(=S)Nc1ccccc1C#N)[C@@H](CC)c1ccccc1 745678181 FQNROUSBAXNXIH-IBGZPJMESA-N 337.492 5.118 30 20 EKED CC[C@@H](C)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 755308185 JYCNAJABTKWQBJ-OAHLLOKOSA-N 338.476 5.458 30 20 EKED C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 758473396 LWCGZNOFZXNMFO-QGZVFWFLSA-N 337.385 5.137 30 20 EKED C=CC[C@H](N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 766020432 PJDDHELVAXUQSY-KXBFYZLASA-N 349.503 5.482 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2C=CCCC2)cc1 777520841 SUKZRRRWCPJHHW-UTKZUKDTSA-N 330.431 5.027 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)C#Cc1ccc(C(F)(F)F)cc1 790718538 SGAVEILHTPJDFB-UHFFFAOYSA-N 345.364 5.127 30 20 EKED Fc1cccc(Cl)c1C=NNc1ccnc2cc(Cl)ccc12 916269567 YTVFCINUFPWJLS-UHFFFAOYSA-N 334.181 5.127 30 20 EKED O=C(O)c1ccccc1NN=C(CC1CCCC1)CC1CCCC1 1776032097 NCLHWMWZQARSFC-UHFFFAOYSA-N 328.456 5.313 30 20 EKED Cc1ccc(-c2cccc(/C=C\C(=O)c3cccc(C(=O)O)c3)c2)cc1 1777429668 DYSOKDWXIUJCLB-RAXLEYEMSA-N 342.394 5.256 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 181322708 NSAMOIHJWIHEMY-DLBZAZTESA-N 327.431 5.032 30 20 EKED C=C(C)[C@H](N[C@@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 186448086 RZYUNLVCIUNREG-SJORKVTESA-N 334.435 5.014 30 20 EKED Cc1ccc(C)c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 191949335 FSBAGTWZSJKCPL-OAHLLOKOSA-N 339.464 5.342 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1cccs1 303177088 STUVJOHOCWWTTH-CMDGGOBGSA-N 329.421 5.215 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)c(F)c(F)c1 340450349 MMSVDIXPYCFBIN-UGSOOPFHSA-N 332.369 5.190 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(Br)cc1)c1ccc(C#N)cc1 447541261 FYLXMAFKSDVPOY-UGSOOPFHSA-N 343.268 5.123 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H]3CC[C@@H](CC#N)C3)s2)cc1 453290638 KVYVNGUHBGLDIG-HFTRVMKXSA-N 339.508 5.160 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1COCc1ccccc1 467824635 AMVNZQXTZIVDKM-UHFFFAOYSA-N 335.447 5.110 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H]1CC=CCC1 475553935 GXEXCJJZWBRKLU-KRWDZBQOSA-N 326.484 5.359 30 20 EKED N#Cc1ccc(Oc2cccc(NCc3ccc(F)c(F)c3)c2)cc1 524231566 RZACNGMITPWROK-UHFFFAOYSA-N 336.341 5.241 30 20 EKED N#Cc1ccc(SCc2csc(-c3cccs3)n2)c(F)c1 525628810 HSZJNGOQOCHFQB-UHFFFAOYSA-N 332.450 5.175 30 20 EKED CC[C@@H]1C[C@@H](CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542946666 XNTUBDNELAEQOQ-HFJQGTKSSA-N 348.490 5.081 30 20 EKED C=CCC(C)(C)C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 550009321 YVNCRGAVQSLXHV-UHFFFAOYSA-N 330.815 5.068 30 20 EKED N#Cc1cccc(CSc2nc(-c3ccco3)nc3ccccc23)c1 589575063 DBVWOGSDDACDDD-UHFFFAOYSA-N 343.411 5.054 30 20 EKED Cc1cccc2sc(C(=O)N(CCC#N)CC(C)(C)C)c(Cl)c12 609191456 AMXUZRLBZKJNIO-UHFFFAOYSA-N 348.899 5.265 30 20 EKED CC(C)C[C@H](C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 727953789 GNLUVHLRFHNILX-AAEUAGOBSA-N 334.872 5.198 30 20 EKED N#CCC[C@@H](C#N)CNc1cccc(-c2ccc(Cl)c(Cl)c2)c1 732917177 GFGOTPIBPIZZFS-ZDUSSCGKSA-N 344.245 5.516 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc2c(cnn2C(F)F)c1 746521263 GJYIJUKVGXMYNP-UHFFFAOYSA-N 337.329 5.041 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1c(C)cccc1F 789456183 NJHJJDLMZVNCFI-UHFFFAOYSA-N 340.442 5.308 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3coc(C(C)C)n3)s2)cc1 806559667 DTESBRUZPMDNGZ-CMDGGOBGSA-N 338.432 5.126 30 20 EKED CC(=NNc1cccc(C(F)(F)F)c1)c1nc2ccccc2s1 917562474 AXXRQOJVELIJID-UHFFFAOYSA-N 335.354 5.151 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Cl)cc1Cl 1776784073 IZOUOLOKPXBLQA-OAHLLOKOSA-N 346.298 5.287 30 20 EKED N#CCc1ccc(NC(=O)c2cc3sc4ccccc4c3s2)cc1 16495887 BQHPDDGGXRXITP-UHFFFAOYSA-N 348.452 5.434 30 20 EKED C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1cccc(C#N)c1 193002033 RJLUMNRTQPDUKP-YVEFUNNKSA-N 328.868 5.099 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(Cl)s1 209743041 YCSYVKPCQPRBQB-ARJAWSKDSA-N 337.878 5.483 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(C)(C)C 263869303 DIIZCFFNEQUJNP-UHFFFAOYSA-N 349.478 5.298 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccsc2C1 276382264 GVVOGTBXVDYFIM-UHFFFAOYSA-N 340.492 5.190 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cccc(N2CCCC2=O)c1)c1ccccc1 358325566 FIXWYWBUPYCFAR-XMSQKQJNSA-N 348.490 5.172 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 421112376 DBMQLFWFIATIKU-AWEZNQCLSA-N 340.389 5.002 30 20 EKED N#CCCC[C@H](NCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 433016684 SYKRJQJSMMUTAA-FQEVSTJZSA-N 349.409 5.005 30 20 EKED C=CCC[C@H](NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 435290886 SOYZKMRUVJYHOD-BBWFWOEESA-N 339.401 5.179 30 20 EKED CC[C@H]1CC[C@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 439119240 QFHKORBDYPHXCR-BZUAXINKSA-N 330.497 5.236 30 20 EKED CCOc1cccc([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)c1 481927505 YDCFBTUKLHJXNT-AOMKIAJQSA-N 334.463 5.075 30 20 EKED CC[C@@H](C)n1c(SCc2cccc(C#N)c2)nnc1-c1ccccc1 504283125 ZCIAQDKXQQWAAL-OAHLLOKOSA-N 348.475 5.080 30 20 EKED CC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(C)cc1 513983745 TWKSAJJUEAVLSN-IBGZPJMESA-N 335.451 5.069 30 20 EKED C=CCCCN(C)C(=O)Nc1ccccc1Oc1ccccc1Cl 523026513 ZQJDSFQTFQKQNY-UHFFFAOYSA-N 344.842 5.562 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(F)cc1 539217113 JVEQRKXEFMHZQU-MRXNPFEDSA-N 330.406 5.215 30 20 EKED N#CCCSc1ccccc1NC(=O)c1ccc(C2=CCCC2)cc1 589402448 WTLGYEAWNLCUQX-UHFFFAOYSA-N 348.471 5.512 30 20 EKED C[C@@H](NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccc(C#N)c(F)c1 593719921 JGUPQIGPMYNOOV-GFCCVEGCSA-N 348.343 5.056 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3)cc2Cl)cc1 604026852 JCSATBMJTDYNSO-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C=C[C@@H](CC(=O)N1CC2(CC=CC2)[C@H]1c1ccccc1)c1ccccc1 649154761 UMDFZTGAGBNVEB-WMZHIEFXSA-N 343.470 5.266 30 20 EKED CC(=NNc1cc(C)ncn1)c1ccc(-c2ccccc2Cl)s1 731934955 LPJXUUKDLWMJJK-UHFFFAOYSA-N 342.855 5.003 30 20 EKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=S)Nc1ccccc1C#N 740773486 SRISTZOITZFUDG-INIZCTEOSA-N 349.503 5.118 30 20 EKED CC(C)c1cnc(CNc2cccc(Oc3ccc(C#N)cc3)c2)o1 754307777 RKDLYDRMZVOOMT-UHFFFAOYSA-N 333.391 5.074 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1c(Cl)cccc1Cl 754723805 KAOSHJYBLGZHQN-UHFFFAOYSA-N 334.124 5.425 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1ccc(C(F)(F)F)cc1 772805505 IGIQCYBGPMAQOU-YFHOEESVSA-N 327.305 5.150 30 20 EKED C=CCC[C@@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 778597369 CUPNPOPKLULJMT-WOJBJXKFSA-N 340.426 5.161 30 20 EKED COc1ccccc1CON=C[C@H](C)c1ccc(C(F)(F)F)cc1 789054330 JWBSMYFGXQBSSJ-ZDUSSCGKSA-N 337.341 5.020 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C(F)=C\C2CCCCC2)s1 816068313 PLEFWPMFPDVUKY-FYQHACEVSA-N 334.460 5.051 30 20 EKED COc1cccc(-c2nc(/C=C3/CCc4ccccc4C3=O)cs2)c1 916135718 KRYDWESDLRDALV-PTNGSMBKSA-N 347.439 5.031 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(OC(F)F)c(F)c1 917557140 YWCZIIUIUHFVME-UHFFFAOYSA-N 331.293 5.037 30 20 EKED C[C@H](SCc1nnc(-c2ccccc2)s1)c1ccc(C#N)cc1 127564449 MLSNFUNJGLLBJB-ZDUSSCGKSA-N 337.473 5.071 30 20 EKED Cc1csc(-c2ccc(N[C@H](C)c3ccc(OCC#N)cc3)cc2)n1 183015593 DQAAJMMUWXGBGG-OAHLLOKOSA-N 349.459 5.194 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2ccc(OC3CCCC3)c(Cl)c2)CCC1=O 328905570 AWIXTEPUYYDXPG-QWHCGFSZSA-N 349.858 5.255 30 20 EKED Cc1cc(Cl)c(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1C 352217498 KFUBNRDOMKTNSD-LJQANCHMSA-N 340.854 5.122 30 20 EKED C[C@H](Nc1ccc(NC(=O)CCCC#N)cc1Cl)c1ccccc1 461915302 GZVQXTAEICHVDA-AWEZNQCLSA-N 341.842 5.145 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1cc2ccccc2s1 481062139 QKFHMXBIWOGRDE-GFCCVEGCSA-N 326.852 5.277 30 20 EKED N#CCC[C@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1 533360185 RWYNYHVOJATEMU-QHCPKHFHSA-N 326.443 5.488 30 20 EKED N#CCc1ccc(C(=O)Nc2ccccc2Sc2ccccc2)cc1 536087536 HGPSEHPJJZWTOP-UHFFFAOYSA-N 344.439 5.156 30 20 EKED Cc1ccccc1[C@@H](C)N(CCCC1(C#N)CCOCC1)CC(C)C 551716618 YMTLZKVYZJZISL-HXUWFJFHSA-N 342.527 5.115 30 20 EKED N#C[C@@H](C(=O)c1cc2sccc2s1)c1nccc2ccccc12 568825155 HGMQPIMDXVTQDK-CYBMUJFWSA-N 334.425 5.001 30 20 EKED C[C@H](c1ccc(Oc2ccccc2)cc1)[S@](=O)CCC(C)(C)C#N 583073974 QJHAOJWAINBNKS-VOIUYBSRSA-N 341.476 5.228 30 20 EKED Cc1nc(-c2cccc(NCc3ccc(C(C)(C)C#N)cc3)c2)oc1C 594505196 QAATXZNDCFJBQR-UHFFFAOYSA-N 345.446 5.372 30 20 EKED CCC(CC)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378452 JFNIRBXXEYJTAT-UHFFFAOYSA-N 344.402 5.086 30 20 EKED C[C@H](SCc1coc(-c2cccs2)n1)c1ccc(C#N)cc1 609825380 UKIZDQGMPWGURJ-LBPRGKRZSA-N 326.446 5.269 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccsc1 619788241 BVYWSEJQPCAOON-QWHCGFSZSA-N 345.493 5.025 30 20 EKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2c1 671745978 CRCYXWWLZSSZEJ-KRWDZBQOSA-N 340.382 5.033 30 20 EKED CSc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 728439051 CYQOYVPBYLHYOL-RMKNXTFCSA-N 343.498 5.490 30 20 EKED CCOc1cc(/C=C\C(=O)c2sccc2C)cc(Cl)c1OC 733749641 RDQZIIHAFDLFPW-WAYWQWQTSA-N 336.840 5.013 30 20 EKED N#CCOc1ccc(Cl)cc1COc1cc(Cl)ccc1Cl 735231105 PUAXWURXZNSGDK-UHFFFAOYSA-N 342.609 5.128 30 20 EKED N#CCC[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1 747690181 CUZUUHTVHJHWAG-XYHOIZSOSA-N 333.218 5.163 30 20 EKED C=C[C@H](CC(=O)OCc1ncc(-c2ccccc2C)o1)c1ccccc1 758910410 XUDHCIQVXITOMH-QGZVFWFLSA-N 347.414 5.053 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccncc2CC)cc1 774475871 HLJNYGUKRLGCMQ-HOTGVXAUSA-N 344.886 5.187 30 20 EKED O=C1/C(=C\c2ccsc2Cl)CCc2ncc(C(F)(F)F)cc21 790224487 YKXNAOZVSBBGCL-YVMONPNESA-N 343.757 5.028 30 20 EKED Cc1nn(C(C)C)cc1/C=C/C(=O)c1cc2cc(Cl)ccc2o1 798369346 FFQJDOBHJRXJKA-GQCTYLIASA-N 328.799 5.068 30 20 EKED N#Cc1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)s1 904553013 XJSUVKUIIZSCLQ-UHFFFAOYSA-N 329.384 5.004 30 20 EKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccccc3Cl)c2c1 1776115149 OYIXCLNWIJSFAL-ALCCZGGFSA-N 342.803 5.149 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc([C@H](C)C(=O)O)cc1 1776786188 WJUJAOUBUUHHIJ-CVEARBPZSA-N 333.472 5.200 30 20 EKED C=C(C)CN(CC)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 64862544 XMUBKFWASHVWHP-UHFFFAOYSA-N 348.421 5.079 30 20 EKED Cc1ccc(OC(F)F)c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)c1 90664534 MKYBJKMHNGMKAS-QAPCUYQASA-N 344.405 5.292 30 20 EKED Cc1ccccc1[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)C(C)(C)C 181866602 BVDNQLRCAOEMLI-LAUBAEHRSA-N 336.479 5.335 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)sc1C 302954136 FJGGOMJQSPYFCL-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CC(O)=Nc1ccccc1-c1noc([C@@H]2CCC[C@H]3CCCC[C@@H]32)n1 329720888 BTAHJNFKIWISRK-OWCLPIDISA-N 339.439 5.418 30 20 EKED C[C@H](SCc1nc(C#N)cs1)c1ccc(C(F)(F)F)cc1 419407468 WNLBWAHUSIALEM-VIFPVBQESA-N 328.384 5.028 30 20 EKED Cc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Cl 431704183 VFNDOLQQHHREJT-GOSISDBHSA-N 341.842 5.205 30 20 EKED CCN(CC1CCC1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 432060790 GFFUDTRLDACUQC-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 436275340 PAWZKJILSPHGEX-LLVKDONJSA-N 338.760 5.081 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438069405 BIOVFUAUBKAOSH-CQSZACIVSA-N 333.501 5.171 30 20 EKED C[C@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccc(C#N)cc1 439652254 VUNTUGYUCIWEEH-AWEZNQCLSA-N 349.821 5.572 30 20 EKED C[C@@H](C(=O)N(c1ccsc1)C1CCCCC1)c1cccc(C#N)c1 464529925 ULITUOFIMRJOCM-OAHLLOKOSA-N 338.476 5.089 30 20 EKED N#Cc1ccc(CN(C(=O)Nc2ccc(C3CCC3)cc2)C2CC2)cc1 489793313 QTWSQSZLNHPWEK-UHFFFAOYSA-N 345.446 5.022 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2c3c(cccc13)CC2 510699372 LBYFLZLNMWVEQN-UHFFFAOYSA-N 342.442 5.159 30 20 EKED N#CCCCCCC(=O)Nc1ccc(OCC2CCCCC2)cc1 588155022 ZZWDLGVYTFKQBG-UHFFFAOYSA-N 328.456 5.058 30 20 EKED Cc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)n1 611367794 UWSVOVRMLIIRJN-QGZVFWFLSA-N 341.458 5.088 30 20 EKED N#CCC[C@H](NCc1ccc(-c2cccs2)cc1)c1ccccc1 618302223 FQXHWYKMSXKFSM-FQEVSTJZSA-N 332.472 5.550 30 20 EKED CCC[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 733680925 JKWUUBJWZIFQLS-DLBZAZTESA-N 338.451 5.391 30 20 EKED C[C@@H](CCC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 750313189 NXRZBXIGOPBKAI-HOCLYGCPSA-N 334.444 5.056 30 20 EKED C#CCN(C(=S)Nc1ccccc1-c1ccccc1)C1CCCCC1 751008451 WQPARMNDLSWLNK-UHFFFAOYSA-N 348.515 5.318 30 20 EKED CC(CCCC(F)(F)F)=NNc1ccc(C#N)c(C(F)(F)F)c1 774385102 KPPOMPVIBAMMGC-UHFFFAOYSA-N 337.267 5.097 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1cc(Cl)sc1Cl 782312991 LXCQJVJOASXMLN-RQOWECAXSA-N 334.227 5.499 30 20 EKED CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc2ccccc2c1 793293880 DKKSMCCBKPSHEO-UHFFFAOYSA-N 342.442 5.308 30 20 EKED CSCc1cnc(C=NN(c2ccccc2)c2ccccc2)s1 814686228 YPHZZOVKCYBHCA-UHFFFAOYSA-N 339.489 5.178 30 20 EKED O=C(/C=C/c1cccc(O)c1)c1ccc2ccccc2c1OC(F)F 916140483 WRGNCPXQRMFYRB-DHZHZOJOSA-N 340.325 5.043 30 20 EKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1cc2ccccc2o1 921261490 FWLMEYZFHIMZDL-JXMROGBWSA-N 346.304 5.270 30 20 EKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 48859244 GPFCKOOGKMCEPS-SFHVURJKSA-N 346.455 5.225 30 20 EKED CCN(C(=O)Nc1cc(C#N)ccc1C)[C@H](C)c1cc2ccccc2o1 58451729 PSFIVHNNXKETSQ-OAHLLOKOSA-N 347.418 5.228 30 20 EKED CSc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1F 90665303 OABHGJFEJXOOMW-KBXCAEBGSA-N 328.456 5.243 30 20 EKED COc1ccccc1/C=C/C(=O)c1sc(-c2ccccc2)nc1C 205638237 JYNHHYRFDWNEMB-OUKQBFOZSA-N 335.428 5.023 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1-c1ccccc1 429223729 SQYXKQRWXFGBER-UHFFFAOYSA-N 335.451 5.147 30 20 EKED CCc1cc(C#N)c(NC(=O)c2cc(C(C)C)nc3ccccc23)s1 448196518 LCVVDRRZVKYYHT-UHFFFAOYSA-N 349.459 5.106 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)cc1 476120769 LXSBPRICLVZDPI-UHFFFAOYSA-N 347.380 5.810 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCCc1cccc(F)c1 486055309 YXPBKPNTAYBVNR-OAHLLOKOSA-N 328.456 5.265 30 20 EKED N#Cc1ccsc1C(=O)Nc1ccccc1Sc1ccccc1 497988190 INEDHEDJVIDYIM-UHFFFAOYSA-N 336.441 5.023 30 20 EKED C[C@@H](NC(=O)CC(C)(C)C#N)c1ccc(-c2ccc(Cl)cc2)s1 503326905 VDCMWKWHLHBQTQ-GFCCVEGCSA-N 346.883 5.186 30 20 EKED CCSc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 538508948 OYGKZRKDAPCAFR-KBPBESRZSA-N 328.456 5.221 30 20 EKED N#Cc1cccc(CNc2cccc(COC3CCCCC3)c2)c1F 539310234 NNZYDSDLPSEHTN-UHFFFAOYSA-N 338.426 5.159 30 20 EKED CCc1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 541066787 NYNIAKCIKZVYHP-OAHLLOKOSA-N 347.487 5.095 30 20 EKED C[C@H](Sc1ccc(C#N)cc1F)c1nc2ccccc2n1C(F)F 556338094 GLLSEGYQLDRIJO-JTQLQIEISA-N 347.365 5.295 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1c[nH]c2cc(F)ccc12 727266808 GGQFJJQPDGHGGL-VQHVLOKHSA-N 348.402 5.327 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1cccc(C#N)c1 728440983 BKSOMZCMBXBPLE-KTKRTIGZSA-N 348.402 5.025 30 20 EKED COc1ccccc1/C=C/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745989807 AJDGZGLQNZFHKX-XATRDHJGSA-N 341.410 5.210 30 20 EKED FC(F)(F)c1ccc(C2CC(=NNc3ncccc3Cl)C2)cc1 781589633 LNEIXNHVXLIWNE-UHFFFAOYSA-N 339.748 5.099 30 20 EKED O=C1/C(=C/c2ccc3ncccc3c2)CSc2ccc(Cl)cc21 797242802 RGGCYLVCBCQYJR-NTEUORMPSA-N 337.831 5.260 30 20 EKED CC(C)(C#N)CCCCNC(C)(C)c1nc2cc(Cl)ccc2o1 879158412 BSJIGLXJPKXIAL-UHFFFAOYSA-N 333.863 5.026 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc2ccccc2c1 918025730 TZSBHIBPNRVLCM-UHFFFAOYSA-N 334.394 5.199 30 20 EKED C[C@@H](NN=Cc1c(Cl)ccc(Cl)c1Cl)c1ccccc1 920383645 XXGFTPZSENZNKX-SNVBAGLBSA-N 327.642 5.332 30 20 EKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1ccccc1Cl 921261412 OCEXIEOUDBVLKH-YFHOEESVSA-N 340.728 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccn1)C1CC1 931062361 PRGXPGAGBVWJOL-NRFANRHFSA-N 349.478 5.206 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Br)cc1 37284436 SBCTXRUKVOTQAR-FZKQIMNGSA-N 343.268 5.123 30 20 EKED CC(C)(C)c1nnc(SCc2ccc(-c3ccccc3C#N)cc2)o1 42570801 SPWXAJFZYHNESJ-UHFFFAOYSA-N 349.459 5.198 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCc1cccc(C#N)c1 43171141 GGZWHEZGMFBLFK-UHFFFAOYSA-N 335.451 5.127 30 20 EKED Cc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1C 78481757 MXOCHWBEIAZKKQ-BQYQJAHWSA-N 325.458 5.385 30 20 EKED Cc1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)oc2c(C)cccc12 147966261 FKMDJSUFWGKUDJ-KRWDZBQOSA-N 340.382 5.088 30 20 EKED Cc1ccc(C)c([C@H](C)N(C)C(=O)N[C@H](CCC#N)c2ccccc2)c1 151288897 UFKXKWGPWSODIZ-GHTZIAJQSA-N 349.478 5.051 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c(F)c1 153672320 CLJFVMVTRYKIEE-LLVKDONJSA-N 348.830 5.126 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1cccc(C#N)c1 177112908 HQIVYSDLXISCLN-HNNXBMFYSA-N 338.476 5.109 30 20 EKED C[C@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1 286924848 HLMXBVXZSAUNKZ-OXJNMPFZSA-N 347.462 5.103 30 20 EKED Cc1c(C(=O)N[C@]2(C#N)CCC[C@H](C)C2)oc2c1ccc1ccccc12 303638810 HJMSQAXXGXQHGM-RCDICMHDSA-N 346.430 5.097 30 20 EKED CC(C)c1ccc(NC(=O)c2c(F)cc(C#N)cc2F)c(C(C)C)c1 445820824 IXJPZRDEAMFQFQ-UHFFFAOYSA-N 342.389 5.336 30 20 EKED CC[C@]1(C)CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 467554398 OFAPRSYRWJEYMW-OAQYLSRUSA-N 349.434 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C\c1ccc(F)cc1 476118224 BXYLUAFRTMKGNO-YVMONPNESA-N 337.438 5.720 30 20 EKED Cc1ccc(C)c([C@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)c1 476315943 VWPMTFKVMPCFTO-RBBKRZOGSA-N 346.474 5.055 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1 488682186 WWBVMJZICUKVMM-OAQYLSRUSA-N 348.446 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(C)c1Cl 489777409 JYIIRZTVQGBZIY-UHFFFAOYSA-N 341.882 5.682 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)c(F)c1 489889964 XMVPRXZGWMSSSO-KBPBESRZSA-N 336.385 5.401 30 20 EKED CCC(C)(C)c1ccc(C[S@](=O)CCCCC(C)(C)C#N)cc1 505718892 GYCPGDZJHXWZRK-HSZRJFAPSA-N 333.541 5.343 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 511839191 UHTUKQIGFNCNDT-IXDOHACOSA-N 342.508 5.237 30 20 EKED C=CCSc1ccccc1NC(=O)CSc1cccc(C)c1 520017843 VMUFYCHNJNGNJG-UHFFFAOYSA-N 329.490 5.004 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2cccc(F)c2)cc1 522778831 YPINDUUCLZHVJF-UHFFFAOYSA-N 347.349 5.134 30 20 EKED CC(C)(C#N)CCCNc1ccc(Oc2ccccc2C#N)c(F)c1 531902949 NLPKOYCUXDKREA-UHFFFAOYSA-N 337.398 5.232 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 532669701 RNNCNWWYXYIFRK-SFHVURJKSA-N 332.369 5.064 30 20 EKED Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c(Cl)c1C 542156466 ZKGUVESRDSWAHK-UHFFFAOYSA-N 346.883 5.440 30 20 EKED COc1ccc([C@H]2C[C@@H]2[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559860433 UNYQNVWYZZCWCZ-LUGPXAIHSA-N 348.490 5.212 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 605959587 QDJMPCAVPTUHKG-IBGZPJMESA-N 342.870 5.037 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2)o1 619755353 FHSFWGYWFJHLIB-CQSZACIVSA-N 336.822 5.322 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1nc(-c2ccccc2)cs1 730086161 YHNYPODNFCYNFV-VQHVLOKHSA-N 341.819 5.065 30 20 EKED Cc1cc(C)cc(C(=O)/C=C\c2ccccc2OCc2cccnc2)c1 730437639 UCCMOBOQSVIYCK-KTKRTIGZSA-N 343.426 5.174 30 20 EKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1ccc2ccccc2n1 731547334 YBNQQJKSDJOKHQ-GOSISDBHSA-N 348.471 5.276 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)o1)c1cncc(F)c1 737444427 RKUOSYOYHXDQIN-FNORWQNLSA-N 327.742 5.030 30 20 EKED C[C@H](Nc1cccc(COc2ccccc2)c1)c1ccc(C#N)cc1 743472115 KMFRFAXPADLNEV-KRWDZBQOSA-N 328.415 5.310 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)C3CCCC3)n2)cc1 750687792 OSPVDZMGFTUVIL-PBHICJAKSA-N 338.476 5.121 30 20 EKED Cc1ncsc1C(=O)/C=C/c1cc(Cl)cc(C(F)(F)F)c1 780186693 LOTZSBSBMMEINQ-NSCUHMNNSA-N 331.746 5.020 30 20 EKED C=C(C)[C@@H](N[C@@H]1COCc2cccc(Cl)c21)c1ccc(F)c(F)c1 788753021 HIRRJMPEWXNMJU-IEBWSBKVSA-N 349.808 5.097 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1C 1776089596 ZHNPSWUKOAFCII-RDTXWAMCSA-N 344.499 5.724 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccccc1C 1776785216 IJAPDNBIYNSPJH-FQEVSTJZSA-N 333.516 5.583 30 20 EKED O=C(O)c1ccc2scc(/C=C\C(=O)c3coc4ccccc34)c2c1 1777683984 MQBRYBZWGZMAGG-ALCCZGGFSA-N 348.379 5.242 30 20 EKED C=C(C)COc1cccc(NC(=O)N(CCC)Cc2ccccc2)c1 72093556 HJXBVNJSMBZIAQ-UHFFFAOYSA-N 338.451 5.086 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccccc2CCC(F)(F)F)cc1 153744707 UUXKIIXTHLDRKJ-CQSZACIVSA-N 348.368 5.084 30 20 EKED N#Cc1cccc(CNc2ccc(Oc3ccc(Cl)cn3)cc2)c1 174897611 QKZVHWISAXMBJH-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C[C@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1cccc(C#N)c1 181901599 NGOPWVBGGRAKFJ-BTYIYWSLSA-N 347.849 5.047 30 20 EKED N#CCCC[C@H](NCc1cccc(-c2cccnc2)c1)c1ccccc1 353916358 QDNSHWIZDPITCY-QHCPKHFHSA-N 341.458 5.273 30 20 EKED CCCc1ccccc1NC(=O)c1sc2ccc(C#N)cc2c1C 431952392 QHYFOFBLHLEYRO-UHFFFAOYSA-N 334.444 5.286 30 20 EKED C[C@@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)c1ccc(C#N)cc1 439589698 BIZUOYRYLQZAPU-CQSZACIVSA-N 333.435 5.461 30 20 EKED CC(C)(C#N)CCCCN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 444679147 LMDKRKNMNNAQCD-QGZVFWFLSA-N 338.417 5.466 30 20 EKED N#Cc1cc(CN(Cc2cccs2)Cc2cccs2)ccc1F 468271644 YOHSQZICJSGUKL-UHFFFAOYSA-N 342.464 5.023 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@@H]1c1ccccc1C(F)(F)F 472264670 YEJKOFCEPOTRTN-QGZVFWFLSA-N 338.417 5.562 30 20 EKED C=CCCc1ccccc1NC(=O)c1[nH]c(C)c(C(C)=O)c1C(C)C 504295044 GSWZYITZNHXZJT-UHFFFAOYSA-N 338.451 5.020 30 20 EKED CN(C(=O)c1cc2sc3ccccc3c2s1)c1ccccc1C#N 508098553 CKDJWGYACHUZGV-UHFFFAOYSA-N 348.452 5.264 30 20 EKED CCN(C(=O)c1ccc(C(C)C)s1)c1ccc(C#N)c(Cl)c1 544851308 VODWFSYGCRRVQF-UHFFFAOYSA-N 332.856 5.063 30 20 EKED C=CCC[C@H](NCc1cc(Cl)c(OCC)c(OC)c1)c1ccco1 556865128 DXHQRJKLDZYHAL-INIZCTEOSA-N 349.858 5.137 30 20 EKED Cc1c(-c2nc([C@H]3CCCCS3)no2)sc2ccc(C#N)cc12 564396850 IGXVHGWPJKUAOS-CQSZACIVSA-N 341.461 5.090 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCCc2sc(Cl)cc21 589949255 BVBAQMNAVPWLKH-IRXDYDNUSA-N 342.895 5.318 30 20 EKED C[C@H](c1ccccc1Cl)N(Cc1ccc(C#N)cc1F)C1CC1 603934187 NCDFGTYRAJYPCN-CYBMUJFWSA-N 328.818 5.076 30 20 EKED CC[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1F 618801320 ACILSMJOUCLLGB-QZTJIDSGSA-N 328.818 5.079 30 20 EKED COc1cccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)c1 727780035 FMJRNTKMADDOGL-VAWYXSNFSA-N 335.428 5.023 30 20 EKED CC[C@H](c1ccccc1)N(CC)Cc1cc(Cl)ccc1OCC#N 735309472 FRGSHUHWJFCWJM-LJQANCHMSA-N 342.870 5.216 30 20 EKED COCc1ccc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)cc1 741845029 XSECJVDFPOXROI-WDZFZDKYSA-N 348.414 5.086 30 20 EKED CCCCCC[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N 741899402 NNCPYKGCERPBKY-KRWDZBQOSA-N 338.451 5.291 30 20 EKED CC(=NNc1ncc(Cl)cc1Cl)c1sc(C(C)C)nc1C 751129903 PQCRLFOFDSVUSA-UHFFFAOYSA-N 343.283 5.113 30 20 EKED FC(F)c1ccc(CON=Cc2ccccc2C(F)(F)F)cc1 763424634 VXTZLBABTKDGKL-UHFFFAOYSA-N 329.268 5.194 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(SC(F)F)cc1 766349902 KPGCGVOSRCZCMT-QWHCGFSZSA-N 332.419 5.285 30 20 EKED C=CCC[C@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 778597368 CUPNPOPKLULJMT-VQTJNVASSA-N 340.426 5.161 30 20 EKED C#CCCCCCC(=O)N[C@H](C)c1ccc(-c2ccccc2OC)cc1 779920509 KVROXSJCGQZWPF-GOSISDBHSA-N 349.474 5.123 30 20 EKED C=CCC[C@@H](Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1ccco1 796980912 BSVGOJFUZBCDIC-SFHLNBCPSA-N 341.451 5.081 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc(C#N)cc1 811685067 ILWHNAYCPIVZES-YUYXVBIOSA-N 339.341 5.002 30 20 EKED N#CC[C@H](CC(=O)Oc1ccc(C2CC2)cc1Cl)c1ccccc1 816217844 RHKNRDHITPQJKD-QGZVFWFLSA-N 339.822 5.210 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1SC(F)(F)F 820140862 TWGFZLZIWWXPCA-TXEJJXNPSA-N 342.386 5.013 30 20 EKED C[C@H](NCCCC(C)(C)C#N)[C@@H](C)c1ccccc1C(F)(F)F 185794043 REICOONCKKDGIN-KGLIPLIRSA-N 326.406 5.117 30 20 EKED Cc1[nH]c2ccc(C/N=C(/O)[C@H]3CCCc4c(O)cccc43)cc2c1C 330013113 LQQBTPZOVNDKBK-SFHVURJKSA-N 348.446 5.067 30 20 EKED C=CCN(Cc1ccc(Cl)s1)Cc1ncccc1C(F)(F)F 506114976 WFSNCTKFSFTRDC-UHFFFAOYSA-N 346.805 5.004 30 20 EKED CCS[C@H]1CCC[C@@H](NC2CCC(C#N)(c3ccccc3)CC2)C1 507612575 FHSMPUQYGQDXEQ-YZDRJCRTSA-N 342.552 5.044 30 20 EKED CN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1cccc(C#N)c1 520325470 SJAXGVFFYNLLQZ-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(Cl)c1Cl 538210357 GSTQLOHFNLNBBF-CYBMUJFWSA-N 347.289 5.645 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc2ncccc2c1 546728764 DKCKPXOOLXVENC-HNNXBMFYSA-N 333.460 5.099 30 20 EKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCCC2)c1cccs1 564303219 GZLNQDZPZLZTGW-GFCCVEGCSA-N 344.505 5.082 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1nccc2ccccc12)c1ccc(F)c(F)c1 569860965 JHDLDYYKWRGORW-XOBRGWDASA-N 338.401 5.481 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)ccc1Cl 619746843 NXNUZFUVMDJDPH-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1F 656689134 NPFODOBCADRXBA-SNVBAGLBSA-N 345.302 5.530 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(C)s3)s2)cc1 734305545 BFOVKRFDAZMXAV-CMDGGOBGSA-N 325.458 5.385 30 20 EKED CCOc1ccc(/C=C\C(=O)c2oc3ccccc3c2C)cc1OC 747139766 OGPWSGMSBBIZHA-LUAWRHEFSA-N 336.387 5.045 30 20 EKED CCCCCCCCC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 748646112 HQOJNWSBPUMOHN-UHFFFAOYSA-N 342.439 5.221 30 20 EKED Oc1ccc2ccccc2c1/C=N\[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 753996983 ZNOCLJUFCKMQMM-PHJOELGQSA-N 349.405 5.024 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 756299232 COBUQLYOLSUWGR-XJKSGUPXSA-N 326.465 5.270 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(SC(F)F)cc1)c1ccncc1 766018708 INHTUMZDNFNFQD-GUYCJALGSA-N 334.435 5.364 30 20 EKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1cccc(Cl)c1 795980192 CFBHUSMNGNJUDU-PBHICJAKSA-N 327.811 5.032 30 20 EKED CC(=NOCc1nc(-c2ccccc2)oc1C)c1cc2ccccc2o1 818251030 CKEQFJRHRHATDZ-UHFFFAOYSA-N 346.386 5.337 30 20 EKED N#C[C@@H](C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1)c1nc2ccccc2s1 860451889 PFFBAZXJQNJWHE-ZACQAIPSSA-N 346.455 5.056 30 20 EKED COc1ccc(C(=O)/C=C\c2ccc(Cl)c(Cl)c2)c(F)c1 916141898 ULOHCEOFVISYHK-CLTKARDFSA-N 325.166 5.037 30 20 EKED COc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)c2cccnc12 920174771 PUWFCMVCXRYSNG-UHFFFAOYSA-N 347.201 5.006 30 20 EKED Cc1ccc([C@H]2CCCC2=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033489 PWYDVKDBMIDTRC-OAHLLOKOSA-N 342.826 5.082 30 20 EKED CCSc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776950891 HAKMEIOIFVIYKU-JXMROGBWSA-N 346.835 5.046 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 117456765 ZVSVJTGNHJPHTI-CVEARBPZSA-N 345.512 5.125 30 20 EKED CCC[C@@H]1CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 135770499 AMWMQXRQRNGPFU-HZPDHXFCSA-N 345.512 5.125 30 20 EKED COc1ccc(Br)cc1S[C@@H](C#N)C1CCCCC1 303940379 XFBJCBFWZFDSQN-HNNXBMFYSA-N 340.286 5.022 30 20 EKED CC(C)c1ccc(N/C(O)=N/C[C@H]2CCO[C@H](C)C2)c(C(C)C)c1 330627537 KHPUXECHPDBEEN-CVEARBPZSA-N 332.488 5.074 30 20 EKED Cc1oc2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2c1C 360664262 OANUXSNSLNVJKL-IBGZPJMESA-N 347.418 5.216 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2C(C)(C)C)n1 434390450 LOKBPXMYAQRLBL-AWEZNQCLSA-N 326.465 5.054 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 446827413 OAWZJKSOBAYDDJ-QCSYZSNVSA-N 336.401 5.013 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@H](C)c1ccc(C#N)cc1 447565292 KBMWUGPXFDETHF-RDTXWAMCSA-N 332.369 5.211 30 20 EKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3ccccc3)c3ccccc23)C1 450684247 RGCFGRDQXIJJGG-GDBMZVCRSA-N 331.444 5.081 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1sccc1C 475564348 AKQMXSRQNRQUGE-UHFFFAOYSA-N 328.481 5.230 30 20 EKED CCCn1ccc2ccc(NC(=O)C[C@H](CC#N)c3ccccc3)cc21 476205894 PSVPFQHWJVRUCC-IBGZPJMESA-N 345.446 5.077 30 20 EKED COc1ccc(-c2nc(CSCCCC(C)(C)C#N)cs2)cc1 480398602 ZYLYJBDXMNWISQ-UHFFFAOYSA-N 346.521 5.382 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)S(=O)(=O)CCCCC(C)(C)C#N 488999670 NYEIVCZNLUCACC-MRXNPFEDSA-N 349.540 5.180 30 20 EKED CC(C)CN(C(=O)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 499316897 ACQHILYDPYGUQE-UHFFFAOYSA-N 347.245 5.168 30 20 EKED Cc1c(C(=O)N2CCC=Cc3ccccc32)sc2ccc(C#N)cc12 505147303 ADVHINHODVEVEO-UHFFFAOYSA-N 344.439 5.145 30 20 EKED N#Cc1ccc(CNc2ccc(COCc3ccccc3)cc2)c(F)c1 533309053 URQNMGLJYJRRPR-UHFFFAOYSA-N 346.405 5.026 30 20 EKED Cc1csc(NC(=O)Cc2coc3ccc4ccccc4c23)c1C#N 570481472 KVLIHOXZQLGPCE-UHFFFAOYSA-N 346.411 5.009 30 20 EKED C[C@@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1cccc(C#N)c1 590712593 PTENCIHFHMYTBZ-ZIAGYGMSSA-N 332.369 5.075 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1cccc2ccccc12 609387078 JSEIWCWECRSRCE-IRXDYDNUSA-N 346.499 6.265 30 20 EKED CCc1ccc(/C=C/C(=O)c2ccc(Br)s2)s1 731156064 ZLBJLNRCYYMADC-AATRIKPKSA-N 327.268 5.031 30 20 EKED C/C(=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 742537742 OYCFNWZAQAVNJA-KETLNSEPSA-N 332.447 5.273 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1 753135448 QVIHZKZOFWGKNT-CMDGGOBGSA-N 348.471 5.399 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(C(C)(C)C)n1 822363857 FOMGYDXRHYATLE-UHFFFAOYSA-N 326.440 5.076 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC(C)(C)CC(F)F 878786153 CPOODDNJKOZENT-LBPRGKRZSA-N 340.439 5.091 30 20 EKED CC(C)[C@H](N[C@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902785223 CABRTXLQGQZCEM-ACJLOTCBSA-N 347.384 5.020 30 20 EKED CCCCC1CCC(C(=O)[C@H](C#N)c2ccc3ccccc3n2)CC1 916848098 AVHLXDFJIUETJS-NKELODKYSA-N 334.463 5.408 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C2CC2)oc1C1CC1 935605844 CKDHJFGWMGVUJZ-UHFFFAOYSA-N 349.474 6.139 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776370530 XIXUFBFFADREIP-MDZDMXLPSA-N 328.795 5.058 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 77284778 ORQCUNMFOKKNDA-UHFFFAOYSA-N 349.434 5.089 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 90665744 JMGSODLKEOHSLW-KDOFPFPSSA-N 332.369 5.401 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc3ccccc3c2)c1 113952447 HSJWOPLPHMDWJJ-JTSKRJEESA-N 344.458 5.372 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1csc(C(C)(C)C)n1 153883231 IIEQCCVMZCATJR-ZDUSSCGKSA-N 345.537 5.447 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(F)c1 189883314 WXBZAAVHCHNGSD-HNNXBMFYSA-N 325.427 5.420 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 392288726 MAQBYKQMTROODY-WZONZLPQSA-N 326.443 5.193 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(Cl)c2ccccc12 421811496 IRNYKYKHPGJTDO-HSZRJFAPSA-N 347.911 5.462 30 20 EKED Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458799533 JMNUZWRJCODPID-NQIIRXRSSA-N 349.478 5.133 30 20 EKED N#Cc1cccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)c1 468285428 JNKXJBCFKZMVJS-UHFFFAOYSA-N 332.790 5.131 30 20 EKED N#C[C@@H](C(=O)c1ccc(-c2cccs2)o1)c1nccc2ccccc12 483228251 DAJMBYSTQMPQOX-OAHLLOKOSA-N 344.395 5.046 30 20 EKED CCN(C(=O)c1ccc(F)c2ccccc12)[C@@H](C)c1ccc(C#N)cc1 483230445 GBWBWVRQOSQJMF-HNNXBMFYSA-N 346.405 5.074 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Cl)cc1C 519002203 QELGMXQOONZUJO-UHFFFAOYSA-N 332.806 5.008 30 20 EKED N#Cc1c(Cl)cccc1SCc1csc(-c2ccccn2)n1 538948528 BUOQETAOBNWXMO-UHFFFAOYSA-N 343.864 5.022 30 20 EKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2c1 552360767 QPJJADXDLNCTCH-SFHVURJKSA-N 340.382 5.033 30 20 EKED C[C@H](NCC(C)(C)CCC#N)[C@@H](C)Oc1ccc(Cl)cc1Cl 554066404 HIIDVHMIMJSIFE-QWHCGFSZSA-N 343.298 5.069 30 20 EKED CCCCc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 613290787 LBBWTYIVAIWGQM-IBGZPJMESA-N 328.415 5.067 30 20 EKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(F)cc1F 727264450 RHLVGQVZTVRGMS-QHHAFSJGSA-N 346.682 5.533 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cc1O 747188370 OXFMTNGYNJEPHZ-CLFYSBASSA-N 336.412 5.025 30 20 EKED O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ccsc1 749105098 QVSKGJILBVAEMG-GQCTYLIASA-N 341.413 5.281 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(F)cc1Br)c1ccccc1 773113882 GNSWZUQKWTUROJ-ACJLOTCBSA-N 346.243 5.003 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccncc2CC)cc1 774475873 HLJNYGUKRLGCMQ-JKSUJKDBSA-N 344.886 5.187 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1scnc1C1CC1 782098587 UUOPZDYSBNPGNR-UHFFFAOYSA-N 333.460 5.061 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1O 810213518 UOWBFODTASBIKA-SJKOYZFVSA-N 348.368 5.085 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCO2 815636041 NXXHZCZSXUXOAG-NHCUHLMSSA-N 334.463 5.097 30 20 EKED C=CCC[C@H](N[C@@H]1CCC[C@@H](CCCC(=O)O)C1)c1ccccc1 902325851 MTMCTYNHMNBMNP-SXLOBPIMSA-N 329.484 5.097 30 20 EKED COc1ccc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc1 918714356 ZXDIQHVKYUUZGG-XFXZXTDPSA-N 335.428 5.023 30 20 EKED Cc1c(NN=C2CCC[C@H]2c2ccccc2Cl)cccc1C(=O)O 1776087465 DMIDDFQOMYGKRQ-HNNXBMFYSA-N 342.826 5.082 30 20 EKED Cc1cccc(NN=Cc2csc3ccc(C(=O)O)cc23)c1Cl 1776106683 QISLMPIPSDRKGH-UHFFFAOYSA-N 344.823 5.007 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)cc(Cl)c1 1776783049 SXLZBGJSQWJRPH-MRXNPFEDSA-N 346.298 5.287 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(OC(F)F)cc1 79724408 ZLNXBYDBSXAECH-AWEZNQCLSA-N 346.377 5.144 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(=O)C(C)(C)C 296307771 NYZBBDIKXGYMRJ-UHFFFAOYSA-N 329.484 5.263 30 20 EKED C[C@@H](NCc1cccc(Oc2ccccc2)c1)c1ccc(C#N)cc1 327333724 ZEEUNYWBXMMORP-QGZVFWFLSA-N 328.415 5.201 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(-c2ccccc2OC)cc1 466659317 YDIIJWWNSGPQBK-IAGOWNOFSA-N 337.463 5.142 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(Cl)c1F 466847751 UBAORTDEQIMPLY-GFCCVEGCSA-N 334.847 5.485 30 20 EKED CC(C)(C#N)CCCSCc1ccn(-c2ccc(Cl)cc2)n1 467315290 ZMFVHHXBPLXJHF-UHFFFAOYSA-N 333.888 5.089 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(COc2ccccc2)c1C 472865295 MPWLOKLSQPXJMR-UHFFFAOYSA-N 338.451 5.004 30 20 EKED COc1cc(Cl)ccc1CNc1ccccc1S[C@@H](C)CC#N 480150259 YQNHNXGMAJEFHN-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 480670817 MFPQXTGTWOYCGT-ORAYPTAESA-N 346.377 5.149 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1cnc(-c2ccccc2)s1 482737730 STXBZBYNIGLWNR-UHFFFAOYSA-N 340.492 5.019 30 20 EKED Cc1cc(Cl)c(C(C)C)cc1OCCCC1(C#N)CCOCC1 499938561 ZLVGQVTUCQPVMB-UHFFFAOYSA-N 335.875 5.251 30 20 EKED CC[C@@H]1C[C@@]1(NCc1cccc(OCCCC#N)c1)c1cccc(C)c1 500512200 IVEUHYNKWOKOFR-OFNKIYASSA-N 348.490 5.093 30 20 EKED CCC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 521420124 AXFLZDANMNHVJJ-OAQYLSRUSA-N 349.478 5.020 30 20 EKED C=C[C@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 536124506 FZUSYXBMAAYKFI-QAPCUYQASA-N 347.380 5.156 30 20 EKED C[C@@H](Nc1ccc(-c2cn3ccccc3n2)cc1)c1cccc(C#N)c1 540694871 IIIWUWJKJDGEAR-MRXNPFEDSA-N 338.414 5.046 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccccc2F)o1)c1ccccc1 579335749 MJNDOHPUIDRNBQ-NRFANRHFSA-N 348.421 5.610 30 20 EKED CCCN(C(=O)CCCCC#N)[C@@H](C)c1ccc(Cl)c(Cl)c1 593963917 AJTMLECFIWZGME-ZDUSSCGKSA-N 341.282 5.377 30 20 EKED C[C@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)CC(C)(C)C 609427765 JJSLKIZKGDLIQZ-HUUCEWRRSA-N 332.513 5.482 30 20 EKED Cc1nc(/C=C/c2ccsc2)sc1C(=O)/C=C\c1ccsc1 726849141 XDIHEBKCCFAFMV-VOERYJCWSA-N 343.498 5.641 30 20 EKED O=C(/C=C\c1cccc2ccccc12)c1c(Cl)nc2ccccn12 737445890 HTVWHEZXOIGMAP-QXMHVHEDSA-N 332.790 5.037 30 20 EKED CC[C@H](C)CN(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748942384 PBAOKHPJMUKVJC-LAUBAEHRSA-N 349.478 5.242 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1csc2ccccc12 754739441 RHTJWICITCAANY-HNNXBMFYSA-N 334.488 5.553 30 20 EKED C#CC[C@@H](NCc1ccc(-c2ccccc2OC)cc1)c1ccccc1 756995890 LOLNPXYMAOAQMH-HSZRJFAPSA-N 341.454 5.216 30 20 EKED CSc1ccc(C(=O)/C=C/c2nccc3ccccc23)c(Cl)c1 765613187 HWIQZTSCNKQPSH-CMDGGOBGSA-N 339.847 5.506 30 20 EKED Cc1cc(C(=O)/C=C\c2ccccc2OCc2ccccn2)c(C)s1 819842313 NOUBANUHSMKWOK-KHPPLWFESA-N 349.455 5.235 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@]2(C1)CC2(F)F 844641802 FWFCKUCJLLEKKK-LJQANCHMSA-N 348.437 5.192 30 20 EKED CCCOc1cc(/C=C/C(=O)c2cc3ccccc3o2)ccc1OC 916138502 SONPAIQBWVTKHA-CSKARUKUSA-N 336.387 5.126 30 20 EKED C=CCN(C(=O)c1ccc(SCc2ccccc2)cc1)C(C)C 917658650 FKXUWPCZSRLSNA-UHFFFAOYSA-N 325.477 5.016 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C2CCC2)cc1 1776784324 VTUXLMBQGKBQHD-HXUWFJFHSA-N 331.500 5.248 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1nccs1 191417651 FVFOFNVEQNWLAD-UHFFFAOYSA-N 343.496 5.052 30 20 EKED Cc1ccc(C)c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 195664157 CGDNWBCOTJWEEE-AWEZNQCLSA-N 340.835 5.057 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 195708785 WBXUQPHNPQFUQG-SFHVURJKSA-N 349.434 5.147 30 20 EKED Cc1nc(CSCc2ccc(-c3ccccc3C#N)cc2)cs1 303248141 DXEKNQUTDFFKGZ-UHFFFAOYSA-N 336.485 5.424 30 20 EKED N#CC1CCC(CN[C@H]2CCCSc3ccc(Cl)cc32)CC1 442870908 DWBUSZJZVTVWSP-KVULBXGLSA-N 334.916 5.187 30 20 EKED CC[C@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 447534448 XJMICEZNNMMZKU-ACJLOTCBSA-N 332.369 5.379 30 20 EKED CC[C@@H](C)c1ccc([C@@H](NC(=O)CCCC#N)c2cccs2)cc1 461757936 UCMHOJPWPPPBET-FOIQADDNSA-N 340.492 5.161 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(OC2CCCC2)cc1)c1ccccc1 474698823 QLODKPXBVLJVHP-GOSISDBHSA-N 348.446 5.034 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1ccccc1)c1ccco1 481934599 SRCCTBKMCNKFSD-FYYLOGMGSA-N 342.442 5.298 30 20 EKED C=CCOc1cccc(CN[C@H]2CCSc3ccc(Cl)cc32)c1 518782269 QUZYYUBCMZSCKT-SFHVURJKSA-N 345.895 5.232 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nccc2ccccc12 518847531 QKSBMBHBWBUQHU-OAQYLSRUSA-N 338.410 5.292 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)cc1OC)c1ccccc1 537945971 HKVHCJRFDMTEQA-OXJNMPFZSA-N 325.452 5.062 30 20 EKED CCc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 550826417 DZNXLEVCDJCRMW-UWJYYQICSA-N 346.474 6.081 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)CC/C=C/c1ccccc1 606161689 ZIOMOSVKUZHDAC-UXBLZVDNSA-N 345.895 5.410 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H]1CCCC[C@H]1C 609428309 LTJUDBMYJINLRT-OAGGEKHMSA-N 330.497 5.236 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)c1 609544505 WIFGOZUXIXEELI-VWLOTQADSA-N 348.449 5.591 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc2ccccc2c1 732625556 PJFRFDMBFQBVKE-UHFFFAOYSA-N 338.520 5.605 30 20 EKED C[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 734080533 UXOIOUTUVUIKNR-RHSMWYFYSA-N 338.476 5.203 30 20 EKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1Cl 741474280 WVRFRAXKIDKKRH-ALCCZGGFSA-N 349.817 5.307 30 20 EKED O=C1/C(=C/c2cccnc2Cl)CCSc2ccc(Cl)cc21 748442815 YGIAHDPEAMITBH-CSKARUKUSA-N 336.243 5.151 30 20 EKED CC1(C)CCC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C1 756516260 GEGDEXCHFXTDLB-JKSUJKDBSA-N 338.476 5.203 30 20 EKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1cc2ccccc2s1 780188920 QGJPBDIBOBITMO-HJWRWDBZSA-N 348.452 5.316 30 20 EKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2ccc(Cl)cc21 788353907 JZWZLDHRTXYISM-WEVVVXLNSA-N 343.757 5.028 30 20 EKED COc1cccc2cc(C(=O)/C=C\c3ncc(C(C)(C)C)s3)oc12 790603453 KYSTVSZGXYXOCT-HJWRWDBZSA-N 341.432 5.092 30 20 EKED CCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 796651003 NXMYBKHNIIMJNH-PXAZEXFGSA-N 334.872 5.342 30 20 EKED N#CCCCCCC(=O)Nc1ccc(-c2cccc(F)c2)c(F)c1 805197948 JSCVUQXMXLQYEC-UHFFFAOYSA-N 328.362 5.044 30 20 EKED O=[N+]([O-])c1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 818204565 NIUXRFDZDUUQGE-UHFFFAOYSA-N 344.585 5.001 30 20 EKED C=CCC1(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)CCC1 856372545 MIDKGUOCMAAAGH-UHFFFAOYSA-N 344.455 5.027 30 20 EKED N#C[C@H](C(=O)CCC1CCCCC1)c1nc(-c2ccccc2)cs1 917026453 ZGWYRAOKOZWGBP-QGZVFWFLSA-N 338.476 5.347 30 20 EKED C=CCN(C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)C(C)C 918062205 NVJQTAYBIGMADO-NRFANRHFSA-N 348.446 5.128 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(CCC#N)cc1 932578295 VUBFRXKINKWIRK-HXUWFJFHSA-N 335.451 5.004 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1C(C)(C)C 1776787028 KOLGQBKHPSQTDC-SFHVURJKSA-N 333.516 5.278 30 20 EKED Cc1ccccc1-c1noc([C@H](C)SCCCCC(C)(C)C#N)n1 435891739 BHUWWZHKNMBPQX-HNNXBMFYSA-N 343.496 5.559 30 20 EKED C=C(C)[C@@H](NCc1ccc2nc(C)ccc2c1)c1ccc(F)c(F)c1 437982510 CREJHFRJSJKHIQ-OAQYLSRUSA-N 338.401 5.228 30 20 EKED N#CCCCOc1cccc(NC2CCC(OC3CCCC3)CC2)c1 449039987 FAYNQWODLWCTBF-UHFFFAOYSA-N 342.483 5.051 30 20 EKED CC(C)N(Cc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458800365 LATNHWVLCDKLRO-NRFANRHFSA-N 349.478 5.042 30 20 EKED CCN(C(=O)c1ccc(C2CCC2)cc1)c1ccc(C#N)c(Cl)c1 485720864 RZMRGEGRLXLDIA-UHFFFAOYSA-N 338.838 5.146 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487486638 PNIVOMBZGUWGGU-UGKGYDQZSA-N 348.490 5.197 30 20 EKED C[C@@H]1CC[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)[C@H](C)C1 503221168 CACUNRQQVJUJPV-FPCVCCKLSA-N 345.512 5.027 30 20 EKED CCSc1ccccc1[C@H](C)Nc1cccc(OCCCC#N)c1 538526452 IUHYQDPOVYGSSO-INIZCTEOSA-N 340.492 5.654 30 20 EKED Cc1cccc([C@H](C)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 571936339 VHRBFSGKULVZHQ-INIZCTEOSA-N 329.403 5.227 30 20 EKED C[C@H](SCc1csc(-c2ccsc2)n1)c1ccc(C#N)cc1 609825495 BPCZRFORRASUFZ-LBPRGKRZSA-N 342.514 5.738 30 20 EKED CCCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1ccccc1 610356035 HWXTWBAZWHAUDL-ROUUACIJSA-N 349.478 5.192 30 20 EKED C=C(C)[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(F)c1 614160413 UEOFDASXJAQUQK-SFTDATJTSA-N 338.401 5.121 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 676391075 KJGZLYPMSRSKHB-KRWDZBQOSA-N 328.415 5.022 30 20 EKED CCOc1cc(/C=C/C(=O)c2ccc(SC(C)C)cc2)ccc1O 728442110 WIJDUMYTQQFRRZ-VZUCSPMQSA-N 342.460 5.188 30 20 EKED C=CCN(C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1)C(C)C 728692920 UDHVUIOIQVWCGF-UHFFFAOYSA-N 330.378 5.060 30 20 EKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccc(F)cc1 732919570 MFDVHZJGZNJGHW-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C=CCCCCCCNC(=O)N(C)[C@H](C)c1nc2ccccc2s1 806004036 YHJNPUMZXXFGIA-OAHLLOKOSA-N 345.512 5.135 30 20 EKED CCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916650445 PSWZQTGWFCOLPC-INIZCTEOSA-N 326.465 5.265 30 20 EKED C[C@@H](CC(C)(C)C#N)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 926091817 OSHNPYHMTBHWCE-UPCLLVRISA-N 346.540 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C1(Cc2ccccc2)CC1 189901726 DWOCOZLWXWGWSM-UHFFFAOYSA-N 333.475 5.500 30 20 EKED CC(C)Cc1ccc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 326611201 LWEMOLMRLCFILE-ZWKOTPCHSA-N 336.479 5.199 30 20 EKED Cc1cc(C)c(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c(C)c1 329993049 KYTXBUBFUDYLCU-UHFFFAOYSA-N 328.456 5.125 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 340443204 FMLFIBIZQQOUOI-QAPCUYQASA-N 341.524 5.661 30 20 EKED CC[C@@H](CC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C)cc1 439671089 ZPYIGCYGFYVWRE-GHTZIAJQSA-N 334.463 5.040 30 20 EKED Cc1cccc(C)c1[C@@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 458643181 DOVCXGJBLRAIGP-QUCCMNQESA-N 349.478 5.099 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](SC)C(C)(C)C 475578689 QMFNLPQOTAIQTM-KRWDZBQOSA-N 348.556 5.438 30 20 EKED Cc1ccc(C(F)(F)F)cc1NC(=O)C[C@H](CC#N)c1ccccc1 476205067 KOPDZXXSOYFYCR-HNNXBMFYSA-N 346.352 5.040 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccsc2Cl)cc1 480266529 OQLQTCWMDNLEQF-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(CCSC)cc1 485463038 CXDAXFCTCQAVCX-UHFFFAOYSA-N 343.517 5.123 30 20 EKED N#Cc1cc(NCc2ncc(Cl)s2)ccc1Oc1ccccc1 488193199 IRHJWAGUDSSIFF-UHFFFAOYSA-N 341.823 5.073 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1cccc(COC2CCCCC2)c1 488365814 KIUWWMFXKPAGCI-LJQANCHMSA-N 342.483 5.108 30 20 EKED CCC(CC)(NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499522275 ZZNSZJBFYPQCQB-UHFFFAOYSA-N 348.918 5.045 30 20 EKED CCc1cccnc1[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 507490802 AIHHHIOZYAODAX-QGZVFWFLSA-N 341.458 5.033 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)cc1 508066168 YTEQBWJGTOONPC-KRWDZBQOSA-N 328.415 5.201 30 20 EKED C[C@@H](N[C@H]1CCCc2c1sc1ccccc21)c1ccc(C#N)cc1 532465305 WAKMIGZLPHEXCH-KUHUBIRLSA-N 332.472 5.501 30 20 EKED C=C[C@H](CC(=O)N(CC)Cc1ccc(Cl)s1)c1ccccc1 535334299 WKCPOHUJHYPLEY-CQSZACIVSA-N 333.884 5.110 30 20 EKED C[C@H](Nc1ccc(-c2cn3ccccc3n2)cc1)c1ccc(C#N)cc1 539596449 ZCPAQOAGCXXONA-INIZCTEOSA-N 338.414 5.046 30 20 EKED C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)c(F)c1 540711025 RXOVQOHFIYWRIG-VXGBXAGGSA-N 336.332 5.128 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 551210133 WFZTWZDSANRMIM-KUHUBIRLSA-N 347.289 6.079 30 20 EKED C=CCC[C@H](NC[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccco1 552047205 DANJAMHZJXRDPF-UWVAXJGDSA-N 344.524 5.021 30 20 EKED C=C(C)CCNc1ccccc1CN(C)C(=O)c1cc2ccccc2o1 581302968 VUWLQBLLODPEIG-UHFFFAOYSA-N 348.446 5.083 30 20 EKED CC(C)c1ccc(NC(=O)CS[C@H](C)c2ccc(C#N)cc2)cc1 609825758 RUWUNUDAMSNVEY-OAHLLOKOSA-N 338.476 5.115 30 20 EKED C=CCN(Cc1csc(C(C)C)n1)Cc1ccc(Cl)s1 613334306 XVGDEHUHTKDMGF-UHFFFAOYSA-N 326.918 5.170 30 20 EKED Fc1ccc(CNN=Cc2c(Cl)ccc(Cl)c2Cl)c(F)c1 727060418 OPBZLDNTEYHGED-UHFFFAOYSA-N 349.595 5.049 30 20 EKED C=CCN(CC1CCCCC1)Cn1ccc(=S)c2ccccc21 732670563 LJPPKSWRJZNZJG-UHFFFAOYSA-N 326.509 5.397 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 733679892 GREXDSISQAXBHO-MOPGFXCFSA-N 334.463 5.408 30 20 EKED C[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)(C)C 734643265 AIHZMNYDHMCKCW-UZLBHIALSA-N 349.478 5.146 30 20 EKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1cc2ccccc2o1 741840214 KPWRVDGSDQYLDW-KTKRTIGZSA-N 346.304 5.270 30 20 EKED O=C(/C=C\c1sc2ccccc2c1Cl)c1ccc2c(c1)COC2 742435870 BERGMOVJUTVQFZ-FPLPWBNLSA-N 340.831 5.481 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)(C)C 744034902 FXENSNLSZSUYPH-PMDBQALLSA-N 332.856 5.118 30 20 EKED N#Cc1csc(/C=C2\CCSc3ccc(Cl)cc3C2=O)c1 748441500 KQSKNKHTNDQONY-IZZDOVSWSA-N 331.849 5.035 30 20 EKED CC(C)CCCCCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 749026524 YDBPJGXMMSZTSK-CQSZACIVSA-N 347.409 5.214 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 756227065 NVCNMJCOXKIKKL-BBRMVZONSA-N 334.444 5.300 30 20 EKED Cc1ccc(C=NOCc2nc(C)c(-c3ccc(Cl)cc3)o2)cc1 768513031 VCCXMGMQDNGNHO-UHFFFAOYSA-N 340.810 5.163 30 20 EKED CCCc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 770480185 JTGFGYZHGYKSMP-UHFFFAOYSA-N 344.462 5.028 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)C(C)(C)C)n2)cc1 815910838 JHSSIMFLRYIRCA-HNNXBMFYSA-N 340.492 5.367 30 20 EKED Cc1ccc(N(C)C(=O)c2ccccc2-c2ccccc2C#N)cc1C 917805206 DNCYXANDHOTXLY-UHFFFAOYSA-N 340.426 5.119 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cc(C)ccc1F 189879082 OMBKHYHTPVWWRG-UHFFFAOYSA-N 341.426 5.004 30 20 EKED Cc1c([C@H](C)NCc2cccc(OCCCC#N)c2)oc2ccccc12 191724514 KVLIYDRZWSZPGG-KRWDZBQOSA-N 348.446 5.275 30 20 EKED C=C(C)CN(CC)C(=O)c1oc2ccccc2c1COc1ccccc1 301998079 OTBUOSOHJMZRKO-UHFFFAOYSA-N 349.430 5.050 30 20 EKED Cc1ccc(N=C(O)C2CC2)cc1N=C(O)C[C@H]1C[C@H]2CC[C@H]1C2 328753412 DHCBNQRRQVLVSF-CWRNSKLLSA-N 326.440 5.407 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCc3ccc(C(C)C)cc32)CC(O)=N1 329724420 DDFBGLYDCKHIJR-YQVWRLOYSA-N 342.483 5.289 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(C#N)cc2Cl)c(C)c1 426145363 ZRFJSZTZROLPJV-AWEZNQCLSA-N 341.842 5.053 30 20 EKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3ccc(F)cc3)c3ccccc23)C1 450585525 QLWSPORWLIDTSR-CZUORRHYSA-N 349.434 5.220 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 461355623 VJFQRAATAKMWIX-GOSISDBHSA-N 328.799 5.011 30 20 EKED C=CCCCCNC(=O)c1ccccc1SCc1cccs1 471687078 WITLCWZHVVEENC-UHFFFAOYSA-N 331.506 5.127 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2cnco2)cc1 476138763 IIXDBOGKBODYBQ-UHFFFAOYSA-N 346.430 5.446 30 20 EKED Cc1cc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)oc1C 502409003 VWEDCWSAKQGHJE-MRXNPFEDSA-N 330.431 5.286 30 20 EKED C[C@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(C#N)cc1F 512296959 UNAXXWSMJLQJBC-VIFPVBQESA-N 340.732 5.125 30 20 EKED CCSc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512624070 HOVQVYCIXAJENO-ZIAGYGMSSA-N 328.456 5.221 30 20 EKED CCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600536 CGXPOLNVZNJHQF-HNNXBMFYSA-N 337.423 5.003 30 20 EKED COc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)c2ccccc12 531696465 BIQRQIIRUPCYKV-CVEARBPZSA-N 330.431 5.132 30 20 EKED N#Cc1csc(CNc2cccc(CSC3CCCC3)c2)c1 533218270 QFCRJPJGRDAVOP-UHFFFAOYSA-N 328.506 5.408 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F)c1ccccc1 533937477 ZSWVZLCTHZCLIX-CBGDNZLLSA-N 337.438 5.095 30 20 EKED C[C@H](Oc1ccc(Cl)cc1Cl)[C@@H](C)NCC(C)(C)CCC#N 554066403 HIIDVHMIMJSIFE-OLZOCXBDSA-N 343.298 5.069 30 20 EKED CC[C@H](NCC[C@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 556217348 MCZWVZVZERCRHL-MOPGFXCFSA-N 346.396 5.335 30 20 EKED COc1ccc(C(C)C)cc1CNc1ccccc1SCCC#N 594548149 CWMWTQZUCXMRIJ-UHFFFAOYSA-N 340.492 5.436 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1cccc(C#N)c1 599029150 CVSZYRANSPGEGF-NWDGAFQWSA-N 336.332 5.128 30 20 EKED CC(C)CCN(CCC(C)C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 603658126 NLXLVOVHAHSKIV-UHFFFAOYSA-N 343.515 5.414 30 20 EKED C[C@H](NCc1sc2ccccc2c1Cl)c1cccc(C#N)c1 610344670 DGMKLRFPQIOWHQ-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(C)C2 666865859 AFJYLXKYCAGWDN-ROUUACIJSA-N 326.484 5.333 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3sccc3C)cs2)cc1 733749741 WOMHOHZJOLIVFW-FPLPWBNLSA-N 325.458 5.385 30 20 EKED C[C@H](c1cccc(C(F)(F)F)c1)N(CC(F)(F)C(F)F)C1CC1 733897923 RAINGOLQURDGFG-SECBINFHSA-N 343.286 5.131 30 20 EKED CCCCCCCCC(=O)N1CCC(OCC2CCCCC2)CC1 742000677 RXUNILLRSWYCKO-UHFFFAOYSA-N 337.548 5.325 30 20 EKED CCCC[C@H](NCc1cccc(O[C@H](C#N)CC)c1)c1ccccc1 746046578 AGKGJKVKDRVYEF-UNMCSNQZSA-N 336.479 5.389 30 20 EKED Cc1csc(-c2ccc(N[C@@H](C)c3ccc(C#N)c(F)c3)cc2)n1 777659555 OCGVYIDDSHRPGI-ZDUSSCGKSA-N 337.423 5.302 30 20 EKED COc1cccc2cc(C(=O)/C=C/c3ccc(Cl)nc3Cl)oc12 779359811 WHYHQZJKTYIRCJ-FNORWQNLSA-N 348.185 5.039 30 20 EKED Cc1ccc(Oc2ccc(N[C@H](C)c3cccc(C#N)c3)cc2)nc1 785530671 VZSCHPDMDQYHMU-MRXNPFEDSA-N 329.403 5.227 30 20 EKED O=C(/C=C/c1c(OC(F)F)ccc2ccccc12)c1cccs1 916137038 IYYMEVYRHWNONT-CMDGGOBGSA-N 330.355 5.399 30 20 EKED CCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916650446 PSWZQTGWFCOLPC-MRXNPFEDSA-N 326.465 5.265 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccccc1F 189901013 AVKYQZPKXGMHLU-HNNXBMFYSA-N 325.427 5.420 30 20 EKED C[C@@H](Nc1ccc(Br)c(Cl)c1)c1cccc(C#N)c1 232191165 UEFUOMDWWJVEGJ-SNVBAGLBSA-N 335.632 5.147 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 410353616 OCDRSNASXLWDDQ-UHFFFAOYSA-N 338.838 5.121 30 20 EKED Cc1cc(CNc2ccccc2COCc2ccccc2)ccc1C#N 443966702 LWRZIZCFUWLVPW-UHFFFAOYSA-N 342.442 5.196 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C 468168356 LEPYZJCRSUWVEW-QGZVFWFLSA-N 326.484 5.081 30 20 EKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1sccc1C#N 484999191 AZPGGLDQPHAVLY-INIZCTEOSA-N 346.455 5.023 30 20 EKED CC[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 507692220 BNHFWZUYNFXVJR-QGZVFWFLSA-N 337.916 5.625 30 20 EKED C=CCOc1cccc(CN[C@@H](CC)c2ccccc2OC(F)F)c1 518270259 ZSUBQJBHNWFDLB-SFHVURJKSA-N 347.405 5.094 30 20 EKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1ccc(C#N)s1 540618586 WLTASBGSZVFXGM-KRWDZBQOSA-N 348.899 5.159 30 20 EKED C=CC[C@H](C)[C@@H](C)Nc1ccccc1CN(C)C(=O)c1cccs1 541206236 PDYCGAPMEIZPGW-JKSUJKDBSA-N 342.508 5.033 30 20 EKED CC(C)(C#N)c1ccccc1CNc1cccc(C(F)F)c1Cl 541799456 IFEVHNKSLIAPDA-UHFFFAOYSA-N 334.797 5.691 30 20 EKED N#Cc1cccc(C2(NCc3sc4ccccc4c3Cl)CC2)c1 567185096 HHYDJXLETGYLPJ-UHFFFAOYSA-N 338.863 5.205 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NCc2ccnc(C#N)c2)cc1 610956796 HRWFUQCHUHDYHF-MRXNPFEDSA-N 345.471 5.419 30 20 EKED C=CCCOc1ccccc1-c1ccc([C@H](N)CC(F)(F)F)cc1 629735750 FIBOPJWZOGGNPX-QGZVFWFLSA-N 335.369 5.261 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(C(F)F)CCCC1 685089292 JBRDOTHNMULWQI-UHFFFAOYSA-N 336.426 5.238 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)cc1 728700723 UXRISHNEGXABOC-MJSCBBHESA-N 333.431 5.216 30 20 EKED C/C(=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)(C)C 742537741 OYCFNWZAQAVNJA-HZMYXVCSSA-N 332.447 5.273 30 20 EKED C#CCCOc1ccc(CNc2ccc(COC(C)(C)C)cc2)cc1 752265742 MCXYBRHRPUQVMX-UHFFFAOYSA-N 337.463 5.016 30 20 EKED C=CC[C@@H](NCc1ccc(Sc2ccccc2)cc1)c1ccncc1 754058391 COHUEFFBKPETIS-JOCHJYFZSA-N 346.499 5.640 30 20 EKED C#CC[C@@H](NC(=O)c1sc2ccccc2c1Cl)c1ccccc1 757596476 CPJRWSQIYHZTQP-OAHLLOKOSA-N 339.847 5.049 30 20 EKED CC(C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)=C1CCCC1 765916173 RMCCDYLZIPKEGJ-QGZVFWFLSA-N 336.460 5.185 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1c(F)cccc1Cl 809159729 VNEGXOVNISVJJX-MDZDMXLPSA-N 343.810 5.499 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2CCC[C@H]2c2ccccc2)n1 835201796 ZOUUUSXQRHPEAD-YESZJQIVSA-N 338.476 5.027 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccsc2)cc1 915179213 BFCDFGNJVOBRBE-OJWOGGGRSA-N 344.439 5.055 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(F)cc2F)cc(C)c1OC(F)F 916128329 ZDTGPJNNZMQENN-ZZXKWVIFSA-N 338.300 5.079 30 20 EKED C=CCN(C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)C(C)C 920046940 NIMFDCGLFSWELW-KRWDZBQOSA-N 348.899 5.097 30 20 EKED Cc1ccc(C)c(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c1 1776133653 HMDGSDJXEWXMAB-ALCCZGGFSA-N 336.412 5.112 30 20 EKED C=CCc1ccccc1CNCCCCCCCCCCC(=O)O 1776188819 SEJOYICDBSZBAU-UHFFFAOYSA-N 331.500 5.100 30 20 EKED COc1ccccc1[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccccc1 181942900 OVPKIXJBCYGOMQ-HXOBKFHXSA-N 342.442 5.007 30 20 EKED Cc1sc([C@@H](C)NCCCCC#N)nc1-c1ccc(Cl)cc1 184946661 KCSIMOKVTSZVLP-GFCCVEGCSA-N 333.888 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1cccc(F)c1 189869715 ZWGVMOKXJUJGFN-HNNXBMFYSA-N 341.426 5.084 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1nc(Cc2ccccc2)no1 190891370 CLTCJNMPJXVIBB-CABCVRRESA-N 349.459 5.087 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cnn(C2CCCC2)c1 340446354 NGXVQNUQGGWRNY-UTKZUKDTSA-N 336.483 5.084 30 20 EKED CC(C)(C#N)CCCOc1cccc(OCCCC(C)(C)C#N)c1F 424100042 KJKNVHDFBOTWMC-UHFFFAOYSA-N 346.446 5.243 30 20 EKED Cc1ccnc(Oc2cc(N[C@H](C)c3cccc(C#N)c3)ccc2C)c1 442792620 OOFRUBCXWWWDDB-QGZVFWFLSA-N 343.430 5.536 30 20 EKED CC[C@H](N[C@H](C)c1ccc(Br)cc1)c1ccc(C#N)cc1 447541253 FYLXMAFKSDVPOY-ACJLOTCBSA-N 343.268 5.123 30 20 EKED N#CCc1ccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 471453735 UTZWJJOCGQYHIM-UHFFFAOYSA-N 346.817 5.325 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(Cl)c1 476117211 HNRXPDODWFWBDB-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C=CCN(Cc1ccccc1)C(=O)c1ccc(CCC(F)(F)F)cc1 502225265 IHHKWXPNJKEXMU-UHFFFAOYSA-N 347.380 5.010 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(C(F)(F)F)ccc1F 524830698 HZGKKKCUCHCWIH-UHFFFAOYSA-N 332.341 5.055 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)cc1 582211089 VZYMURJDQMNHFY-BTYIYWSLSA-N 336.504 5.397 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC)c1ccc(Cl)cc1 612299125 HZHSQMJQFXMTQB-KRWDZBQOSA-N 348.899 5.250 30 20 EKED C=C[C@@H](CC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1)c1ccccc1 617917763 IEUDDSJLAFDYNX-UWJYYQICSA-N 335.447 5.083 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(OCC#N)cc1 731211980 MDTRPMIXZQWCIP-CYBMUJFWSA-N 349.261 5.089 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3sccc3C)s2)cc1 734304824 XLPNMSVCDSLSNO-FPLPWBNLSA-N 325.458 5.385 30 20 EKED CCOc1ccc(/C=N/[C@@H](C)c2ccc(-c3ccncc3)cc2)c(O)c1 746392930 GDQUGOHUWPZODO-WTJYETQFSA-N 346.430 5.033 30 20 EKED Cc1ccoc1C(=O)/C=C\c1cc(C)c(OCc2ccccn2)c(C)c1 769784539 YPZHXVIDOHHLSK-FPLPWBNLSA-N 347.414 5.075 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H]1CC=C(c2ccc(F)cc2)CC1 780746299 YNHNYBAJKDSCLT-KXBFYZLASA-N 336.410 5.165 30 20 EKED O=C1/C(=C/c2ccc3cnccc3c2)CCc2[nH]c3ccc(F)cc3c21 782323268 LWDXBNJJBOFKAA-XNTDXEJSSA-N 342.373 5.068 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1cccc3cnccc13)C2=O 782889190 FFVUQEUYDOOOIZ-LFIBNONCSA-N 331.440 5.169 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1c[nH]c2cc(Cl)ccc12 782889575 IXEILOCYMXPCIM-DAXSKMNVSA-N 332.790 5.266 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1nccc2ccccc12 792103573 LJBAJVGSLPYUNN-BOLBYERCSA-N 332.447 5.018 30 20 EKED CCCc1occc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 798394102 CDMVDVNYOROOKB-FQEVSTJZSA-N 344.414 5.140 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1CC(C)(C)CO1 890166105 XWTSCKBNCSUXQW-QGZVFWFLSA-N 329.484 5.072 30 20 EKED Cc1ccc2ccccc2c1C[S@@](=O)CCCCC1(C#N)CCC1 899398059 UEUMKQFAZYDBCH-DEOSSOPVSA-N 339.504 5.261 30 20 EKED CCCCCCCC(=O)Nc1ccc(SCc2cccnc2)cc1 104984223 AZUMQJUFOHEOGZ-UHFFFAOYSA-N 342.508 5.673 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(C(C)(C)C)cc2)cc1 110656590 BMTGTWAKTIYNPT-KAMPRCONSA-N 333.431 5.171 30 20 EKED N#C[C@H](Sc1nnc(-c2ccc(Cl)s2)o1)C1CCCCC1 127040629 JFTXPKUNJPOUOM-NSHDSACASA-N 339.873 5.016 30 20 EKED Cc1ccccc1[C@H](N[C@H](C)c1ccc(OCC#N)cc1)C(C)(C)C 181866617 BVDNQLRCAOEMLI-UTKZUKDTSA-N 336.479 5.335 30 20 EKED Cc1cc(C)cc(C(=O)/C=C/c2csc(-c3cccs3)n2)c1 303353722 YEVOIZBBTQLFCC-AATRIKPKSA-N 325.458 5.385 30 20 EKED N#CCCC[C@H](NC(=O)c1cccc2ccccc12)c1ccccc1 352206579 NZBJHDSOFHOMKF-NRFANRHFSA-N 328.415 5.005 30 20 EKED C=C(C)[C@@H](NCc1ccc(C(F)(F)F)s1)c1ccc(F)c(F)c1 428880219 JCOKYVOWMNGOJI-OAHLLOKOSA-N 347.352 5.452 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)s1 429565545 IGGCJDNUIHBRPV-ZDUSSCGKSA-N 348.418 5.042 30 20 EKED CC(C)c1ccc2ncc(C#N)c(N3CC[C@@H](CC(F)(F)F)C3)c2c1 447684279 AAHRBSKVYFYMMD-ZDUSSCGKSA-N 347.384 5.009 30 20 EKED Cc1nc(C(C)C)ccc1CNc1ccccc1SC[C@H](C)C#N 453077077 AJTDVFFKAFTTFT-OAHLLOKOSA-N 339.508 5.377 30 20 EKED Cc1cccc(Cl)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 455160856 PAYMGVDSNUSIEL-QGZVFWFLSA-N 341.842 5.205 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(C#N)cc1 464361027 DONYAYMNAHLFGW-KRWDZBQOSA-N 340.426 5.058 30 20 EKED Cc1c(N[C@@H]2CCCCc3cc(C#N)ccc32)cnn1C1CCCC1 481992447 OFVCEESKVGIXCY-HXUWFJFHSA-N 334.467 5.058 30 20 EKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1c(Cl)cccc1Cl 483869182 YCPSMTSGLRBHCQ-UHFFFAOYSA-N 347.245 5.071 30 20 EKED Cc1nc2ccccc2nc1CSCc1ccccc1C(C)(C)C#N 486756700 ZKZFFHZDCGPUCK-UHFFFAOYSA-N 347.487 5.173 30 20 EKED CC(C)c1nc(COc2ccc(-c3ccc(C#N)cc3)cc2)cs1 515595112 WVOLRBQWZVYZBY-UHFFFAOYSA-N 334.444 5.384 30 20 EKED CCCCN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 519192606 MRZVTIHGHDXWEG-UHFFFAOYSA-N 349.434 5.147 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(Cl)c1 521796820 HJSRXNKSDDPAPC-GFCCVEGCSA-N 345.855 5.378 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(C#N)c1 530560766 TXOKDAXLUXZSOU-UHFFFAOYSA-N 338.838 5.316 30 20 EKED N#CCC[C@@H](NCc1cc(-c2ccccc2)cs1)c1ccccc1 533038001 SICSQHXWGVUYRQ-OAQYLSRUSA-N 332.472 5.550 30 20 EKED C=CCCC(=O)N(Cc1c(OC)ccc2ccccc12)C1CCCC1 590249084 LAVQCZVTMFHQMP-UHFFFAOYSA-N 337.463 5.086 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc3c(c2)CCCC3)c1 726743453 IMCUNZHXGQFDDE-JLHYYAGUSA-N 345.442 5.144 30 20 EKED C=CCN(C(=O)N[C@H](CCC)c1cccc(C(F)(F)F)c1)C(C)C 726851937 YEHFYQZAACXETJ-MRXNPFEDSA-N 342.405 5.153 30 20 EKED CC(C)C[C@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727664626 XLNMAXHSWJPMAA-UWJYYQICSA-N 334.463 5.353 30 20 EKED C=CC[C@H](NCc1ccc(-c2ccc(F)cc2C)o1)c1ccncc1 734510121 QZAUARUPHKCPRI-FQEVSTJZSA-N 336.410 5.196 30 20 EKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 735398756 MBYXUFJFBJQXKK-KBPBESRZSA-N 347.409 5.214 30 20 EKED N#C[C@H](NC(=O)C1CCCCCCC1)c1ccc(Cl)c(Cl)c1 741687878 VFGRTTPKKONRGR-INIZCTEOSA-N 339.266 5.035 30 20 EKED C=C(C)CNC(=S)Nc1ccc([C@H](C)Sc2ccccc2)cc1 752238892 BALYRNILHJJZDC-HNNXBMFYSA-N 342.533 5.402 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1nc2ccccc2s1 756519455 OJBLXMHIHOXFSW-ZJIFWQFVSA-N 338.476 5.079 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 768388062 DTUMNRWLXUHTOU-QZTJIDSGSA-N 337.463 5.084 30 20 EKED C[C@@H](Nc1cc(Cl)cc2cccnc12)c1ccc(C#N)c(F)c1 777626451 TYCYQGKPEFUJAW-LLVKDONJSA-N 325.774 5.072 30 20 EKED CCOc1cccc2cc(C(=O)/C=C\c3scnc3C3CC3)oc12 782304407 BIKVRPMLJFIDRF-HJWRWDBZSA-N 339.416 5.062 30 20 EKED O=C(/C=C\c1cccc(-c2cccnc2)c1)c1c(F)cccc1Cl 809158951 GBKPKGPRCJVWRV-KTKRTIGZSA-N 337.781 5.437 30 20 EKED Cc1nn(C)cc1C(=O)/C=C/c1ccc(-c2cccc(Cl)c2)s1 917519832 GIZCUOYRRSECEV-SOFGYWHQSA-N 342.851 5.007 30 20 EKED N#CCCC[C@H](N[C@H]1CCCc2c(Cl)ccnc21)c1ccccc1 926482062 XIDUQSIRZBGDMI-OALUTQOASA-N 339.870 5.137 30 20 EKED CCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443498 SJVPPZJXTIEFEZ-CQSZACIVSA-N 332.856 5.220 30 20 EKED CCN(C(=O)[C@@H](C)c1cc2ccccc2o1)[C@@H](C)c1ccc(C#N)cc1 176162046 DAOBUAPZXGDFDY-HOTGVXAUSA-N 346.430 5.018 30 20 EKED C[C@@H](NCC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 327791812 GOAHMTDCWLNHNO-GOSISDBHSA-N 326.443 5.041 30 20 EKED N#CCC[C@H](NC(=O)Nc1cccc(C2CCC2)c1)c1ccccc1 361798534 VJKAGMPNSAYJSD-FQEVSTJZSA-N 333.435 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(OCC)CCCC1 455243581 IVSCVCXEGBBHRQ-UHFFFAOYSA-N 344.499 5.009 30 20 EKED CN(CCCCC#N)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 522299486 JRYKXROFFAZUST-UHFFFAOYSA-N 349.356 5.023 30 20 EKED C=CCC[C@H](NCc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 532726052 QHIGUMOQFHVYRH-IBGZPJMESA-N 344.380 5.374 30 20 EKED Cc1c(C#N)cccc1NC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 535465621 BTEXEVHKZWSGDK-OAQYLSRUSA-N 347.462 5.359 30 20 EKED N#CC1(CC(=O)Nc2ccccc2COc2ccccc2)CCCCC1 596882425 RCUPEHGGUCSFMU-UHFFFAOYSA-N 348.446 5.068 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](CC)c1ccccc1 609639088 ROVMEFWPZDKESK-NRFANRHFSA-N 349.478 5.538 30 20 EKED COc1cc(CS[C@@H](C)c2ccc(C#N)cc2)ccc1OC(F)F 609824979 FDQRXNFKVQYNSO-LBPRGKRZSA-N 349.402 5.163 30 20 EKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1ccc2ccccc2n1 613290953 PVUGXNUCVQQYDT-HNNXBMFYSA-N 346.386 5.079 30 20 EKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)cc2c1 647379787 NQTVETFASPSJSZ-CYBMUJFWSA-N 338.457 5.034 30 20 EKED C=CCC[C@H](N[C@H]1CCCn2nccc21)c1ccc(C(F)(F)F)cc1 657929908 GULVKJKOENLYDM-IRXDYDNUSA-N 349.400 5.034 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1 727975419 TWVKWUHAHQKNAW-BHQIHCQQSA-N 330.227 5.019 30 20 EKED CC1(CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)CCCCC1 753541242 QXWHXEDJMRAHQV-INIZCTEOSA-N 338.476 5.347 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(F)c2ccccc12 806664098 ZWCCRMNUTOAVGZ-CVEARBPZSA-N 348.421 5.293 30 20 EKED C[C@@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2c(O)ccc(F)c21 815636488 WDHXYACIYDWCIZ-FHLIZLRMSA-N 338.426 5.104 30 20 EKED CC(C)[C@H]1/C(=C\c2cccc(C(=O)O)c2Cl)C(=O)c2ccccc21 1776308588 HCMWPJJMGOSING-BRVCPTFNSA-N 340.806 5.058 30 20 EKED N#C[C@H](C(=O)c1cccs1)c1nc(-c2ccc(Cl)cc2)cs1 46443600 CMKOIGNFRFGQHE-GFCCVEGCSA-N 344.848 5.015 30 20 EKED N#CCCn1cc(C(=O)CSCC2CCCCC2)c2ccccc21 58487526 KDZYBTNRTPQSFN-UHFFFAOYSA-N 340.492 5.051 30 20 EKED C=CCOc1ccc(CNC(c2ccccc2)c2ccccc2)cc1 60816223 GNEYPZRHSJJNCA-UHFFFAOYSA-N 329.443 5.131 30 20 EKED C[C@H](Nc1cc(Br)ccc1Cl)c1cccc(C#N)c1 61690922 SJUFIESKDXDHOR-JTQLQIEISA-N 335.632 5.147 30 20 EKED CCCCOc1ccc(NCc2ccc(O[C@H](C)C#N)cc2)c(C)c1 236704139 WLRLTMLDNAANHN-QGZVFWFLSA-N 338.451 5.077 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2F)s1)c1cccc(C#N)c1 237579737 QJRHFZKMXZQGKW-AWEZNQCLSA-N 336.435 5.277 30 20 EKED FC1(F)CC[C@@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 324393634 BJQPTZADHSHENL-LLVKDONJSA-N 347.249 5.002 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1csc(-c2ccccc2)n1 410344442 LEZPWDZZDTWWLZ-UHFFFAOYSA-N 348.471 5.110 30 20 EKED CCSc1cccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 430621855 KQBBOVGSOUIODI-AWEZNQCLSA-N 344.505 5.043 30 20 EKED CC(C)(C#N)CCCCN1CCc2sccc2[C@H]1c1cccs1 444597132 MGEOKZKQVJEKCV-SFHVURJKSA-N 344.549 5.477 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458805189 UFPQCOQZWLBXGF-NQIIRXRSSA-N 349.478 5.133 30 20 EKED C=C[C@@H](CC(=O)Nc1c(CCC)cccc1C(C)C)c1ccccc1 472835459 XZJUCEAAZPHRFQ-SFHVURJKSA-N 335.491 6.061 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1cccc2ccccc12)C(F)(F)F 510429203 VCHYEPRPXVUEAK-KRWDZBQOSA-N 334.385 5.363 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 512561681 XNJFWNAQWOFWGS-INIZCTEOSA-N 349.434 5.147 30 20 EKED N#Cc1csc(CNc2cccc(CSC3CCCCC3)c2)n1 516939702 JNPHLWFXBYDZLF-UHFFFAOYSA-N 343.521 5.193 30 20 EKED Cc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c2ccccc2n1 536012028 NSIJIYIZHCJCSF-UHFFFAOYSA-N 349.459 5.026 30 20 EKED CCN(C(=O)c1csc2ccccc12)c1ccc(C#N)c(Cl)c1 536972801 QMQLLVFHUGFANQ-UHFFFAOYSA-N 340.835 5.093 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1cccc(C#N)c1 537293828 INZOCWGZZURMPH-DJJJIMSYSA-N 328.406 5.274 30 20 EKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(C#N)c(F)c3)c2)oc1C 537452173 OQVJIYCUDLBEGU-CYBMUJFWSA-N 335.382 5.142 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccccc1C#N 542522945 OKIDTHQRZFEUSP-HXUWFJFHSA-N 332.472 5.002 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NC(=O)C1(C#N)CC(C)C1 575061634 KMQUTZLJNPIHLA-UHFFFAOYSA-N 336.460 5.025 30 20 EKED Cc1ccc(-c2ncco2)cc1NCc1ccc(C(C)(C)C#N)cc1 614057991 YRTGGUGBJHNACO-UHFFFAOYSA-N 331.419 5.063 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCc2cc(Cl)cc(Cl)c21 618804274 KNAICWNBOMJIJR-ROUUACIJSA-N 343.257 5.129 30 20 EKED CCc1nc2ccccc2n1N=Cc1ccc(-c2ccc(F)cc2C)o1 734299098 RLHJNSDAJUEDEJ-UHFFFAOYSA-N 347.393 5.188 30 20 EKED Cc1cccc([C@H]2CCCCCN2Cc2ccc(OCC#N)cc2)c1 735494665 HLLJJJLMAUKDAX-JOCHJYFZSA-N 334.463 5.015 30 20 EKED CC[C@H](C)C[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743094830 CMPBYUJFSGKGEE-FIKGOQFSSA-N 349.478 5.288 30 20 EKED CC1(C#N)CCC(Nc2ccc(OCc3cccc(C#N)c3)cc2)CC1 824119308 GUFYJZQVXZGLII-UHFFFAOYSA-N 345.446 5.022 30 20 EKED C=C(Cl)CSCc1coc(-c2ccc(Br)cc2)n1 920426648 SGPFXVQCEHYEOE-UHFFFAOYSA-N 344.661 5.090 30 20 EKED C[C@@H](NC(=O)N[C@H](CC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 61989501 VHFQBRRLFCZJGP-OXQOHEQNSA-N 349.478 5.096 30 20 EKED Cc1ccccc1-c1noc([C@H](C)SCCCC(C)(C)C#N)n1 161959909 JZWFCJHZAYMFHN-AWEZNQCLSA-N 329.469 5.169 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)NCC1CCC(C#N)CC1 282000101 XUKUQQZWSNIWCE-UHFFFAOYSA-N 341.499 5.214 30 20 EKED OC(=Nc1csc(-c2ccccn2)n1)C12CC3CC(CC(C3)C1)C2 329267319 GBTQEWFDZYUMQQ-UHFFFAOYSA-N 339.464 5.010 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)S[C@H](C)c2cccc(C#N)c2)n1 443138592 FDPTZRCYTFNZCJ-HUUCEWRRSA-N 349.459 5.472 30 20 EKED N#CCCCC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1 464532007 YBZYMZRQUJVLIM-UHFFFAOYSA-N 333.218 5.293 30 20 EKED N#CCCCCN[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 539970507 VLHKACQGIFEFMQ-SJLPKXTDSA-N 338.417 5.405 30 20 EKED N#Cc1cc(Cl)ccc1CSCc1ccc(C(F)(F)F)cn1 559953260 ZGIPGJGHEVKBBN-UHFFFAOYSA-N 342.773 5.059 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1OC1CC1 568134253 SESLMSVLLNOBSM-UHFFFAOYSA-N 335.447 5.332 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)C1CCCCC1 726317821 DUCOKKVRSIVPJE-ZFWWWQNUSA-N 326.465 5.079 30 20 EKED C[C@H](C#N)Oc1ccc(C=NN(c2ccccc2)c2ccccc2)cc1 727687797 PPQQSIMCMVOLMK-GOSISDBHSA-N 341.414 5.150 30 20 EKED CCCCCCCCCC(=O)Nc1ccc2c(c1)CCCC(=O)N2 728498554 WCQILVYGVCGFQF-UHFFFAOYSA-N 330.472 5.041 30 20 EKED CCCCCCCC(=O)N(Cc1ccccn1)Cc1ccccc1C 732761721 JHMHLMGDELDCBG-UHFFFAOYSA-N 338.495 5.279 30 20 EKED C#CCCOc1ccc(CN[C@@H](CC(C)C)c2cccs2)cc1 733325559 QYTHLHUEZXPNBE-IBGZPJMESA-N 327.493 5.027 30 20 EKED C=CC[C@H](NC(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1ccncc1 737854613 KKYPSCKJMJLSRL-UTKZUKDTSA-N 336.479 5.132 30 20 EKED CCCC(CCc1ccccc1)=NNc1oc(C(C)(C)C)nc1C#N 740761989 UITDBQGCZWNBQH-UHFFFAOYSA-N 338.455 5.045 30 20 EKED Clc1ccc([C@@H]2CCCC2=NNc2cnnc3ccccc23)cc1 741460614 OQMTZDBDCQWGQA-HNNXBMFYSA-N 336.826 5.019 30 20 EKED C[C@H](Nc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1 743473725 QIMXXMSSQFJUIO-INIZCTEOSA-N 346.405 5.449 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2cncc3ccccc23)c1 772808592 WROFFBNKZKZWQE-BQYQJAHWSA-N 339.341 5.041 30 20 EKED C[C@@H](CC(=O)OCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 783859025 RAKQCXGZHZPUHN-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED C[C@@H](SCC(=O)Nc1ccc2ccccc2c1)c1cccc(C#N)c1 785537166 MTGQJZWIWABXKK-OAHLLOKOSA-N 346.455 5.144 30 20 EKED CCCC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 786317872 FRBUVCKGPBGVRI-HNNXBMFYSA-N 326.465 5.203 30 20 EKED Clc1ccc2c(NN=C3CCC[C@H]3c3ccccn3)ccnc2c1 794858703 SWLZXWLMJNYQMT-AWEZNQCLSA-N 336.826 5.019 30 20 EKED CSc1ccccc1[C@@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 800023484 CPMFOZAYYRXZNW-WBVHZDCISA-N 339.460 5.100 30 20 EKED COc1cccc2cc(/C=C\C(=O)c3cc4cccc(OC)c4o3)oc12 916130435 VFYTYHXGRVINHV-KTKRTIGZSA-N 348.354 5.092 30 20 EKED CCC/C(C)=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920323766 JQYLFUKRPBCVGU-LMRWQKIVSA-N 344.867 5.386 30 20 EKED Cc1cccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c1C 1777443819 LKFNNZVKINEGTN-SOFGYWHQSA-N 336.412 5.112 30 20 EKED N#CCCC[C@H](N[C@@H]1CCSc2ccc(F)cc21)c1ccccc1 340453906 RTALYRDIPMJSDX-RBUKOAKNSA-N 340.467 5.387 30 20 EKED N#Cc1cc(NC(=O)c2ccoc2C2CC2)ccc1Oc1ccccc1 409949633 CVHPLWILNSTFDX-UHFFFAOYSA-N 344.370 5.073 30 20 EKED Cc1ccc(C#N)cc1NC(=O)Nc1ccc(CCC(F)(F)F)cc1 440286539 RYISFGIKRLPULW-UHFFFAOYSA-N 347.340 5.006 30 20 EKED C=CCC1(C(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)CCC1 478969925 WLSBJCCBHDUFDG-CQSZACIVSA-N 340.492 5.042 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485724294 QZHBDJNNHZPQEF-CYBMUJFWSA-N 347.817 5.066 30 20 EKED N#CCCCOc1cccc(N[C@@H](CCc2ccccc2)C(F)F)c1 498752651 MCVNQGQWYPZWDQ-IBGZPJMESA-N 344.405 5.048 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](c1cccs1)C1CC1 505001227 QGSLGHLZQTXVTR-GOSISDBHSA-N 326.465 5.140 30 20 EKED N#Cc1cc(NCc2ncc(-c3cccc(Cl)c3)o2)ccc1Cl 515664757 DSTOKPXMQLYYOE-UHFFFAOYSA-N 344.201 5.132 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cc(OC)c(OC)cc1F)c1ccccc1 539045909 BZHWAQXFUVLGEO-KXBFYZLASA-N 343.442 5.201 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cc(C)ccc1OC 539627192 OAADMUARKKNCCH-FQEVSTJZSA-N 338.451 5.249 30 20 EKED N#CCc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 555073875 UZQGAEHDCXFCAQ-LJQANCHMSA-N 344.380 5.012 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCC(C)(C)CCC#N)cc1 558244529 BXMRUZIOEQHYLM-QGZVFWFLSA-N 336.479 5.343 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cc(C)on1)c1ccc(C(F)(F)F)cc1 569654119 YZELVQHMODXYJE-XJKSGUPXSA-N 338.373 5.360 30 20 EKED C[C@@H](Nc1cccc(Br)c1Cl)c1cccc(C#N)c1 600854310 ROIRLDQUVSZLIQ-SNVBAGLBSA-N 335.632 5.147 30 20 EKED CC(C)(C)[C@@H](NCc1ccc(C#N)cc1F)c1cc2ccccc2o1 611524482 JDDTUZCEJBCAFG-FQEVSTJZSA-N 336.410 5.321 30 20 EKED CCOc1ccccc1[C@@H](CC)NCc1ccc(C(C)(C)C#N)cc1 614179053 AHCVXVHTKCBAET-HXUWFJFHSA-N 336.479 5.127 30 20 EKED Cc1cc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc(C(F)(F)F)c1 619449937 RAHMCXRZGFGDNY-OAHLLOKOSA-N 346.352 5.040 30 20 EKED CCCC(=CC(=O)Nc1ccccc1S[C@H](C)CC#N)CCC 770728701 DCKASTCHJHXARN-OAHLLOKOSA-N 330.497 5.546 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772240121 ZZKRGWIVCCJQJH-ZLGUVYLKSA-N 347.462 5.137 30 20 EKED C#CCCCCC(=O)Nc1cc(Cl)ccc1NCc1ccccc1 773431187 MDEQWCDQORNEKT-UHFFFAOYSA-N 340.854 5.084 30 20 EKED C#CCCCCCC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 781014728 RJPHIVRUKVTNFZ-LJQANCHMSA-N 349.474 5.066 30 20 EKED C=C(C)[C@H](N[C@@H](CC)c1ccc(C)cc1O)c1ccc(F)c(F)c1 794815812 PNIMYKGIIYPKSF-ICSRJNTNSA-N 331.406 5.337 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccnn2C(C)C)cc1 794942878 RNDZANAOSJBILS-OUKQBFOZSA-N 346.430 5.036 30 20 EKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)CC(F)F 892523259 ZQMQOXJGDKZMQQ-ZDUSSCGKSA-N 348.418 5.058 30 20 EKED Cc1ccc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915086198 IEXKUDVWYRPYET-QFIPXVFZSA-N 340.426 5.211 30 20 EKED CCCOc1ccc(/C=C\C(=O)c2ccc(F)cc2F)cc1OCC 916128285 UVSPJJMIMRETPE-UITAMQMPSA-N 346.373 5.048 30 20 EKED Cc1c(NN=C2CCC[C@H](c3ccccc3)CC2)cccc1C(=O)O 1776088766 HJEMADDMUYQCJZ-KRWDZBQOSA-N 336.435 5.209 30 20 EKED Cc1cc(NN=Cc2csc3ccc(C(=O)O)cc23)ccc1Cl 1776105027 LWGGUKBLSKHENG-UHFFFAOYSA-N 344.823 5.007 30 20 EKED COc1cccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)c1 207732186 WBYMLUXMNPQEKW-VBKFSLOCSA-N 347.439 5.031 30 20 EKED CC[C@@H](C#N)Oc1cccc(CNc2ncc(-c3ccccc3)s2)c1 301551838 YNNIRHGHKSJOFH-KRWDZBQOSA-N 349.459 5.103 30 20 EKED C[C@@H](Nc1ccccc1OCc1ccccc1)c1cccc(C#N)c1 310848234 ABWGRZSBYYIKSQ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED CC(C)(C#N)CCCCN1CCCC[C@@H]1c1nc2ccccc2o1 375401440 DOMFCGWPYVRNJT-QGZVFWFLSA-N 325.456 5.075 30 20 EKED Cc1cc(C(F)(F)F)ccc1CNc1cccc(OCCCC#N)c1 442987429 BTHSQYCUBGYSLY-UHFFFAOYSA-N 348.368 5.309 30 20 EKED Cc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)ccc1C1CC1 481902777 HVZZVAQXFSZHFK-UHFFFAOYSA-N 349.434 5.199 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C[C@@H]1C 505058688 YYMIUFVLUGCKHK-FXAWDEMLSA-N 334.463 5.215 30 20 EKED C[C@H](c1ccccc1)N(Cc1cccc(OCCCC#N)c1)C1CC1 506602532 QCOIBYSDTLPEBE-GOSISDBHSA-N 334.463 5.095 30 20 EKED Cc1ccc(CN[C@@H](C)c2ccc(C#N)cc2F)c(OC(C)(C)C)c1 512668182 TVAKGQFOBDAJTJ-HNNXBMFYSA-N 340.442 5.034 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CC/C=C/c1ccccc1 523112883 JZFNBOOWGKLKKF-UXBLZVDNSA-N 346.474 5.036 30 20 EKED COc1ccc([C@H](CCC#N)NCc2cccc(Cl)c2Cl)cc1 562592656 QAPSZBPYBIYANG-KRWDZBQOSA-N 349.261 5.137 30 20 EKED C=CCC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 563574790 BCLVWIXUMYLDOJ-IBGZPJMESA-N 344.380 5.374 30 20 EKED CC[C@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1 564039498 IAFDPVLOAYBHEA-CJNGLKHVSA-N 327.497 5.114 30 20 EKED Cc1cc(C#N)ccc1CS[C@H](C)c1nc(-c2ccccc2C)no1 614394781 SJQLCWLIIPJVAS-OAHLLOKOSA-N 349.459 5.220 30 20 EKED CC1=CC(=NNc2ncnc3sc(-c4ccccc4)cc23)CCC1 727253815 KMTTUNPWMIHEMO-UHFFFAOYSA-N 334.448 5.256 30 20 EKED C[C@@H](CC#N)OC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 733708940 FHJBJASMNNASLS-VIFPVBQESA-N 340.231 5.181 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744037578 YLLDGHVZPKPBEU-WBVHZDCISA-N 340.492 5.593 30 20 EKED FC(F)Oc1cccc(CON=Cc2cccc(Cl)c2Cl)c1 747810377 LWBVHNLBAGZHQO-UHFFFAOYSA-N 346.160 5.146 30 20 EKED N#Cc1ccccc1NC(=S)Nc1cccc(-c2cccs2)c1 751025454 AMRONFDWJAHLAY-UHFFFAOYSA-N 335.457 5.096 30 20 EKED CCSCc1cccc(N[C@@H](C)c2ccc(OCC#N)cc2)c1 777697851 WVOMSGWVKGMFRO-HNNXBMFYSA-N 326.465 5.015 30 20 EKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1cccc2ccccc12 788343147 DIYOUSKOEVMYMY-HJWRWDBZSA-N 333.334 5.211 30 20 EKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1csc2ccccc12 793445161 OGICYIYJLJFVIM-CQSZACIVSA-N 348.471 5.193 30 20 EKED CCCCCCCC(=O)N1CCc2sccc2[C@H]1c1cccs1 888828129 UPLCEGPOXWQLHE-IBGZPJMESA-N 347.549 5.644 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1OCCCC 1776787095 POWWZUUTLGFNDY-LJQANCHMSA-N 349.515 5.159 30 20 EKED C[C@H](Nc1ccc(COCc2ccccc2)cc1)c1cccc(C#N)c1 179929441 HEVZVBSEAFBFCE-SFHVURJKSA-N 342.442 5.448 30 20 EKED COc1ccc2ccccc2c1-c1cc(CSCCCC#N)on1 191004618 NURXMLXLRXDHEQ-UHFFFAOYSA-N 338.432 5.040 30 20 EKED Cc1c(N[C@H](C)C(C)C)cccc1/C(O)=N/CC1CCC(C#N)CC1 331265566 HCJIRKGKIXZRHY-WWDZGPRUSA-N 341.499 5.086 30 20 EKED C=CCC[C@@H](NCc1nc2ccc(F)cc2s1)c1ccccc1 428865195 VLRYUVYRCPADSK-MRXNPFEDSA-N 326.440 5.233 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H]1c1nc2ccccc2s1 433952852 HZZCZPLLUSFPOT-KBXCAEBGSA-N 333.460 5.066 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCCC1(C)C 444858834 LJPHXMBYSCINEG-SFHVURJKSA-N 339.483 5.086 30 20 EKED CC[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 447534451 XJMICEZNNMMZKU-UGSOOPFHSA-N 332.369 5.379 30 20 EKED N#CCCCC(=O)Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1 463071362 QQQAGFXWWHRECM-UHFFFAOYSA-N 347.443 5.109 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(OC3CCCC3)c2)cc1 474697351 LEAOZRLZNMLINP-UHFFFAOYSA-N 348.446 5.061 30 20 EKED CCSc1ccc([C@H](C)NCc2ccc(Cl)cc2C#N)cc1 480899804 QEQZAPXOCKAPFU-ZDUSSCGKSA-N 330.884 5.174 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)s1 503362886 ACZUHVMMWTUHSL-RTBURBONSA-N 346.455 5.078 30 20 EKED Cc1csc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3F)c2)n1 512282895 XYALXGGIKFSHSO-CYBMUJFWSA-N 337.423 5.302 30 20 EKED C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1F 512637472 WEXIWBPEWXPRTG-APPDUMDISA-N 346.858 5.238 30 20 EKED Cc1nc(C)c(C#N)c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 515851380 YFENRPFHOYQWOF-VIFPVBQESA-N 338.263 5.125 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2C)C[C@H]1C)c1ccccc1 533948468 VOCVAEIBGHEUQH-SFHLNBCPSA-N 333.475 5.059 30 20 EKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(F)c1 582519596 QEZDGZKGYSIPGQ-CQSZACIVSA-N 333.366 5.058 30 20 EKED CC(C)c1ccc([C@@H](NC(=O)CCCCC#N)c2cccs2)cc1 593953925 GKDSGGREOSYRSF-HXUWFJFHSA-N 340.492 5.161 30 20 EKED CCCN(C(=O)CCCCC#N)[C@H](C)c1ccc(Cl)c(Cl)c1 593963916 AJTMLECFIWZGME-CYBMUJFWSA-N 341.282 5.377 30 20 EKED N#CCCC[C@H](N[C@@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 599048377 MOXIWAWABDSZQV-VQTJNVASSA-N 342.845 5.491 30 20 EKED C#Cc1cccc(N(CC)C(=S)Nc2ccc3ccccc3c2)c1 728447552 HUURQDAQQJFILH-UHFFFAOYSA-N 330.456 5.044 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(OC(F)F)c(Cl)c2)s1 731490214 VHAJUBLQZQBLCE-HWKANZROSA-N 328.767 5.207 30 20 EKED N#Cc1c(Cl)nsc1N[C@H]1CCc2c1ccc(Cl)c2Cl 733302372 QUBRVTJWPFNBQL-JTQLQIEISA-N 344.654 5.074 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(O)c(F)c2)cc1 741468204 UTIGPSHNLJXHQF-XYOKQWHBSA-N 348.373 5.103 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc(Cl)nc1 748999789 YXXFAPFXSVEPMH-VQHVLOKHSA-N 340.835 5.063 30 20 EKED CCc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 750682026 SLFFAUSKJNTDDO-MRXNPFEDSA-N 348.471 5.013 30 20 EKED Oc1nc2ccccc2cc1C=Nc1cccc(CCC(F)(F)F)c1 753565185 XAIQFCRHZBFXIH-UHFFFAOYSA-N 344.336 5.186 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc3ccc(C)cc3o2)c1 756043713 UHMUHQGZWMLOON-APWZRJJASA-N 348.446 5.273 30 20 EKED CCc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 770146504 QEAKLZORNNWMDH-JOCHJYFZSA-N 340.426 5.157 30 20 EKED FCCC[C@H]1CCCC1=NNc1ncc(C(F)(F)F)cc1Cl 800805012 HVCGQHCIRNWQDC-SECBINFHSA-N 337.748 5.072 30 20 EKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)c1 151288685 UFKXKWGPWSODIZ-NQIIRXRSSA-N 349.478 5.051 30 20 EKED COc1ccc2oc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)c(C)c2c1 153714402 VWHYEVRIRWLLLZ-GJZGRUSLSA-N 334.419 5.033 30 20 EKED C[C@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccc(C#N)cc1 154328912 FIXQWFJCQONYPC-VHSXEESVSA-N 325.264 5.338 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(S[C@H](C)c2cccc(C#N)c2)o1 189844576 KYDWVMIXOOYGAZ-KDOFPFPSSA-N 349.459 5.336 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccccc1 189867973 JYPYBCWCTGIBCM-UHFFFAOYSA-N 325.477 5.269 30 20 EKED CC(C)C[C@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 236649581 LJACLCPMNJGZTK-QFIPXVFZSA-N 336.479 5.246 30 20 EKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)Nc1c(C(C)C)cccc1C(C)C 280971195 IMYZQFHCIQWITL-JXFKEZNVSA-N 344.499 5.036 30 20 EKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1O 287616898 JOTOQGGRPSXPAM-ROUUACIJSA-N 328.843 5.131 30 20 EKED CC[C@@H](N[C@H]1CCCOc2c(Cl)cccc21)c1ccc(C#N)cc1 447580149 NGYJJQSFPDBFCM-MOPGFXCFSA-N 340.854 5.166 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)o1)c1nc2ccccc2s1 478728542 POQYRTYUMRXWLR-CQSZACIVSA-N 344.395 5.046 30 20 EKED CCN(Cc1cnc(-c2ccccc2)s1)[C@@H](C)c1ccc(C#N)cc1 497610646 KOKDOEHTTNKBFL-INIZCTEOSA-N 347.487 5.265 30 20 EKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)sc12 515505421 XHLRANHGMBNNNS-CYBMUJFWSA-N 340.473 5.280 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCC2CC2)cc1Cl 523708512 CDPXETPHUCHSGU-SFHVURJKSA-N 338.838 5.124 30 20 EKED C[C@H](Nc1ccccc1COCc1ccccc1)c1cccc(C#N)c1 573229985 OCEBHGOLEAEFIK-SFHVURJKSA-N 342.442 5.448 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1cccc(-c2ccccc2)c1 610812785 QVQYQFJMBDFYPN-MRXNPFEDSA-N 330.406 5.215 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCSc2c(Cl)cccc21 618807011 SPHUXIYBIGSLDP-MSOLQXFVSA-N 340.879 5.026 30 20 EKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)C1CC(F)(F)C1 628342917 UCTSVSNHDDVCNU-QMMMGPOBSA-N 341.286 5.063 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1nc2ccccc2s1 726427148 FPAXPUVMPRYQEA-ZHACJKMWSA-N 348.452 5.316 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1sccc1SC(F)F 732644495 UCFIVYKTRJELAI-UHFFFAOYSA-N 345.480 5.271 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1ccc2ccccc2n1 735231328 RUDWIVJMSLQOQO-UHFFFAOYSA-N 340.835 5.083 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(Cl)nc2)cc1 749005506 KVTZGPRBTHLQFW-WUXMJOGZSA-N 349.817 5.307 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)c1 763292263 LBQOSWAXWAPHPB-VQHVLOKHSA-N 341.382 5.293 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1c[nH]c2cccc(F)c12 789891518 YXBLPTRWHMITGS-UHFFFAOYSA-N 336.410 5.411 30 20 EKED O=C1/C(=C/c2cocn2)CCCCCCCCC/C1=C\c1cocn1 790212284 SSJBFPMOPJXQQE-OTYYAQKOSA-N 340.423 5.223 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc2ccccc2c1)c1ccccc1 814479723 GCYUOIROWKXPOR-NRFANRHFSA-N 343.430 5.396 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccc(C(F)(F)F)cc1 915963672 JRGJPULNUVTJBI-UHFFFAOYSA-N 329.325 5.090 30 20 EKED CC(=NNc1cccc2ncccc12)c1sc(C(C)(C)C)nc1C 915964615 FXSPWJZNKVFWEK-UHFFFAOYSA-N 338.480 5.133 30 20 EKED CC[C@H](C)c1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776697997 BXFURCPMUQGJFV-KUJHUBHOSA-N 334.415 5.038 30 20 EKED Cc1cccc2c1[C@H](C)/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1777455842 FTVKNMKQPPPUOO-DZZSIBQASA-N 348.423 5.291 30 20 EKED CCC(CC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443727 YHRIJTZNEYDRHP-AWEZNQCLSA-N 332.856 5.076 30 20 EKED CC(C)c1ccc(CN(C(=O)Nc2ccc(CC#N)cc2)C2CC2)cc1 76084962 KBEQOENNOJTRJF-UHFFFAOYSA-N 347.462 5.073 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C)s1 191427044 UORDAUAGAHNCDC-UHFFFAOYSA-N 342.508 5.572 30 20 EKED Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)n1[C@@H]1CCC[C@@H](C)C1 245647454 UIAKLCXTDCJOMM-HBUWYVDXSA-N 340.496 5.063 30 20 EKED C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246732916 NGSPGTATYDWYTO-BZUAXINKSA-N 345.512 5.123 30 20 EKED N#CCC[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 301786370 LXXVXJZPYVYGBH-HNNXBMFYSA-N 349.312 5.071 30 20 EKED N#Cc1ccc(CNC(c2ccccc2)c2ccccc2)c(Cl)c1 326088489 ZJJVFVZJYNARAC-UHFFFAOYSA-N 332.834 5.091 30 20 EKED Cc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c(Cl)c1 329985354 DEKIRVFSCVHRAG-UHFFFAOYSA-N 334.847 5.162 30 20 EKED COC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340446645 GSAWYTGMKFNISJ-WOJBJXKFSA-N 342.870 5.052 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@]1(C)C[C@@H]1c1ccccc1 413743380 GICBADQGKHUESR-OFNKIYASSA-N 333.475 5.671 30 20 EKED C[C@H](Sc1ccccc1C#N)c1nc(-c2ccc(Cl)cc2)no1 466638252 YSASCDCITCPWFK-NSHDSACASA-N 341.823 5.115 30 20 EKED CC(C)C(=O)Nc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1 481989573 JFFGFTMTYSBCFV-NRFANRHFSA-N 347.462 5.032 30 20 EKED C=CCCc1ccccc1NC(=O)NCc1ccc(C(F)F)cc1 505004302 BVMFSMRVRHUEHH-UHFFFAOYSA-N 330.378 5.065 30 20 EKED Cc1sc(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c(C#N)c1C 518702422 SQDVHJCBAPJLGM-MSOLQXFVSA-N 346.455 5.132 30 20 EKED C=C[C@@H](CC(=O)N(C)[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 535452640 XYNFBKCECHPDEM-HNAYVOBHSA-N 347.380 5.108 30 20 EKED C[C@@H](NCCCC(C)(C)C#N)c1ccccc1OCc1ccccc1 538225492 CDKZTCNRTSVUDL-GOSISDBHSA-N 336.479 5.246 30 20 EKED Cc1cc(Cl)c2ccccc2c1NCCCC1(C#N)CCOCC1 538612214 WTAOSKLQAQULSG-UHFFFAOYSA-N 342.870 5.314 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 542551729 UYDJUEYRMBIAHQ-LSDHHAIUSA-N 332.513 5.482 30 20 EKED COc1cc(C)c([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1C 543425435 ZBIHVCXZULBBFB-QGZVFWFLSA-N 338.451 5.168 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(F)cn1 543961577 XWIYARNOPIOLSO-CVEARBPZSA-N 345.421 5.171 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 551209454 CIUNAAYRHGRTMF-VQIMIIECSA-N 334.488 5.987 30 20 EKED C[C@@H](CCc1c(F)cccc1F)N[C@@H](CCCC#N)c1ccccc1 551222461 LJJJLDDPLLZBDY-KKSFZXQISA-N 342.433 5.311 30 20 EKED CCCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](CC)c1ccccc1 558352022 YXDHOWDKZKIFCV-HXUWFJFHSA-N 335.451 5.148 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cccc(F)c1Cl 568426823 URAXMLSQULTDGW-GFCCVEGCSA-N 334.847 5.343 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1 588759431 MPWIECYLLHQVSY-UHFFFAOYSA-N 326.827 5.420 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(NC(=O)[C@H](C)CC(=C)C)c(C)c1 619323252 ABRHUBFUAKHFDZ-DLBZAZTESA-N 342.483 5.077 30 20 EKED Cc1c(C(=O)/C=C/c2cccc(OCCCC#N)c2)oc2ccccc12 726743627 NNGFWHOONLLOHI-VAWYXSNFSA-N 345.398 5.320 30 20 EKED CCCCCOc1ccc(C(=O)/C=C/c2cccc(OCC#N)c2)cc1 730151307 JZUFQQNLWJTJIP-MDWZMJQESA-N 349.430 5.054 30 20 EKED CCOc1ccc(C=Nc2ccc(COC3CCCC3)cc2)c(O)c1 739427806 ZXNMAPHRKGCOBR-UHFFFAOYSA-N 339.435 5.001 30 20 EKED COc1cccc2cc(/C=C\C(=O)c3c(C)[nH]c4ccccc34)oc12 750904784 IEEYJIGYJZAHIG-KHPPLWFESA-N 331.371 5.127 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)c1 763292512 PBVIJBJHRGPTJX-WEVVVXLNSA-N 347.389 5.004 30 20 EKED C=CCC[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 778597979 HHULOCSKPXNHOD-IAGOWNOFSA-N 346.455 5.223 30 20 EKED C[C@@H](c1cccc(C#N)c1)N(C)Cc1ccc(SC(F)F)cc1 782180988 NMFNRPJTXNOAFO-ZDUSSCGKSA-N 332.419 5.066 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1Cl 792108779 YZMZAHXPRFYKPJ-QIXNEVBVSA-N 346.817 5.168 30 20 EKED C[C@H](CC(=O)OCC(C)(C)CCC#N)c1ccccc1C(F)(F)F 798877225 QMYAQGBNRBUNQW-CYBMUJFWSA-N 341.373 5.072 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(N=Cc2cc(Cl)ccc2O)cc1 915113065 MSVNPWLWDRIMPJ-HXUWFJFHSA-N 346.817 5.452 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C/c1cc(C)c(C)cc1C 1776783288 MSEMAKCZFMFRSX-RQWLHQTBSA-N 345.527 5.418 30 20 EKED COc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1Cl 112532362 YEUAQSXYGFYTGA-AWEZNQCLSA-N 344.842 5.204 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccc3oc(C(C)(C)C)nc3c2)cc1 156652284 REWSAVVIUNEIOI-CQSZACIVSA-N 349.434 5.028 30 20 EKED CC1(C)CCC[C@H](C/C(O)=N/CC[C@@H]2C(O)=Nc3ccccc32)C1 328793617 SALWFNZUVXHHNO-ZBFHGGJFSA-N 328.456 5.325 30 20 EKED CSc1cc(/C(O)=N/[C@H]2CC23CCCCC3)ccc1N=C(C)O 329128330 VIFIAKNFMISRFR-INIZCTEOSA-N 332.469 5.044 30 20 EKED OC(=Nc1cccc(C/N=C(/O)[C@H]2CC23CCCC3)c1)C1CCC1 330000711 WYSNQCRSHVPOMM-QGZVFWFLSA-N 326.440 5.112 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@@H](CCC#N)c1ccccc1 353314783 NJYLXAQNECYXLB-LEWJYISDSA-N 334.463 5.052 30 20 EKED Cc1sc(CN[C@@H]2CCCCc3cc(C#N)ccc32)nc1C(C)C 360837957 AAKUKCARDOTLGX-GOSISDBHSA-N 339.508 5.004 30 20 EKED C[C@H](N[C@H](C)c1nccs1)c1ccc(-c2cccc(C#N)c2)cc1 367805497 XFBYVZFXGNXIIH-LSDHHAIUSA-N 333.460 5.094 30 20 EKED CC(C)[C@@H]1CN(C(=O)N[C@H](CCC#N)c2ccccc2)c2ccccc21 447752535 HACUYVCGXQTSAN-VQTJNVASSA-N 347.462 5.001 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 466382845 ZSJRPGGQDOMMSL-UHFFFAOYSA-N 337.448 5.003 30 20 EKED C[C@H](c1cccc(C(F)(F)F)c1)N(CCCC(C)(C)C#N)C1CC1 472428189 DMTXWCGYGDUQNC-CQSZACIVSA-N 338.417 5.561 30 20 EKED N#CC[C@H](CC(=O)N[C@H](c1ccccc1)C1CCCC1)c1ccccc1 475028982 HOVMCBHVVMPRFZ-FYYLOGMGSA-N 346.474 5.122 30 20 EKED Cc1nc(SCc2ccccc2C(C)(C)C#N)c2ccccc2n1 486983289 CWOBGVARVPCASV-UHFFFAOYSA-N 333.460 5.032 30 20 EKED C[C@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)cc1F 512282391 MGOFUZDXRKOZQW-HNNXBMFYSA-N 338.426 5.330 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(OC(F)(F)F)cc1 513647227 GWNZCRTVWUXVKX-UGSOOPFHSA-N 348.368 5.259 30 20 EKED Cc1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)s1 541084300 IIKCDRNIFRPEOY-AWEZNQCLSA-N 347.487 5.149 30 20 EKED N#Cc1cc(Oc2ccc(NCc3cc(Cl)cs3)cc2)ccn1 565332234 FKJKZTHIDCCUJG-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CC(C)N(C(=O)CCCCCC#N)c1ccc(Cl)c(Cl)c1 588904414 JNHIBJKKLGRGFR-UHFFFAOYSA-N 327.255 5.209 30 20 EKED C[C@@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccsc1 609970482 JORLFYYVNBHAOW-CQSZACIVSA-N 348.427 5.154 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/c3ccsc3)cc2)c1 731331811 RISWIUDYQBOPNV-RUDMXATFSA-N 346.411 5.064 30 20 EKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 735398758 MBYXUFJFBJQXKK-UONOGXRCSA-N 347.409 5.214 30 20 EKED CC1(C)CCC(=NNc2nc(C(F)(F)F)nc3ccccc23)CC1 735972471 FAHCONBXMBPOIN-UHFFFAOYSA-N 336.361 5.017 30 20 EKED COc1cc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)ccc1SC 736433562 GRPVOULARDMQQM-FPLPWBNLSA-N 347.505 5.067 30 20 EKED CC(C)Oc1ccccc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990499 QVESCJSQBQRIHP-VAWYXSNFSA-N 343.426 5.432 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)o2)cc1 761804898 UIQQPYLJPQDHOG-YHVDPYDOSA-N 343.382 5.134 30 20 EKED C#CCCCCC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 773290836 BUOMWCRWQBVGNI-QGZVFWFLSA-N 325.477 5.032 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1ccc2cnccc2c1 782326093 BIURHIYRJVPASB-SOFGYWHQSA-N 336.460 5.193 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2c(F)cccc2Cl)c1 809159422 PIOSZBNVYCYVDJ-MDZDMXLPSA-N 343.785 5.058 30 20 EKED O=C(/C=C/c1cccc(-c2ccccn2)c1)c1c(F)cccc1Cl 809159767 WFXYQXNCUUUBSR-ZHACJKMWSA-N 337.781 5.437 30 20 EKED CC(CCCCCCC(=O)O)=NNc1nc(-c2ccccc2)cs1 814769288 LYOIYNICDYRBIX-UHFFFAOYSA-N 345.468 5.023 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc2ccccc2c1O 841763354 VWZHPUBDMJHYPU-IVZQSRNASA-N 342.442 5.145 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)OC(=O)CCCCC#N)s2)cc1 847649197 DEBBOISAUVVDGU-HNNXBMFYSA-N 342.464 5.115 30 20 EKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1csc(C2CC2)n1 920367936 DYGMTRYZYCHSEK-UHFFFAOYSA-N 347.487 5.057 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2c(F)cc(C(=O)O)cc2F)cc1 1776700070 UMTCXJAHBMKHLV-JLVNDZCYSA-N 344.357 5.073 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)cc1 110655646 JKGQCEMUBDSEBV-YJJOXIQCSA-N 333.431 5.072 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)c(F)c1 152862189 UTQHERPZAXDDOR-LLVKDONJSA-N 347.390 5.003 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1cccc(Cl)c1 175211185 DXKRUGUVUXLBJK-CUXKMMBLSA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCO[C@H](C(C)C)C1 276460163 NTRKHCBUIOUPBP-PXNSSMCTSA-N 343.511 5.318 30 20 EKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(-c2ccccc2)cc1 277839223 KOHSTKFNOZZMIL-DEOSSOPVSA-N 339.504 5.322 30 20 EKED CC[C@H](NC(=O)c1sc2ccc(C#N)cc2c1C)c1cccs1 429899946 DWXXTASREKLJQT-AWEZNQCLSA-N 340.473 5.024 30 20 EKED Cc1ccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c(Cl)c1 431241400 BVYFVKHRGCDRTK-UHFFFAOYSA-N 340.835 5.296 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(CCC(F)(F)F)cc1 440277893 CELMZYHUTAMOGE-UHFFFAOYSA-N 342.405 5.392 30 20 EKED N#CCCCC(=O)Nc1cc(Cl)ccc1Sc1ccccc1 463111099 XCARJXTVRLJGGU-UHFFFAOYSA-N 330.840 5.124 30 20 EKED CCN(CCC#N)[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 471195889 VWYOGRSFJZYPBE-JTQLQIEISA-N 338.295 5.021 30 20 EKED Cc1ccc([C@@H](Nc2ccc(C#N)c(Cl)c2)c2ccccn2)cc1 480578537 NLFZXIVTUDYFMU-HXUWFJFHSA-N 333.822 5.117 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1ccccc1Sc1ccccc1 531309583 QJKXCEWAKVECGI-UHFFFAOYSA-N 344.439 5.270 30 20 EKED Cc1c(COc2ccccc2)cccc1NCc1ccc(C#N)s1 537718801 VSKVJDNCQVRKLP-UHFFFAOYSA-N 334.444 5.119 30 20 EKED CCCCN(C(=O)NCC(C)(C)CCC#N)[C@@H](CC)c1ccccc1 558083633 PFBDWHDIKKHWBE-IBGZPJMESA-N 343.515 5.279 30 20 EKED N#CC1(c2ccc(C(=O)Nc3cccc(-c4ccccc4)c3)cc2)CC1 565263784 VTOGDABSYQCMCW-UHFFFAOYSA-N 338.410 5.161 30 20 EKED CC(C)(C)c1ccc(-c2cc(NC(=O)CCCCCC#N)on2)cc1 588361935 RPUDLZPGEOJNCP-UHFFFAOYSA-N 339.439 5.052 30 20 EKED CC(C)(C)c1ccc([C@H](NCc2cccc(C#N)c2)C(F)(F)F)cc1 604484035 MWGIFQZAQBULSM-SFHVURJKSA-N 346.396 5.249 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@]12CCCC[C@H]1C2(F)F 613902281 ZATIJLYCPOSKOT-YLJYHZDGSA-N 347.449 5.693 30 20 EKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 647377366 GQDOFNFANWCGNM-HNNXBMFYSA-N 342.489 5.011 30 20 EKED C=CCN(C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)C(C)C 728867433 MRPIEURUULUENE-UHFFFAOYSA-N 348.421 5.078 30 20 EKED Cc1ccsc1C(=O)/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 733749600 PTKLSFNPXXENOG-ALCCZGGFSA-N 339.372 5.121 30 20 EKED Cc1cccc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)c1C 734305644 ZANSBLLPPFDCNI-DHZHZOJOSA-N 343.426 5.174 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccc(-c2ccccc2)o1 754708984 HDBQSCXGQWHRQR-UHFFFAOYSA-N 331.293 5.378 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCCCc1ccc(C(F)(F)F)cc1 779739974 CSERYHDVJWCJHO-AWEZNQCLSA-N 348.368 5.041 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)s1 902884385 GYEIWXFIHHUKGP-TZMCWYRMSA-N 338.398 5.463 30 20 EKED C=CC1(CC(=O)Nc2cc(C(=O)O)c3ccccc3c2)CCCCC1 1776149558 GJUMPQUBNPWFJY-UHFFFAOYSA-N 337.419 5.003 30 20 EKED Cc1cccc2c1CC/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1777457218 GLQLYUOWWCARPA-UKTHLTGXSA-N 348.423 5.120 30 20 EKED CCCc1ccc([C@H](NCc2cccc(C#N)c2)c2cccs2)cc1 22817860 WDFHUASVIXCCTK-QFIPXVFZSA-N 346.499 5.451 30 20 EKED N#C[C@@H](C(=O)c1cc2sc3ccccc3c2s1)c1ccccn1 41492814 FQVXITRASDBWRF-GFCCVEGCSA-N 334.425 5.001 30 20 EKED COc1cc(C(=O)/C=C/c2cccc(F)c2)ccc1SC(F)F 63874763 NSPMOYKFJYRBBT-FNORWQNLSA-N 338.350 5.045 30 20 EKED COc1ccc2cc([C@@H](C)N[C@H](CCC#N)c3ccccc3)ccc2c1 90665696 YKRUXWGNILMACI-UZUQRXQVSA-N 344.458 5.544 30 20 EKED Cc1nc(-c2cc([C@@H](C)NCC(C)(C)CCC#N)cs2)cs1 348248789 XMYSHXJEFYZEAX-GFCCVEGCSA-N 333.526 5.161 30 20 EKED CC(C)(C#N)CCCCNC1(c2c(Cl)cccc2Cl)CC1 444683053 DCHOUXUSDFFABY-UHFFFAOYSA-N 325.283 5.292 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455900915 CXSBIDLKGLORDL-NRFANRHFSA-N 347.462 5.245 30 20 EKED CN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCC(C)(C)CC1 458799722 JYNLXODBJJROOV-IBGZPJMESA-N 341.499 5.032 30 20 EKED CCC(CC)c1cc(CNc2ccc(C#N)cc2C(F)(F)F)on1 462908653 CJVWTYKQVUTQPY-UHFFFAOYSA-N 337.345 5.081 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1 466659319 YDIIJWWNSGPQBK-SJORKVTESA-N 337.463 5.142 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 469304835 UNTFXYFZDSRKAY-UHFFFAOYSA-N 347.245 5.539 30 20 EKED COc1cccc(CCCNc2ccccc2S[C@@H](C)CC#N)c1 470539303 WFHKQKQLPUCFPT-INIZCTEOSA-N 340.492 5.134 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)C)nn1CC 476132352 FGUKHTXJOPKRSS-UHFFFAOYSA-N 339.483 5.131 30 20 EKED C=C(C)[C@H](NCc1cnc(CC(C)C)s1)c1ccc(F)c(F)c1 479384703 CAHVJDZSYAFBCU-SFHVURJKSA-N 336.451 5.027 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)oc2ccc(Cl)cc12 494609427 OXEMWEBTBOEMIZ-UHFFFAOYSA-N 345.185 5.172 30 20 EKED C=CCCc1ccccc1NC(=O)N(CCC(F)(F)F)CC1CC1 505041055 YGICCOLQBKWXPI-UHFFFAOYSA-N 340.389 5.002 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2Nc2ccccc2)c1 552359887 ZHMUNFHBERASAR-UHFFFAOYSA-N 347.805 5.208 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cncc(Br)c1)c1ccccc1 578643980 IVKSDPZWBZRGRZ-KBXCAEBGSA-N 345.284 5.202 30 20 EKED N#C[C@H](Cc1ccccc1)N[C@H](CCc1ccccc1)c1ccccc1 603955317 QKWHUDNCRNOIQB-BJKOFHAPSA-N 340.470 5.085 30 20 EKED Cc1cc(Cl)c(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1Cl 611051284 FEXCTVFRSLTNGX-NSHDSACASA-N 348.233 5.056 30 20 EKED C=C[C@](C)(CC)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 685383480 FYAOPQRZQZTVPP-IUODEOHRSA-N 328.309 5.001 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 729892417 YGFQUILHLWXNIH-ZBFHGGJFSA-N 326.465 5.059 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 734079634 SONVSRZHSXVLPU-LSDHHAIUSA-N 326.465 5.079 30 20 EKED C=CC[C@@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1ccncc1 734234549 QLFWETYILDYTCN-OAQYLSRUSA-N 334.463 5.177 30 20 EKED COc1cccc2cc(C(=O)/C=C/c3cnc(C(C)(C)C)s3)oc12 736432669 DPZUDQVWIXKBJQ-CMDGGOBGSA-N 341.432 5.092 30 20 EKED COCc1cccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)c1 742434317 HFGYFIWBXBOGRR-VAWYXSNFSA-N 349.455 5.161 30 20 EKED Fc1cccc(Cl)c1CCC=NOc1ccccc1C(F)(F)F 755815124 FTSSIDALKMEDGV-UHFFFAOYSA-N 345.723 5.495 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(F)c(Br)c1)c1ccccc1 773113874 GIQGKZUFNBJKPM-ACJLOTCBSA-N 346.243 5.003 30 20 EKED CC(C)CC[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351478 CUFRNYQPLYBMLL-UTKZUKDTSA-N 349.478 5.288 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 90665365 GMQPQDZGKCGLHW-KBXCAEBGSA-N 343.268 5.145 30 20 EKED CCCCCCCC[S@@](=O)Cc1csc(-c2ccco2)n1 190742141 DWTIFKRUSZRHGE-OAQYLSRUSA-N 325.499 5.012 30 20 EKED CSc1ccccc1[C@@H](C)Nc1cccc(OCCCC#N)c1 194945797 IDERVLUSEXSPEJ-OAHLLOKOSA-N 326.465 5.264 30 20 EKED COc1ccc2cc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)ccc2c1 327312113 VRSSVNCPFMYRTR-JKSUJKDBSA-N 330.431 5.132 30 20 EKED CC(C)(C)c1cnc(CCC(O)=Nc2cccc3c2CCCC3)o1 330134649 SBNHNDKEPJDGJF-UHFFFAOYSA-N 326.440 5.072 30 20 EKED N#CCCC[C@H](NC(=O)c1cccc(C2CCC2)c1)c1ccccc1 352205150 CQIYMHFCBXDDCJ-NRFANRHFSA-N 332.447 5.119 30 20 EKED CC(C)(c1ccc(NCc2ccc(CC#N)cc2)cc1)C(F)(F)F 432321543 GMYZYXCESNMXOS-UHFFFAOYSA-N 332.369 5.205 30 20 EKED Cc1ccc(F)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 482343319 PUCIESXKYJDJOS-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(C)s1 505001815 XTIWOKNIZUFYDE-SFHVURJKSA-N 340.492 5.544 30 20 EKED CC(C)Oc1ccc([C@H](C)NCC2CCC(C#N)CC2)cc1Cl 560235717 WKVVGZNZAALTAW-FHERZECASA-N 334.891 5.108 30 20 EKED Cc1ccc2sc(CN[C@H](CCCC#N)c3ccccc3)nc2c1 599426584 JFKWEZLKQWECOG-QGZVFWFLSA-N 335.476 5.130 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 605953062 WQDIRRVRPAPKIU-OAQYLSRUSA-N 348.446 5.130 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccccc1Cl 609387305 WPPKSTNJACGOHC-KBPBESRZSA-N 330.884 5.765 30 20 EKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(C(C)(C)C#N)cc1 614170656 IQOQORSHGKIQHU-HNNXBMFYSA-N 349.503 5.290 30 20 EKED C=CCN(Cc1ccccc1F)Cn1ccc(=S)c2ccccc21 731659441 CDYKPPGTDKLZKA-UHFFFAOYSA-N 338.451 5.156 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C)cc3)o2)c1 750894690 BALIJGBNCARCEO-ZRDIBKRKSA-N 345.398 5.110 30 20 EKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 776081292 MQWAIRDXOSCHLW-KGLIPLIRSA-N 347.409 5.214 30 20 EKED CCCCCCCCCCC(=O)N1CCCCC[C@H]1c1ncon1 787263911 YYLQXCSQVVGXNZ-KRWDZBQOSA-N 335.492 5.044 30 20 EKED C=C(C)[C@H](N[C@H](CC)c1ccc(C)cc1O)c1ccc(F)c(F)c1 794815821 PNIMYKGIIYPKSF-QUCCMNQESA-N 331.406 5.337 30 20 EKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCC1 838787812 KAYIIDWFTKGFPE-IAQYHMDHSA-N 344.867 5.076 30 20 EKED C=CCCCCC[C@H](C)N[C@H](C(=O)O)c1ccc2ccccc2c1 901514372 GMHPXAQOFJURNX-JXFKEZNVSA-N 325.452 5.080 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C 113570165 BFLDSAWUCSVLRM-CYBMUJFWSA-N 339.464 5.199 30 20 EKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccc(CC#N)cc2)c1 118009889 OPYIFFWOMBWWPL-NRFANRHFSA-N 347.462 5.210 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCS[C@@H](C(C)C)C1 191507368 UPKKBLAIAJPKDM-GOSISDBHSA-N 346.540 5.144 30 20 EKED N#CCCC[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccccc1 433030080 DIJTZLDFWZFVAY-LJQANCHMSA-N 349.409 5.005 30 20 EKED Cc1ccccc1-c1noc([C@H](C)S[C@H](C)c2cccc(C#N)c2)n1 443138587 FDPTZRCYTFNZCJ-CABCVRRESA-N 349.459 5.472 30 20 EKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1cccc(CC#N)c1 455925199 WTJZYZWXIRXWFP-QGZVFWFLSA-N 347.462 5.148 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 474071069 CECRJYUFBFBYCF-CYBMUJFWSA-N 333.218 5.019 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(F)cc1 500745564 SKVSKFXNAVSTSU-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H](NCCCC#N)c1ccc(-c2ccccc2Br)s1 543428093 JMJRVHRPHTXLMA-GFCCVEGCSA-N 349.297 5.132 30 20 EKED Cc1cc(Cl)c(NC(=O)c2ccc(C#N)c(Cl)c2)cc1Cl 548288984 ANZKFCMYOMKPRQ-UHFFFAOYSA-N 339.609 5.079 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCCc3c2[nH]c2ccccc32)c1 567424469 CRHJLKPEGMQNGP-OAQYLSRUSA-N 345.446 5.340 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1 573824735 QKYOUPBRRIXIKD-HUUCEWRRSA-N 339.401 5.456 30 20 EKED CC[C@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 581041691 YNCALAHYHYESTA-MOPGFXCFSA-N 346.396 5.020 30 20 EKED O=C1/C(=C/c2csc(-c3ccccc3)n2)Cc2cc(Cl)ccc21 742437879 SARLXYFSRLVEGB-GXDHUFHOSA-N 337.831 5.286 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2ccc(-c3ccncc3)cc2F)c1 763292105 JCDBCLGKWZIORK-ALCCZGGFSA-N 335.353 5.231 30 20 EKED O=C(/C=C/c1cc(F)c(F)cc1F)c1cccc(-c2ccncc2)c1 767728287 DKXIFTBCWKBGFM-SNAWJCMRSA-N 339.316 5.062 30 20 EKED CCCc1ccc([C@@H](C)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772983579 LANVKWMILDQQFS-UTKZUKDTSA-N 336.479 5.171 30 20 EKED CCC(CC)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccs1 776161693 ZIDGYUHUHBVAGK-QRWLVFNGSA-N 342.508 5.479 30 20 EKED N#Cc1ccc(CSc2nnc(-c3ccccc3)s2)c(Cl)c1 783985707 GDORLNRYKVZZBW-UHFFFAOYSA-N 343.864 5.022 30 20 EKED N#C[C@H](C(=O)CCCC1CCCCC1)c1cc(C(F)(F)F)ccn1 813218798 ZOMBABOMDHIABV-HNNXBMFYSA-N 338.373 5.027 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccccc1SC(C)(C)C)c1ccncc1 815580186 FCGONVYYZLVPAW-QFBILLFUSA-N 340.536 5.940 30 20 EKED CC(C)N(C(=O)CCCCC#N)c1ccc(Nc2ccccc2)cc1 846833255 ZUEFYLFNJGLAMN-UHFFFAOYSA-N 335.451 5.256 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1sccc1CC#N 875277276 ZBMHZMFPLHCSLX-UHFFFAOYSA-N 344.505 5.266 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Nc1ccc(CCC#N)cc1 905855261 JXVNDGDTDJHCNO-KRWDZBQOSA-N 349.478 5.014 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C=C1CCCCC1 919895996 SCWBIFWNRKTDQP-UHFFFAOYSA-N 346.430 5.488 30 20 EKED O=C(O)c1ccc(NN=C2CCCC[C@H]2C2CCCCC2)cc1F 1776075328 AGQMIPSSPVMPAS-HNNXBMFYSA-N 332.419 5.062 30 20 EKED CC(C)c1ccc([C@@H](NCc2cccc(C#N)c2)c2cccs2)cc1 22817919 FXRYXOWDMHZZIL-JOCHJYFZSA-N 346.499 5.622 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1nc(Cc2ccccc2)no1 173829717 JBUALKHNTDVZJW-CABCVRRESA-N 349.459 5.087 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(F)c1 189883330 WXBZAAVHCHNGSD-OAHLLOKOSA-N 325.427 5.420 30 20 EKED C[C@@]12CC3CC(C(=O)[C@H](C#N)c4nc5ccccc5o4)(C1)C[C@](C)(C3)C2 250670420 WPVIGPASDHBOIO-DBKKHPRISA-N 348.446 5.001 30 20 EKED Cc1cccc([C@@H](Nc2c(Cl)cccc2C#N)c2ccccn2)c1 301906719 ZGVGEZJXIQPDOS-HXUWFJFHSA-N 333.822 5.117 30 20 EKED CCO[C@H](C)c1nc(CSCCCCC(C)(C)C#N)cs1 435893352 PJEHLZYEWFNHLB-CYBMUJFWSA-N 326.531 5.194 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(CC)ccc1CC 438856687 LMFGGABTOAGMPX-UHFFFAOYSA-N 349.478 5.127 30 20 EKED Cc1ccc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 440584587 WTJAHYBWVWCSDY-UHFFFAOYSA-N 349.415 5.365 30 20 EKED C[C@@H]1CCCc2ccccc2[C@H]1NCc1cccc(OCCCC#N)c1 462542361 MIAUPNMYFBRZDB-JPYJTQIMSA-N 348.490 5.172 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(C)(C)C)cc1 463013501 SHZPZEMZFJQTNH-UTKZUKDTSA-N 336.479 5.560 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)[C@@H](C)c1cccc(C#N)c1 464397292 RMMOGNPEAAIJQJ-AWEZNQCLSA-N 348.833 5.416 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccccc1F 476123800 QAYPRKFWNZEPIF-HNNXBMFYSA-N 341.426 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(OC)c(C)c1 476176867 ZRDKVKISKLFQPT-UHFFFAOYSA-N 337.463 5.416 30 20 EKED C=CCN(C(=O)C[C@@H]1C=CCCC1)c1nc(-c2ccccc2)cs1 487604860 HEFLKMAJOLOWJU-MRXNPFEDSA-N 338.476 5.076 30 20 EKED CC(C)Oc1ccccc1[C@H](C)NCc1ccccc1C(C)(C)C#N 540324094 OGEQMXNMEMGAHB-KRWDZBQOSA-N 336.479 5.126 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(CC#N)cc3)cs2)o1 542221502 FZLIBABSGLKPNT-UHFFFAOYSA-N 340.473 5.211 30 20 EKED C=CCC[C@H](Nc1ccc(NC(=O)c2ccccc2)cn1)c1ccco1 560535668 CTMQRRDXWGCUPF-SFHVURJKSA-N 347.418 5.046 30 20 EKED C=C[C@@](C)(CC)c1nc([C@H](CCCOC)c2ccc(Cl)cc2)no1 583050683 CPRWPWIKKLAODZ-APWZRJJASA-N 348.874 5.135 30 20 EKED N#CCCCCCC(=O)N[C@H](c1cccc(Cl)c1)C1CCCC1 588654517 XXSQLTCXPNDUBD-IBGZPJMESA-N 332.875 5.162 30 20 EKED CC[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCCC1 590067685 GJQNALNKDRKRJW-VQTJNVASSA-N 341.499 5.080 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@@]3(C#N)CCC[C@H](C)C3)sc2c1 609736838 RDUZLZSSRHOUCN-SGTLLEGYSA-N 346.883 5.065 30 20 EKED C[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1cccc(C#N)c1 610878453 KPTZHGZKGXEWFA-JTQLQIEISA-N 349.768 5.032 30 20 EKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cc(F)ccc1F 614179195 KBMKAIQIAMHUGY-IBGZPJMESA-N 328.406 5.007 30 20 EKED Cn1cc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)c2ccccc21 727973967 CQIBOYOAXKWKFG-VAWYXSNFSA-N 344.439 5.198 30 20 EKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 735398757 MBYXUFJFBJQXKK-KGLIPLIRSA-N 347.409 5.214 30 20 EKED CCCCc1oc2ccccc2c1CNCc1cc(C#N)ccc1F 742381912 RPINWEKWJPWTFA-UHFFFAOYSA-N 336.410 5.076 30 20 EKED Cc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1[N+](=O)[O-] 744868997 PKSGBTRVPNNZIN-PLNGDYQASA-N 342.203 5.168 30 20 EKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1O 775522920 BRLHUEIJPUIUJR-ROUUACIJSA-N 328.843 5.131 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc2sc(C)nc2c1 776891272 GGQPVSJZNQDVDS-UHFFFAOYSA-N 340.473 5.135 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](F)Cc1ccccc1 789720702 WZIMKCXUZYRFLZ-IBGZPJMESA-N 325.427 5.058 30 20 EKED O=C(/C=C/c1ccc(OCC(F)F)cc1)c1c(F)cccc1Cl 809159603 SKIKVDOQGVHFFW-RMKNXTFCSA-N 340.728 5.019 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1ccncc1 858365923 VBWWMQYGBBXGAE-SJKOYZFVSA-N 338.348 5.208 30 20 EKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1cc2ccccc2o1 921261493 FWLMEYZFHIMZDL-YFHOEESVSA-N 346.304 5.270 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776114711 YOLHWOFOEZFGGS-GDNBJRDFSA-N 342.394 5.256 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc(C2(C(=O)O)CC2)cc1 1776786046 GKLOHKVLOOCLAB-INIZCTEOSA-N 345.483 5.128 30 20 EKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1 56517830 ULZFNDGXNRRFGB-OAQYLSRUSA-N 341.414 5.080 30 20 EKED CN(Cc1cccc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 59337542 HCZYKNNTAACXBQ-UHFFFAOYSA-N 349.821 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(COC)cc1 194958485 VCWLTVPVJJACIZ-UHFFFAOYSA-N 338.451 5.329 30 20 EKED C=CC[C@@H](C)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 522646471 RRAMHPCQYDLRHB-MRVPVSSYSA-N 347.789 5.268 30 20 EKED CCO[C@H](C)c1nc(CSc2cccc(Cl)c2C#N)cs1 536733853 FGSVYETVEUVMDF-SNVBAGLBSA-N 338.885 5.058 30 20 EKED N#CCCC[C@@H](NC1CC(c2ccccc2Cl)C1)c1ccccc1 560563609 BIWPQTFIMYUQDT-WIXQSORDSA-N 338.882 5.611 30 20 EKED Cc1ccc(-c2ccc(CN[C@@H](CCCC#N)c3ccccc3)o2)cc1 562855083 DCAJCOJCBTWTAR-QFIPXVFZSA-N 344.458 5.780 30 20 EKED N#CCCCOc1cccc(NCCOc2ccc3ccccc3c2)c1 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QZPUJITXCJWBAK-DYESRHJHSA-N 336.479 5.163 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCCCC1 303345447 MKNKMBZFVGNZKT-JKSUJKDBSA-N 344.524 5.626 30 20 EKED COc1ccc(N=C(C)O)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 328992156 IRCNNMVOBJSPRS-BHYGNILZSA-N 344.455 5.498 30 20 EKED C[C@@H]1CC[C@@H](N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 429748833 CADUTCQGGIMVDR-CRAIPNDOSA-N 349.434 5.003 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1C(F)(F)F 471138404 YYMLSTDKNYGBCI-UHFFFAOYSA-N 348.368 5.316 30 20 EKED C=C[C@H](CC(=O)Nc1cccnc1-c1csc(C)c1)c1ccccc1 474328923 PRKWNYFLGYFQLS-MRXNPFEDSA-N 348.471 5.417 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(NC2CCCC2)c1)c1ccccc1 479976121 PJWLQVYHXCKQMN-GOSISDBHSA-N 347.462 5.067 30 20 EKED C=CCC(C)(C)CNC(=O)c1ccccc1SCc1cccs1 489905531 IICSAEKJFWMNPI-UHFFFAOYSA-N 345.533 5.373 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(-c2nc3ccc(C)cc3s2)cc1 505886195 ADBIVUWTTFNUBU-FQEVSTJZSA-N 349.459 5.150 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 507712874 GAXHJRWBABQPME-UHFFFAOYSA-N 330.884 5.194 30 20 EKED CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)CCCCCC#N 588760184 WATJCKHLQSWZLL-HXUWFJFHSA-N 348.918 5.750 30 20 EKED CC(C)(C#N)c1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 590121788 VLMCNHNXSACKBU-OAQYLSRUSA-N 331.463 5.013 30 20 EKED C[C@H](NCc1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 611080806 KRXLRQGAUGDXBA-NSHDSACASA-N 338.760 5.081 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1Cl 647280465 AXCLCFHKBVLANY-UHFFFAOYSA-N 341.263 5.275 30 20 EKED N#Cc1ccc(-c2cccc(CNc3nc4ccccc4o3)c2)s1 739890870 ZIXUULMUMJXWEL-UHFFFAOYSA-N 331.400 5.040 30 20 EKED O=C1/C(=C\c2csc(-c3ccccc3)n2)Cc2cc(Cl)ccc21 742437880 SARLXYFSRLVEGB-UVTDQMKNSA-N 337.831 5.286 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCC[C@@H](C)C3)n2)cc1 744034357 HCAIYEUDEXNAPY-HYVNUMGLSA-N 338.476 5.121 30 20 EKED C(=NNCc1cnc2ccccc2c1)c1ccccc1-c1ccccc1 764775569 OGYGJIABDGUCQY-UHFFFAOYSA-N 337.426 5.026 30 20 EKED N#C[C@@H]1CC[C@H](Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 799724430 MFEDGLNHFOBRIG-UPJWGTAASA-N 341.307 5.077 30 20 EKED COc1ccc2oc(/C=C/C(=O)c3c(F)cccc3Cl)cc2c1 809159763 WAYYGAZTVURQQM-FNORWQNLSA-N 330.742 5.130 30 20 EKED CCc1ccc(CC(Cc2ccc(Cl)cc2)=NOC2CCC2)nc1 812237046 IEQVCLCOMONJCZ-UHFFFAOYSA-N 342.870 5.008 30 20 EKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(C3CCCC3)cc2)c1 812755851 DUFLVRYXWPBKQD-QFIPXVFZSA-N 348.490 5.315 30 20 EKED Clc1ccccc1-c1ccc(C=Nn2cnc3ccccc32)s1 874102550 WHKYMABYLCCODE-UHFFFAOYSA-N 337.835 5.300 30 20 EKED C/C=C/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 915656350 SMLKRENTXBXDFO-YMPMVBQXSA-N 336.822 5.066 30 20 EKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)C(C)(C)C)c1 1776787454 RUFHAYOVBJFZJP-LJQANCHMSA-N 349.515 5.015 30 20 EKED N#CCc1cccc(C(=O)Nc2ccccc2SC2CCCC2)c1 49681552 HFZYUJGLFSGQRR-UHFFFAOYSA-N 336.460 5.040 30 20 EKED CC(C)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1Cl 115619944 IKSKMNNUWRSADF-FOIQADDNSA-N 342.870 5.118 30 20 EKED CCCCCCCC[S@@](=O)Cc1sc(C)nc1C(F)(F)F 190849110 ZUPRQZMPPFOPDK-OAQYLSRUSA-N 341.464 5.080 30 20 EKED N#CCCC[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 340442228 FGUKJIHAGWWWFL-RBUKOAKNSA-N 340.467 5.387 30 20 EKED CC(C)(C)c1cc(C#N)c(NC(=O)c2sccc2C2CC2)s1 411006237 JAGBDXDJXFWUFP-UHFFFAOYSA-N 330.478 5.108 30 20 EKED CC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1c(C)noc1C 411521994 ZPPPRSCSFVWNKN-NRFANRHFSA-N 345.446 5.071 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1C(C)(C)C 471120058 DASWZBJAXBVJFI-UHFFFAOYSA-N 336.479 5.594 30 20 EKED CC(C)(C#N)CCCSCc1cc(-c2ccc(Cl)cc2)no1 480365866 QMIWDKCEUZNLNR-UHFFFAOYSA-N 334.872 5.558 30 20 EKED C=C[C@H](CC(=O)Nc1cnn(C(CC)CC)c1CC)c1ccccc1 482686182 GKVWZPQVKFHQMC-MRXNPFEDSA-N 339.483 5.105 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 485411377 KBNWTWJVPGTCCD-UHFFFAOYSA-N 339.483 5.088 30 20 EKED Cc1ccc([C@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccccc2)cc1 512669336 ZONDXMYHDPWSCW-GAJHUEQPSA-N 344.433 5.446 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C)c1cccc(C#N)c1 540595069 UBRHSKWNDJKAIC-DYESRHJHSA-N 346.499 5.563 30 20 EKED C/C=C/c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 558298376 IPYARANZSVPOGZ-QHHAFSJGSA-N 335.407 5.046 30 20 EKED CC1(C)CN(Cc2cccc(OCCCC#N)c2)[C@@H]1c1cccs1 569968466 GOCYRZJFJTVMJE-LJQANCHMSA-N 340.492 5.014 30 20 EKED C[C@H](Cc1ccc(Cl)cc1)N[C@@H](CCCC#N)c1ccccc1 590069247 LDUATWVREHCEGV-UZLBHIALSA-N 326.871 5.296 30 20 EKED C=CCOc1cccc(CN[C@H](c2ccc(F)cc2)C2CCC2)c1 591699508 VXFAOUGSCJZZCQ-NRFANRHFSA-N 325.427 5.022 30 20 EKED CC(C)[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209171 ZOPJYEUDBWRINM-HXUWFJFHSA-N 349.434 5.003 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(COC(C)(C)C)cc1)c1ccccc1 681664795 ZWCLHRDDKZLPFG-FQEVSTJZSA-N 337.463 5.300 30 20 EKED C#C[C@@H](C)N(C)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 770566164 XIZYNKXYUMJOQC-HZPDHXFCSA-N 338.476 5.025 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(C#N)cc3F)s2)cc1 781108975 WCWUMVWCYAIBPT-VQHVLOKHSA-N 348.402 5.025 30 20 EKED COc1c(C)cc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1Cl 796990657 RMORCDQMMNRHMF-LBPRGKRZSA-N 349.261 5.033 30 20 EKED 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COc1ccc2[nH]cc(C(=O)/C=C/c3ccc(C(F)(F)F)cc3)c2c1 303648574 SUHNCCIOGHCPBT-RUDMXATFSA-N 345.320 5.091 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c1 328801388 ZGBNTSMQQZWYSM-SOUVJXGZSA-N 332.419 5.628 30 20 EKED CCc1ccc(CC)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 433001030 HCWDLNKSPQTOAH-FQEVSTJZSA-N 349.478 5.368 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCCC[C@@H]1C 475552543 WILLPOSRFONLCH-QFBILLFUSA-N 328.500 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(F)c1 476093150 YIGFZFVNPAKRRR-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(-c2ncco2)c1)c1ccccc1 489590745 LAPZHOKMFFFWSL-LJQANCHMSA-N 332.403 5.030 30 20 EKED CCc1cc(Cl)c(Cl)cc1OCCCC1(C#N)CCOCC1 499990978 PIDCOCCIKGQNBQ-UHFFFAOYSA-N 342.266 5.035 30 20 EKED CC(C)c1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 503629637 QGRQIMQRLQZITL-UHFFFAOYSA-N 345.446 5.003 30 20 EKED N#Cc1cc(Cl)ccc1NCc1ccc(Oc2ccccc2)nc1 511382940 WXGFFKPWYFITIG-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 551210131 WFZTWZDSANRMIM-AUUYWEPGSA-N 347.289 6.079 30 20 EKED N#Cc1ccc2c(c1)[C@@H](NCc1ccc(OC3CCCCC3)cc1)CC2 554997351 MIRNESNSJYUHMH-QHCPKHFHSA-N 346.474 5.047 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610356319 OVFBRSWVFHEYFW-LAUBAEHRSA-N 349.478 5.014 30 20 EKED N#Cc1csc(CNc2cccc(Cl)c2SCC(F)F)c1 610911090 PBERCDQKESWAFY-UHFFFAOYSA-N 344.839 5.242 30 20 EKED C#Cc1cccc(N(C(=S)Nc2ccc(F)c(Cl)c2)C(C)C)c1 728226664 IAGUCKFOJRODIH-UHFFFAOYSA-N 346.858 5.072 30 20 EKED CC(C)[C@H]1/C(=C\c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 766501467 GPUPDSQIHBAGID-GTENMVSRSA-N 346.455 5.225 30 20 EKED N#Cc1ccc(F)c(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774465329 VTQFCHLYZVNECX-GOSISDBHSA-N 349.236 5.245 30 20 EKED CC(=NNc1cc(Cl)ccn1)c1csc(-c2csc(C)n2)c1 777905131 BOQYFLNNQDZICF-UHFFFAOYSA-N 348.884 5.065 30 20 EKED C[C@@H](NCc1cccnc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 782383645 SXLZQNLIVCAKEB-OAHLLOKOSA-N 347.849 5.124 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccccc1Cl 796967323 DHQPTWSOLCHIHF-MDZDMXLPSA-N 343.810 5.499 30 20 EKED C=CCOc1cccc(NC(=S)Nc2cccc(Cl)c2C)c1 920074497 AEFHSEFQPCHALA-UHFFFAOYSA-N 332.856 5.022 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(-c2ccccc2)no1 926481294 SXOINSJLQONWEH-XLIONFOSSA-N 345.446 5.427 30 20 EKED Cc1cc(C)c(/C=C/C=NNc2ccc(Cl)c(C(=O)O)c2)cc1C 1776034770 XZWPBIQRVVZEHV-KHHAUUPUSA-N 342.826 5.075 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1cc(C)c(C(=O)O)c(F)c1 1776786079 IXLCTLOZIXLWGV-ZDUSSCGKSA-N 337.435 5.158 30 20 EKED CCn1nc(C)c(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c1C 60370815 SJQVPZDHUWJDTC-CCEZHUSRSA-N 330.431 5.083 30 20 EKED CC(C)(C#N)CCCSCc1csc(Cc2ccccc2)n1 161398418 VBOWYNROWLCMSX-UHFFFAOYSA-N 330.522 5.297 30 20 EKED CCCCN(CC)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 195635636 PLHOWPRGANCQRN-UHFFFAOYSA-N 337.423 5.004 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)s1 271515645 UDBSPVGNIPTCJQ-SWLSCSKDSA-N 334.872 5.106 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cccc(N2CCCC2=O)c1)c1ccccc1 358325548 FIXWYWBUPYCFAR-AVRDEDQJSA-N 348.490 5.172 30 20 EKED N#CCC[C@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 436389238 LVFOTHHPGLFHTF-INIZCTEOSA-N 348.233 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCC1(F)F 455247583 OOUVSDPKFOFWLM-OAHLLOKOSA-N 336.426 5.095 30 20 EKED CC(C)COc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512641122 DKHBLPDKGPEODG-HZPDHXFCSA-N 340.442 5.144 30 20 EKED C[C@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1F 512664953 CHJXOLWIDQLDKS-SJCJKPOMSA-N 336.332 5.042 30 20 EKED N#Cc1cccc(CN[C@@H](CCc2ccccc2)c2ccccc2)c1F 539277319 XIRYILLEBSDCLT-QFIPXVFZSA-N 344.433 5.161 30 20 EKED CC[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 561129867 CKWINSOJHJBVOA-HZPDHXFCSA-N 330.884 5.391 30 20 EKED C[C@@H]1C[C@@H]1[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 564426566 CPQQNVSKNCQWLH-WTXAKBKRSA-N 336.866 5.186 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@H]1CCSc3ccc(Cl)cc31)CC2 569413804 XOJPXPDOWKMINF-MSOLQXFVSA-N 340.879 5.026 30 20 EKED N#CCc1ccc(CN[C@@H]2CCCSc3ccc(Cl)cc32)cc1 584590125 MIZLZPAEOCRAFW-GOSISDBHSA-N 342.895 5.123 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1Cc2ccc(C#N)cc2C1 594058182 ISSIDUBYWQBTGJ-UHFFFAOYSA-N 347.462 5.353 30 20 EKED C=CCCCCCN(C)C(=O)c1ccc(Sc2ccccn2)cc1 606814909 XPIFSKYEZOACQP-UHFFFAOYSA-N 340.492 5.051 30 20 EKED N#CCN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccccc1 609502896 WJSCEPSGIYOMGK-UHFFFAOYSA-N 346.817 5.177 30 20 EKED Cc1cccc([C@@H](NCc2ccc(C#N)cc2F)c2cccc(F)c2)c1 619753517 IDBNCHFNIFQBRB-JOCHJYFZSA-N 348.396 5.024 30 20 EKED CCCCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 728116954 DWEUFXNKYVWFES-FQEVSTJZSA-N 335.451 5.196 30 20 EKED Cc1ccsc1C(=O)/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 733749166 GBWDOSDNKVXZPL-VURMDHGXSA-N 339.372 5.121 30 20 EKED CC(=NOCc1csc(C)n1)c1ccc(-c2ccc(F)cc2)s1 744179225 FRGMBUUGHLSGME-UHFFFAOYSA-N 346.452 5.260 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccccc1Cl 751511840 CKONXVFMJGSSHA-FPLPWBNLSA-N 331.849 5.421 30 20 EKED C=CC[C@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccncc1 766023012 ZEEOVUQTJZNYEX-VGSWGCGISA-N 329.447 5.112 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2cncc3ccccc23)c1 772808593 WROFFBNKZKZWQE-FPLPWBNLSA-N 339.341 5.041 30 20 EKED N#C[C@H](C(=O)/C(F)=C\C1CCCCC1)c1nc2cc(F)ccc2s1 815941694 KVMBISYJCSRXFO-SJWLEHQBSA-N 346.402 5.045 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)c(F)c1 1776076897 LCXDBKADMOGRSG-DYVFJYSZSA-N 348.462 5.554 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Cl)c1F 153624029 OPYLCLRFRXZYDJ-LLVKDONJSA-N 348.830 5.126 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1C[C@@H](C(C)=O)C1(C)C 276690315 XTULZOFIJIBNKW-MJGOQNOKSA-N 341.495 5.118 30 20 EKED CC(C)[C@@H](c1ccccc1Cl)N(C)CCCC1(C#N)CCOCC1 410375904 ZZPOEJRJFBVVLQ-IBGZPJMESA-N 348.918 5.069 30 20 EKED N#CCCC[C@H](NCCOc1cccc2ccccc12)c1ccccc1 433016184 OJFVAIPOCXAFQQ-QFIPXVFZSA-N 344.458 5.243 30 20 EKED Cc1cccc(Oc2ccccc2C(=O)[C@@H](C#N)c2nc(C)cs2)c1 442020951 HBEFKOXIXLUWNE-QGZVFWFLSA-N 348.427 5.042 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(F)c(Cl)c1 468952350 JTADFJDPDGXELM-LBPRGKRZSA-N 334.847 5.343 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473392905 VBIAQORCCKISLA-UHFFFAOYSA-N 337.341 5.004 30 20 EKED C[C@H](c1noc(-c2cn(CCCC#N)c3ccccc23)n1)C(C)(C)C 519565567 GHMJNOSSWBPFLZ-CQSZACIVSA-N 336.439 5.145 30 20 EKED CC(C)(C#N)CCCNc1cc([N+](=O)[O-])ccc1Nc1ccccc1 531649935 NNTYAAVLCYEGTM-UHFFFAOYSA-N 338.411 5.080 30 20 EKED C=CCC[C@@H](NCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 532725909 GRBQHCRSKGGACA-LJQANCHMSA-N 344.380 5.374 30 20 EKED C=CCC[C@@H](NCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 537129322 PLWROJIGFOZKFL-QGZVFWFLSA-N 338.417 5.632 30 20 EKED CC(C)[C@@H](NCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 540422125 BJAPBTIGPRGQJG-MRXNPFEDSA-N 326.406 5.322 30 20 EKED C=CCC[C@@H](NCc1cc(F)c(C(F)(F)F)cc1F)c1ccco1 562060395 XTZANGXDUQYKDS-OAHLLOKOSA-N 345.311 5.374 30 20 EKED C[C@@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2cccs2)o1 567539909 WPCIRQBRXIPBER-SECBINFHSA-N 347.852 5.176 30 20 EKED CCOc1ccc2c(c1)[C@H](C)CC(C)(C)N2C(=O)CCCCCC#N 588841823 PMWMCHWXGGSUST-MRXNPFEDSA-N 342.483 5.178 30 20 EKED C=CCOc1cccc(CN[C@@H](c2ccc(F)cc2)C2CCC2)c1 591699511 VXFAOUGSCJZZCQ-OAQYLSRUSA-N 325.427 5.022 30 20 EKED CC(C)Sc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 603872827 SGEGAXRVIKUNMP-UHFFFAOYSA-N 338.476 5.241 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)C3CCCC3)cc2Cl)cc1 604026579 BRFBZQAOAZTESD-UHFFFAOYSA-N 340.810 5.133 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 606920110 JWXXVVXSXXHJCN-CQSZACIVSA-N 342.405 5.154 30 20 EKED CC(C)CC(=O)Nc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 614056398 UHENBCKEMVRKGA-UHFFFAOYSA-N 349.478 5.084 30 20 EKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)CSc2ccccc21 727264259 PJOUCVHMAHGHEM-UVTDQMKNSA-N 335.453 5.182 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc(Cl)cc2)c1 727284293 VYLFUOMEZZGSBP-UHFFFAOYSA-N 332.856 5.104 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(O)c(C)c3)cs2)cc1 728231201 JTCFYFQSYQNCGN-NTMALXAHSA-N 335.428 5.029 30 20 EKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cnn(C(C)C)c2)c1 729644162 QPSIZQZWGYODFJ-VAWYXSNFSA-N 330.431 5.336 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1cnc(C(C)C)s1 758430947 SZQGEEVFGXOVKN-BQYQJAHWSA-N 334.510 5.225 30 20 EKED CC[C@H](C)[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 780311439 CCRPBJKXRFZURB-HUBLWGQQSA-N 346.883 5.322 30 20 EKED C=CCC[C@@H](Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccco1 796857394 SHXYNFULESLZQK-MRXNPFEDSA-N 344.842 5.179 30 20 EKED CCCCCCCC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1 936020026 FBDVEROQXQSNES-MRXNPFEDSA-N 344.524 5.363 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)c1sc2c(C)cccc2c1C 1776038197 WYAQAPZPEVSSOK-UHFFFAOYSA-N 338.432 5.052 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)cc1F 66907340 QLDDAIHMGJFEEG-NSHDSACASA-N 347.390 5.003 30 20 EKED N#CCCCOc1cccc(CNc2cccc(SC(F)F)c2)c1 129227159 ZLVIHQUPVUGCHY-UHFFFAOYSA-N 348.418 5.296 30 20 EKED C[C@@H](Oc1ccccc1NC(=O)c1cc(C#N)cs1)c1ccccc1 177072459 XSGIPPMAZLGFMI-CQSZACIVSA-N 348.427 5.012 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccc(F)c(F)c1 191507748 JFEXXYWUFQMNAT-ORAYPTAESA-N 333.426 5.019 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C)[C@H](C1)C2(F)F 297754720 KNPROFUFUMRMGV-LPHOPBHVSA-N 348.437 5.048 30 20 EKED C=CCN(CC1CCCCC1)C(=O)N[C@@H]1CCSc2ccccc21 303446534 IZJHTBQVPLYGCK-GOSISDBHSA-N 344.524 5.001 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]1 329126915 YUAYMJFVWGMUIF-BRWVUGGUSA-N 337.467 5.580 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC(C)(C)C1 332339768 PLEYIWZXQZVELA-OAHLLOKOSA-N 345.512 5.125 30 20 EKED N#CCCC[C@H](NCc1csc(-c2ccccc2)n1)c1ccccc1 353915922 OOECXCXDHSMJPU-FQEVSTJZSA-N 347.487 5.335 30 20 EKED CCC[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 431768096 CMEHPNFQBNVEAJ-SFTDATJTSA-N 349.478 5.262 30 20 EKED N#Cc1cc(NC(=O)c2cscc2-c2ccccc2)ccc1Cl 463240974 YGUWYIMMAPVVSU-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#Cc1ccnc(SCc2csc(-c3ccc(Cl)cc3)n2)c1 476697080 KWUGYGPZLRBXQE-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccn1C1CCCC1 476804022 ZTYZNEHRKZLECJ-UHFFFAOYSA-N 336.479 5.707 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccc2n1C 530508099 VVDKFFKFVJJKHB-UHFFFAOYSA-N 332.447 5.283 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 534693773 ZDPKTNLKRIDYQK-QGZVFWFLSA-N 344.414 5.172 30 20 EKED C[C@H](CCC#N)Sc1ncnc2sc(-c3ccccc3)cc12 559965531 ZUGQNLDADRJSDM-GFCCVEGCSA-N 325.462 5.143 30 20 EKED Fc1ccc(CNC(CCC(F)(F)F)CCC(F)(F)F)cc1F 657702256 IIOTWFWCUIVKSZ-UHFFFAOYSA-N 349.265 5.108 30 20 EKED O=C(/C=C\c1nc(Cl)cs1)c1ccc(SCC(F)F)cc1 759085199 SOWLUOYVBWYELR-WAYWQWQTSA-N 345.823 5.050 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(C(F)(F)F)cc1 782331736 XLMSDLDZZLPHGV-WAPJZHGLSA-N 327.305 5.150 30 20 EKED C=CC[C@H](OC(=O)[C@@](C)(C#N)CC)c1ccc(Cl)c(Cl)c1 808795843 UOUBOGIVSYRMSX-GOEBONIOSA-N 326.223 5.094 30 20 EKED Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccccc1SCCC#N 932297526 SSXXZQDEYBLXHO-UHFFFAOYSA-N 342.464 5.144 30 20 EKED CCCCCCCCCCCN(C)[C@H](CCc1ccccc1)C(=O)O 1776784627 XPLKEEHVTYKWHF-OAQYLSRUSA-N 347.543 5.535 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccccc1 188072408 DZHQSLRGQXLQMN-UHFFFAOYSA-N 335.447 5.140 30 20 EKED N=C(O)[C@H]1CCC[C@H](C(O)=Nc2ncc(C3CCCCC3)s2)C1 329971553 XSFQDAGUYHOMLD-STQMWFEESA-N 335.473 5.120 30 20 EKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 352175571 VXZOJBAJEPOOHS-ZFWWWQNUSA-N 346.883 5.056 30 20 EKED C=CCC[C@H](NC(=O)Nc1ccc(COCC)cc1)c1ccccc1 435605196 RNRLSMXWVOKPDF-FQEVSTJZSA-N 338.451 5.052 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(C)cs1 455241296 FVOZIMZHVUXNMQ-UHFFFAOYSA-N 328.481 5.230 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)C1 463237699 WYVGNRAHQRSSOK-OAOQPFQOSA-N 336.401 5.013 30 20 EKED C[C@@H](Sc1cccc(C#N)c1)c1nc(-c2ccc(Cl)cc2)no1 468653127 MKUGTLBGNGHRPU-LLVKDONJSA-N 341.823 5.115 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(SC3CC3)cc2)n1 542118558 YPWBQLTUZOPCNH-OAHLLOKOSA-N 342.489 5.011 30 20 EKED C[C@H](CN[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 583090485 TYKXXHCHPCOJKF-UZLBHIALSA-N 326.871 5.468 30 20 EKED N#CC1(CC(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 590184451 SAMIKPHNWJDUPC-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1Cl 590745162 CJERQGBPVUJZBS-CYBMUJFWSA-N 330.834 5.131 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C/c1csc(-c2cccs2)n1 731318235 HGXROCBRQJXOGG-FNORWQNLSA-N 329.421 5.215 30 20 EKED C[C@@H](CC1CCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733921915 YXYVEEILCIQOID-HTAPYJJXSA-N 346.474 5.497 30 20 EKED C=CC[C@H](C)C(C)=NNc1nc2cc(C(F)(F)F)ccc2s1 743444619 RMNPPUUXBQOTJI-VIFPVBQESA-N 327.375 5.315 30 20 EKED CCCCCCCCCC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 754564956 HJBJQVLKPZXBPZ-WOJBJXKFSA-N 349.490 5.303 30 20 EKED CC[C@H](CC#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 762721895 FMCYNVVETBZSHA-GFCCVEGCSA-N 334.872 5.100 30 20 EKED Clc1cccc(C=NOCc2cnc3ccccc3c2)c1Cl 799174223 FGFUXUHOICQWNC-UHFFFAOYSA-N 331.202 5.092 30 20 EKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/C(=O)c1ccnc(F)c1 806574403 ONXAUAHCQHPINH-FPONQXLSSA-N 335.300 5.082 30 20 EKED Clc1ccc(CSc2nncn2N=CCC2CCCCC2)cc1 814768885 DKFAQBPALFYWOK-UHFFFAOYSA-N 348.903 5.028 30 20 EKED N#CC1(CCCC[S@@](=O)Cc2cccc(Cl)c2Cl)CCC1 899404842 GNZVVNDIEUCPBI-OAQYLSRUSA-N 344.307 5.106 30 20 EKED Cc1ccc(C)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 7276213 RCVCTOAFMRSDPC-UHFFFAOYSA-N 326.399 5.094 30 20 EKED N#Cc1cccc(CNCc2ccc(-c3ccccc3Cl)s2)c1 65979537 WLMCXBUFAYQLML-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)cc2cccnc12 188073822 LBTWIKGCQQQJJO-UHFFFAOYSA-N 348.421 5.478 30 20 EKED CC1(C)/C(=C/c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 195651389 PQPOEFYREOSCOS-CXUHLZMHSA-N 337.469 5.429 30 20 EKED Cc1cc(C)cc(-c2nnc(SCCCCC(C)(C)C#N)o2)c1 436136477 WNIJXKHQIBZUCH-UHFFFAOYSA-N 329.469 5.166 30 20 EKED CC(C)(C)CN(CC(C)(C)C)C(=O)c1ccc(C(C)(C)C#N)cc1 476542818 JSEDJJCSCLFYOA-UHFFFAOYSA-N 328.500 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](CC#N)c1ccccc1 476996703 BUVLZUSAHQWOKZ-FQEVSTJZSA-N 346.474 5.565 30 20 EKED C=C[C@@H](CC(=O)Nc1c(F)cc(Cl)c(C)c1F)c1ccccc1 536443472 AIKHWXUFSDESRC-LBPRGKRZSA-N 335.781 5.225 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c2ccccc12 551221095 AQBLUAQDLXIGBA-UZUQRXQVSA-N 346.449 6.065 30 20 EKED C[C@H](Sc1ccccc1C#N)c1nc2ccccc2n1C(F)F 551452293 NXAXOWSPTHHOLR-NSHDSACASA-N 329.375 5.156 30 20 EKED CC(C)[C@@H](NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 562042609 GHKOHGIZJVEJPR-MRXNPFEDSA-N 326.406 5.322 30 20 EKED Cc1ccc(C)c(Oc2ccc(CNC3CCC(C)(C#N)CC3)cn2)c1 580281086 FUOIALIZCBAXPK-UHFFFAOYSA-N 349.478 5.053 30 20 EKED N#Cc1ccc(C(F)(F)F)nc1N[C@H](c1ccc(F)cc1)C1CCC1 609670285 DFSNLRAOCCVPTE-INIZCTEOSA-N 349.331 5.064 30 20 EKED CC(C)(C#N)c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 614179729 KYXCGJYUFKIRLW-HXUWFJFHSA-N 338.882 5.382 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(Nc3ccccc3)cc2)c1 726438394 QDTXCVUXURTZHA-UHFFFAOYSA-N 343.455 5.220 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1 731835649 LTAQQCVAUWWDOB-KTKRTIGZSA-N 343.304 5.257 30 20 EKED CC[C@@H](CC#N)OC(=O)c1sc2cc(Cl)ccc2c1Cl 787098540 FQNQWOPPLNZIST-VIFPVBQESA-N 328.220 5.057 30 20 EKED CC(C)Sc1ccc([C@@H](C)Nc2nc(Cl)c(C#N)s2)cc1 804431235 MUJDAYKEWAVDFS-SNVBAGLBSA-N 337.901 5.342 30 20 EKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1cccc(O)c1 916155625 NSYFAUHHPPMYEL-NTMALXAHSA-N 347.395 5.158 30 20 EKED Cc1ccccc1-c1cccc(C=NNc2cccc(C(=O)O)c2C)c1 1776086663 HECNPCAHJBYEHX-UHFFFAOYSA-N 344.414 5.115 30 20 EKED CC(C)[C@@H]1/C(=C/c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776308586 FMWAAFKMRQWTDK-QLBUUCPGSA-N 346.835 5.119 30 20 EKED CC(C)CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 66955586 WCNANRNVHGBLES-OAHLLOKOSA-N 345.512 5.123 30 20 EKED O=C1/C(=C/c2csc(-c3ccc(F)cc3)n2)CCc2ccccc21 71813548 LEIRMUICSYOOOH-RVDMUPIBSA-N 335.403 5.162 30 20 EKED N#C[C@H](C(=O)C1=CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 123094307 MUGZSADKGTVREB-OAHLLOKOSA-N 342.851 5.140 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(Cl)c1Cl 180541222 BRPHLNDZOLVUFW-OLZOCXBDSA-N 349.261 5.308 30 20 EKED C[C@H](NCc1ccc(OCC#N)cc1)c1cccc(-c2ccccc2)c1 180558875 WAHSVEFUSDKSRD-SFHVURJKSA-N 342.442 5.107 30 20 EKED N#Cc1ccc(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2)cc1 189081279 CBSIQKVJEFSSJK-UHFFFAOYSA-N 346.817 5.060 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)c(F)c1 237516975 LCRDWNJQFYGIFQ-MRXNPFEDSA-N 346.405 5.340 30 20 EKED OC(=Nc1ccc2oc(C3CC3)nc2c1)N1CCCC12CCCCC2 328880270 KOGFHNMRVWJJSB-UHFFFAOYSA-N 339.439 5.049 30 20 EKED OC1=Nc2ccc(/C(O)=N/[C@@H]3CC[C@@H]4CCCC[C@H]4C3)cc2SC1 329816165 FJLCACAWQPXGJF-KCQAQPDRSA-N 344.480 5.044 30 20 EKED N#CCC[C@@H](N[C@@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 343732108 WEIZWGCACKMRPN-TZIWHRDSSA-N 329.447 5.180 30 20 EKED C[C@@H](CC#N)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 433819356 PMECGGZCUUDHQA-NSHDSACASA-N 348.233 5.084 30 20 EKED C=CCC(CC=C)C(=O)N(C)c1ccc(C(F)(F)F)cc1Cl 439125952 XQTGIBWVGAPTKX-UHFFFAOYSA-N 331.765 5.090 30 20 EKED CC[C@@H](N[C@H](c1ccc(F)cc1F)C(C)C)c1ccc(C#N)cc1 447589045 WKSHSTLEJBBNFK-UXHICEINSA-N 328.406 5.274 30 20 EKED COc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(C#N)cc1F 512666274 JOQUPJAZEKQMOK-MGPUTAFESA-N 340.442 5.144 30 20 EKED C[C@H](SCc1ccc(Br)s1)c1ccc(C#N)cc1 522840671 YNALRNLGYUXBHY-JTQLQIEISA-N 338.295 5.377 30 20 EKED CC(C)(C#N)CCCNc1ccc(Cl)cc1OCC(F)(F)F 531902857 WDSFUZLYCNYQFK-UHFFFAOYSA-N 334.769 5.023 30 20 EKED CC(C)[C@@H](NCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 540359431 VIWQHFDHDFCDAJ-MRXNPFEDSA-N 326.406 5.322 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)C2CCC2)c(C(F)(F)F)c1 573651956 QWQYJQOQDXEYJF-LJQANCHMSA-N 344.380 5.208 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@H](CCCC#N)c1ccccc1 590068699 QUKNBHXMFJJLPT-LJQANCHMSA-N 346.396 5.539 30 20 EKED N#CC1(CC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)CCCCC1 597172729 BJXHYGVOZXYRSB-HXUWFJFHSA-N 349.478 5.086 30 20 EKED CC(C)c1noc(CSCc2ccc(-c3ccccc3C#N)cc2)n1 609236864 HQBFNAPAYPETFS-UHFFFAOYSA-N 349.459 5.165 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)CS[C@H](C)c1ccc(C#N)cc1 609825567 FWPSBUYHJRQGRC-CQSZACIVSA-N 334.444 5.025 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1 674265578 VXXXYQMMAOUGLN-UHFFFAOYSA-N 341.263 5.275 30 20 EKED CCOc1cccc(C(=O)/C=C/c2csc(-c3cccs3)n2)c1 728440352 NMSCQSIGIQPGKQ-CMDGGOBGSA-N 341.457 5.166 30 20 EKED CC(C)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(Cl)cc1 728713295 YLCPBEPPTZWRSX-YWZLYKJASA-N 342.870 5.118 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 740760091 KQQHHPJVBBPXPA-UHFFFAOYSA-N 337.426 5.276 30 20 EKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H](C)C(C)C 743294583 PJYPQUHSJNVRQL-UTKZUKDTSA-N 349.478 5.240 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1 753142021 NBSHUYNQTXQLOX-ZHACJKMWSA-N 334.444 5.225 30 20 EKED Fc1ccccc1C=NOCc1nc(-c2ccccc2Cl)cs1 774724678 JLWGJZUKFSHWMT-UHFFFAOYSA-N 346.814 5.153 30 20 EKED CCCCCCC[C@@H](C)CN[C@H]1CCN(C(C)=O)Cc2ccccc21 779021048 XCTLQZONZURXQB-GCJKJVERSA-N 344.543 5.066 30 20 EKED CCCCCCCCCN(C)C(=O)c1cc(-c2csc(C)n2)c[nH]1 918397369 ATXIVWZYAKHKQO-UHFFFAOYSA-N 347.528 5.269 30 20 EKED O=C(O)c1cccc(-c2ccc(/C=C\C(=O)c3ccccc3)s2)c1 1776113931 CDLUOYXKBJTZJD-LUAWRHEFSA-N 334.396 5.009 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc([C@@H](C)C(=O)O)cc1 1776786190 WJUJAOUBUUHHIJ-HZPDHXFCSA-N 333.472 5.200 30 20 EKED N#Cc1ccc(-c2csc(-c3ccc(Br)cc3)n2)cc1 22459974 QFJBCRJLKPAXLV-UHFFFAOYSA-N 341.233 5.111 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/c2nc3cc(Cl)ccc3s2)cc1 110970263 QRNQLIGIZCMJSL-OXFRDRNISA-N 340.835 5.411 30 20 EKED N#CCCC[C@H](NCc1c(Cl)oc2ccccc12)c1ccccc1 353918386 YAJHJCZXYIGJSU-SFHVURJKSA-N 338.838 5.611 30 20 EKED CC(C)CN(CCCCC(C)(C)C#N)[C@H]1CCCc2cccnc21 444683535 HIVBQCJJCBWJSE-IBGZPJMESA-N 327.516 5.137 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2cccs2)o1 465387361 HGGJFYULIXXGHI-SECBINFHSA-N 347.852 5.176 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C)s1 475551034 PLPWRDUSFZWZNH-UHFFFAOYSA-N 328.481 5.230 30 20 EKED C=CCC1(C(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)CCC1 479651988 MZLIEQKHABFIHX-HNNXBMFYSA-N 340.492 5.042 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(SC2CCCC2)cc1 480791494 RJHARAGFIMNAGM-MRXNPFEDSA-N 336.504 5.444 30 20 EKED N#CC[C@H](CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 483040420 MDDJWMRMDOEXDY-CYBMUJFWSA-N 333.218 5.019 30 20 EKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@H](CCC#N)c1ccccc1 489003816 ACJBVQYYIHYGIW-YFVAEKQCSA-N 346.474 5.137 30 20 EKED C[C@H](c1cc2ccccc2o1)N(C)Cc1cccc(OCCCC#N)c1 506328906 ZNAORMJFBRPRDJ-QGZVFWFLSA-N 348.446 5.308 30 20 EKED CC(C)(CCC#N)CN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 507135076 PMQFPMHSRZTGOO-INIZCTEOSA-N 325.283 5.460 30 20 EKED Cc1c(C#N)cccc1C(=O)Nc1ccccc1-c1c(F)cccc1F 510400209 XZOGJEUDXVPLLZ-UHFFFAOYSA-N 348.352 5.064 30 20 EKED C=CCN(C(C)=O)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 514616599 INJYWDDZNQGWCC-UHFFFAOYSA-N 334.444 5.016 30 20 EKED N#Cc1ccc2c(c1)[C@@H](NC1(c3c(Cl)cccc3Cl)CC1)CC2 521122165 AJSRYTDFZGZXTM-KRWDZBQOSA-N 343.257 5.131 30 20 EKED N#Cc1cc(CN[C@H](CCc2ccccc2)c2ccccc2)ccc1F 561111260 MYIBEKSFSFMETA-HSZRJFAPSA-N 344.433 5.161 30 20 EKED CC[C@H](N[C@H]1COc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 570243284 POGPPCQYOCAAAI-HOTGVXAUSA-N 347.245 5.039 30 20 EKED C=CCC[C@@H](NCc1ccccc1CN1CCCCC1)c1ccco1 572668622 JMRQVGQRHQUVHM-OAQYLSRUSA-N 338.495 5.063 30 20 EKED Cc1cc(CSCC2(CC#N)CC2)nc(-c2ccc(Cl)cc2)n1 596351566 YAEVWVZXKUSYKG-UHFFFAOYSA-N 343.883 5.033 30 20 EKED C=CCN(C(=O)c1sc2ccc(OC)cc2c1C)c1ccccc1 607780696 FUJRYIXRROHXFR-UHFFFAOYSA-N 337.444 5.051 30 20 EKED CC(C)Sc1c(Cl)cccc1NC(=O)c1cccc(CC#N)c1 610176086 SNGUUSYRYXQSDG-UHFFFAOYSA-N 344.867 5.159 30 20 EKED Cc1ccc(-c2ccc(CN[C@@H](C)c3cccc(C#N)c3)s2)cc1 610344975 PJWSPDWBQOMBQR-INIZCTEOSA-N 332.472 5.446 30 20 EKED CCc1c(C)sc(NC(=O)C(C)(C)c2ccc(Cl)cc2)c1C#N 727790370 FGNSEMSKVRDSJE-UHFFFAOYSA-N 346.883 5.060 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(C#N)cc2)cc1 741464947 RPQQGRBBDPTYQI-GDNBJRDFSA-N 339.394 5.130 30 20 EKED CCOc1ccc(O)c(/C=N/[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 746393870 LRCAWNIXTAHUGW-WTJYETQFSA-N 346.430 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1cccc(F)c1 789717983 CBGVYLQIKHWHSJ-SSZFMOIBSA-N 337.438 5.720 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(OCC)cc1 799900480 LJQQFEYVTNGDKI-UHFFFAOYSA-N 326.465 5.013 30 20 EKED O=C(/C=C/c1ccc(C(F)(F)F)s1)c1c(F)cccc1Cl 809159764 WBKPYNDDZGYYCQ-GQCTYLIASA-N 334.721 5.456 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352877 OJAZRNJUFIOUFE-SFTDATJTSA-N 347.462 5.138 30 20 EKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1ccccc1F 916135720 KVVAGXNIQSMACY-MDZDMXLPSA-N 343.810 5.499 30 20 EKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 916848215 GILPAEQNZJDUHI-FQEVSTJZSA-N 342.442 5.167 30 20 EKED C[C@@H](c1ccc(C(=O)Nc2ccc(CCC#N)cc2)cc1)C(F)(F)F 928401467 XLDWEIVVDCPIGV-ZDUSSCGKSA-N 346.352 5.061 30 20 EKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(CCC#N)cc2)c1C 932576351 RMBYGIBNQDILPX-OAQYLSRUSA-N 347.462 5.129 30 20 EKED CC1(C)CCC/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C1=O 1776550718 BFSUQVJIQPWESA-SAPNQHFASA-N 334.415 5.214 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 159728068 RWFUQLWCRJZFFM-GOSISDBHSA-N 335.451 5.151 30 20 EKED N#Cc1ccc(N2CCC[C@H]2c2nc3ccccc3s2)cc1Cl 301236693 KRBPJWCSDJFCKI-INIZCTEOSA-N 339.851 5.163 30 20 EKED COc1ccc(N=C(C)O)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 328992161 IRCNNMVOBJSPRS-USXIJHARSA-N 344.455 5.498 30 20 EKED CC(O)=Nc1ccc(C)c(N=C(O)N[C@@H]2CCCCC23CCCC3)c1 329627934 PPUGYOJSRXFNSB-GOSISDBHSA-N 343.471 5.241 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(CN2CCCCC2)cc1 410346345 HYPQNMRVADWMGF-UHFFFAOYSA-N 348.490 5.043 30 20 EKED C=CCCCC(=O)Nc1c(Cl)cc(C(F)(F)F)cc1Cl 411112593 LWWXGBKFLHPLAC-UHFFFAOYSA-N 326.145 5.307 30 20 EKED Cc1cc(C)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 432483402 ANBIKMFPTIUXHG-IBGZPJMESA-N 335.451 5.169 30 20 EKED Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3C#N)c(F)c2)cc1 433964870 MWZDUTRTLIPIAG-UHFFFAOYSA-N 348.352 5.064 30 20 EKED Cc1cc(C(C)(C)C)cc(C)c1C[S@](=O)CCCCC(C)(C)C#N 436105385 PPIKPJUUMYAXCF-XMMPIXPASA-N 347.568 5.570 30 20 EKED N#CCCC[C@H](N[C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 449341876 XCYSEQILLOTSFF-IRXDYDNUSA-N 344.380 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)oc2ccccc12 476112088 PUSGTZWEZLIQLU-UHFFFAOYSA-N 347.458 5.774 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1C[C@H](C)C[C@@H](C)C1 503139600 MOWNPJOCGLHOHT-KFWWJZLASA-N 330.497 5.092 30 20 EKED C=CCOc1cccc(NC(=O)Nc2cccc(SCC)c2)c1 506756478 AHPRWGYWGVQMMC-UHFFFAOYSA-N 328.437 5.007 30 20 EKED C=C(C)COc1cc(CNc2cccc(C(F)F)c2)ccc1OC 532887108 AQKFNUOVYGPYMR-UHFFFAOYSA-N 333.378 5.200 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H](c2ccc(Cl)cc2)c2cccs2)C1 613255188 XJUYIKVKMPFOSB-RPVQJOFSSA-N 330.884 5.163 30 20 EKED CCOc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 728438854 AGHUNSRNXHDSDX-JXMROGBWSA-N 341.457 5.166 30 20 EKED CCCCC[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 731114221 KDLACQUVMDQPIR-CABCVRRESA-N 333.501 5.029 30 20 EKED COc1ccccc1[C@@H](C)SCc1cc(Cl)ccc1OCC#N 742455700 SUPIRZPNUXADAY-CYBMUJFWSA-N 347.867 5.245 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccc(Cl)c(Cl)c1)c1ccncc1 766021426 STCQJPANIIVTSK-ZWKOTPCHSA-N 335.278 5.747 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1cccc(Br)c1)c1ccncc1 766022585 XGVJHQDQEGAARV-ZWKOTPCHSA-N 345.284 5.202 30 20 EKED C[C@H](CC(=O)OCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 783656298 WNJSDVJDBSSEQH-CYBMUJFWSA-N 341.373 5.072 30 20 EKED CC(C)Oc1c(F)cc(NCc2ccccc2C(C)(C)C#N)cc1F 783886379 ZRRGGANHQPRPLH-UHFFFAOYSA-N 344.405 5.165 30 20 EKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916846186 KJISPIHQAZTLRZ-KRWDZBQOSA-N 348.471 5.229 30 20 EKED CCCCC/C(C=NNc1ccc(C(=O)O)cc1)=C\c1ccccc1 1776012010 OOWLDICTZBUACV-ZDKUDODDSA-N 336.435 5.446 30 20 EKED Cc1ccc(CC(=NNc2ccc(Cl)c(C(=O)O)c2)C(C)C)cc1 1776033484 PNJFHQFUMGLYKP-UHFFFAOYSA-N 344.842 5.013 30 20 EKED C=CCOc1cccc(NC(=O)c2oc3ccc(Cl)cc3c2C)c1 65749536 RKYUEBNNNUGTBV-UHFFFAOYSA-N 341.794 5.212 30 20 EKED C=C(Cl)COc1ccc([C@H](C)NCc2nc(C3CC3)cs2)cc1 90458597 CZLDAUNGWNUKQF-ZDUSSCGKSA-N 348.899 5.003 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 110402046 HTIQWFHSMZRYAZ-MDWZMJQESA-N 349.430 5.052 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 181887002 CORRUVKUGVDCPC-OPAMFIHVSA-N 330.406 5.138 30 20 EKED CCC(C)(C)C1C/C(=C/c2cccnc2)C(=O)/C(=C\c2cccnc2)C1 207452799 XTMUEPLBFWCBOA-YZLQMOBTSA-N 346.474 5.359 30 20 EKED C[C@@H](N[C@H](C)c1cncc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 367799521 GLCDURRJABVGET-HZPDHXFCSA-N 345.421 5.171 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1cccc(F)c1C#N 427821634 BMXHBOVXTGXFEL-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CC(C)(C#N)CCCCN[C@@H](COc1ccccc1)c1ccccc1 444690619 UTPBHTAMZRGRHT-NRFANRHFSA-N 336.479 5.116 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N[C@H]2CCC[C@@H](C#N)C2)cc1 447525975 AJOKCUYDCVBXDY-QKLQHJQFSA-N 334.463 5.095 30 20 EKED CCCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1ccccc1 462014732 ICQLVCBXYIFZDY-ROUUACIJSA-N 334.463 5.052 30 20 EKED C=CCC(CC=C)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 468672452 BHHFBQHGHUGFQH-UHFFFAOYSA-N 327.374 5.339 30 20 EKED C=CCC[C@@H](N[C@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 537948127 XWPLMZJHRYFPKP-IUODEOHRSA-N 340.414 5.520 30 20 EKED C[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 541111423 QRPQMYPDAZIAQN-KRWDZBQOSA-N 341.414 5.167 30 20 EKED CCC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(OC)cc1 554180957 FYXUMDZQQFMFIE-OAQYLSRUSA-N 338.451 5.331 30 20 EKED C=CCC[C@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560264632 CHFLMIRDWSUUKL-KBXCAEBGSA-N 341.417 5.117 30 20 EKED Cc1ccsc1-c1noc(-c2cn(CCCC#N)c3ccccc23)n1 562123394 WPFOQOLXKNASSS-UHFFFAOYSA-N 348.431 5.032 30 20 EKED CC1(C#N)CCC(NC(CCC(F)(F)F)CCC(F)(F)F)CC1 595091537 SEJVFJSPNAHBAB-UHFFFAOYSA-N 344.343 5.102 30 20 EKED Cc1ccc(F)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 727086744 SPYKQIHCUKQALI-HXUWFJFHSA-N 344.389 5.042 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cc(Cl)sc2Cl)s1 736433158 MFFOXILJZUIVAM-PLNGDYQASA-N 346.304 5.705 30 20 EKED C=CCCCN(C)C(=S)Nc1ccc(Oc2ccccc2)cc1 736449849 CQEAOHIMVXKTEW-UHFFFAOYSA-N 326.465 5.074 30 20 EKED CCSc1ccc(Cl)cc1NCc1ccc(O[C@H](C)C#N)cc1 770564486 TWBQZEALZWDNRV-CYBMUJFWSA-N 346.883 5.355 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(SC(F)F)cc1 777599425 JOVJUNWXOVTPQL-KRWDZBQOSA-N 330.403 5.362 30 20 EKED CC/C(C)=C(/C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 779910907 SZERPGIXTFFMGL-ICFOKQHNSA-N 348.446 5.131 30 20 EKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CC1 805855729 OWZSZKMKEMIBKO-CQSZACIVSA-N 344.867 5.076 30 20 EKED Cc1ncsc1C(=O)/C=C/c1csc(-c2ccc(Cl)cc2)n1 915987520 GCXSPYOFXRJSKX-VOTSOKGWSA-N 346.864 5.125 30 20 EKED O=C(O)c1cccc(-c2ccc(/C=C/C(=O)c3ccccc3)s2)c1 1776113932 CDLUOYXKBJTZJD-PKNBQFBNSA-N 334.396 5.009 30 20 EKED C=CCn1c(SCc2ccccc2)nnc1-c1ccc(Cl)cc1 9050071 RVAHEDVOGZYALG-UHFFFAOYSA-N 341.867 5.077 30 20 EKED CCC(CC)CN(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955720 PFTFTPMGCYALOQ-OAHLLOKOSA-N 347.528 5.371 30 20 EKED N#CCSc1cccc(C(=O)Nc2ccccc2-c2ccccc2)c1 79381711 RJUHNZKQCJGWJR-UHFFFAOYSA-N 344.439 5.222 30 20 EKED CCCCc1nc(CNc2ccccc2SC[C@@H](C)C#N)cs1 172906207 BPHROZNZGRDHGL-AWEZNQCLSA-N 345.537 5.350 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1c(C)cccc1C 189880000 CSGCVPFJPGIJHF-UHFFFAOYSA-N 337.463 5.173 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 189880835 TXOHGJAFVQGOER-UHFFFAOYSA-N 338.407 5.007 30 20 EKED COc1ccccc1-c1ccc(CN[C@@H](C)c2cccc(C#N)c2)cc1 237342774 PLFCREOBIPSUIS-KRWDZBQOSA-N 342.442 5.085 30 20 EKED Cc1ccc(CNCc2cc(C#N)cs2)c(Oc2ccccc2)c1 237778694 DHGUPMLYYOIFCS-UHFFFAOYSA-N 334.444 5.010 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cnc2ccsc2c1 340450388 YAGKIKCVGIWCMD-QAPCUYQASA-N 335.476 5.382 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc2sccc2c1)c1ccccc1 352207586 ZVYQJKBZXSWPTI-GOSISDBHSA-N 334.444 5.066 30 20 EKED COc1ccc2oc([C@H](C)NCCCCC(C)(C)C#N)c(C)c2c1 444688537 ZPPCSWNWISQXQR-HNNXBMFYSA-N 328.456 5.121 30 20 EKED C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482605775 OBFGLNNKUWRORM-IERDGZPVSA-N 348.446 5.001 30 20 EKED C=CCOc1ccccc1CN[C@H]1C[C@H](C)Sc2sccc21 482883657 DOGOMSZRKDHINO-BBRMVZONSA-N 331.506 5.028 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1ccco1)C1CCCC1 505062985 WTYGBTUZQSBGAZ-UHFFFAOYSA-N 338.451 5.375 30 20 EKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 517656322 FCKGFZXTXGVOBT-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C/C=C/c1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 570714966 JDAHUKNRXCLBJG-FARCUNLSSA-N 343.430 5.230 30 20 EKED N#C[C@@H](Cc1ccccc1)SC(c1ccccc1)c1ccccc1 603451594 IBTSFGOTGZPFHM-OAQYLSRUSA-N 329.468 5.644 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccc(C#N)cc1 611167002 NQYXGDBCKRNGIV-PIGZYNQJSA-N 331.246 5.203 30 20 EKED CC(C)(C#N)c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1 614179728 KYXCGJYUFKIRLW-FQEVSTJZSA-N 338.882 5.382 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(C)s3)s2)cc1 734305547 BFOVKRFDAZMXAV-HJWRWDBZSA-N 325.458 5.385 30 20 EKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc(Cl)cc1 743476023 BDSLKYFNDNDGQS-QUCCMNQESA-N 342.870 5.262 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1cccc(-c2ccccn2)c1 747694480 YCPQHWLECIJEQE-VAWYXSNFSA-N 345.446 5.039 30 20 EKED CCCCCCCCCCC(=O)N1CCC(c2nccc(C)n2)CC1 754464843 MZYZJTCYVJMQAZ-UHFFFAOYSA-N 345.531 5.022 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 759186522 IATMVJNRIWTUQY-FFWXCITRSA-N 346.817 5.168 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1cc2c(ccc3ccccc32)o1 776165000 MZNDELSFSSORFW-AWEZNQCLSA-N 344.389 5.448 30 20 EKED Cc1c(C(=O)/C=C\c2ccc(C(F)F)cc2)cnn1-c1ccccc1 794939184 UAHXEBQWZDBHQU-XFXZXTDPSA-N 338.357 5.014 30 20 EKED C=C(C)[C@@H](N[C@@H](CC)c1ccc(F)cc1O)c1ccc(F)c(F)c1 796949268 PHMZTKGZQDEVQN-PKOBYXMFSA-N 335.369 5.168 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC 886895093 SZXCXYXXTDMMHO-IBGZPJMESA-N 347.499 5.118 30 20 EKED Cc1cc(C)c(NC(=O)[C@@H](C)SCC2CCC(C#N)CC2)c(C)c1 902568270 TVFXMGSKOXMZQL-WWDZGPRUSA-N 344.524 5.002 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1cc(C)oc1C 916317821 HUWVBGBZDWBVCM-UHFFFAOYSA-N 332.618 5.088 30 20 EKED N#CC1(CCCCN2[C@H]3CC[C@H]2CC(CC(F)(F)F)C3)CCC1 932802286 KTFDNQJMTYHACG-HOTGVXAUSA-N 328.422 5.046 30 20 EKED CCn1c(SCCCC(C)(C)C#N)nnc1-c1ccc(Cl)cc1 177148345 FTFVCQVFUAPPKP-UHFFFAOYSA-N 348.903 5.040 30 20 EKED CC(C)c1c(CC#N)nc2sc3c(c2c1-c1cccnc1)CCC3 183890074 YRJLBHBYQSCVKK-UHFFFAOYSA-N 333.460 5.036 30 20 EKED C[C@@H](CCNCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 237563979 FBCAEJPYZABJBX-AWEZNQCLSA-N 326.406 5.119 30 20 EKED N#Cc1c(Cl)nsc1N1CCC[C@@H]1c1cccc2ccccc12 301933036 QBBNHKYYYANOTR-MRXNPFEDSA-N 339.851 5.163 30 20 EKED C[C@H](NCc1cccc(OCC2CCCCC2)c1)c1ccc(C#N)cc1 477207326 PMIQGLGHSDMFMV-SFHVURJKSA-N 348.490 5.368 30 20 EKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)o1)c1nc2ccccc2s1 478728541 POQYRTYUMRXWLR-AWEZNQCLSA-N 344.395 5.046 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1Cl 483223199 AULXTVGIEZBVMT-GOSISDBHSA-N 348.833 5.502 30 20 EKED N#Cc1cnc(Oc2ccc(Cl)c(C(F)(F)F)c2)c(Cl)c1 513639444 BUWGACQKTIFQJB-UHFFFAOYSA-N 333.096 5.071 30 20 EKED Cc1cc(C#N)ccc1Oc1ncnc2scc(-c3ccccc3)c12 522996680 HVXJJWFLHQQKCE-UHFFFAOYSA-N 343.411 5.331 30 20 EKED CC(C)(CCC#N)CN[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 554364090 YLMSCRXYAHCSBA-LJQANCHMSA-N 344.861 5.488 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 609208830 HUAKEZXVQGIPJH-MRXNPFEDSA-N 349.434 5.004 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(C(C)C)c1 612297080 SKVDQJSELLKNJB-HXUWFJFHSA-N 327.472 5.091 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(C(F)(F)F)s1 671848536 GHUXKBXYZWUINB-UHFFFAOYSA-N 325.355 5.138 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(Cl)c(Cl)c1Cl 726365900 PWPWMPFRUWMSRW-ZZXKWVIFSA-N 347.028 5.591 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1cc(F)c(F)c(F)c1 727974505 LGUHNBPFKDIJBM-AATRIKPKSA-N 339.382 5.062 30 20 EKED CC[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 734079323 NYTSAGRFSMQPCB-PKOBYXMFSA-N 334.463 5.408 30 20 EKED C#Cc1cccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)c1 746658657 GDDJPSHKLKQKIL-GFCCVEGCSA-N 347.245 5.200 30 20 EKED N#Cc1csc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 748441332 XTYMNRJJABVEHG-MKMNVTDBSA-N 347.226 5.665 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cccc(-c2cccnc2)c1 754722331 BQMKZIWOIRHDPE-UHFFFAOYSA-N 342.320 5.180 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3cccc(OCCCC#N)c3)oc2c1 754829329 KMWUVYIJULZFIR-CSKARUKUSA-N 345.398 5.320 30 20 EKED C#CC[C@@H](NCc1ccc(Oc2cccnc2)c(C)c1)c1ccccc1 756998486 WWQJPIOLENWULL-JOCHJYFZSA-N 342.442 5.037 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(Cl)nc3)s2)cc1 759081927 CYTGQYABYXVUCA-FPLPWBNLSA-N 340.835 5.063 30 20 EKED C=CC[C@@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccncc1 760332252 YILLTESRLIXJFB-SJORKVTESA-N 333.262 5.283 30 20 EKED C#C[C@H](C)N(C)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 770566162 XIZYNKXYUMJOQC-HOTGVXAUSA-N 338.476 5.025 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1ccc(SC(F)F)cc1 772807011 OSSJHPLIGLZSLO-JXMROGBWSA-N 341.382 5.446 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(C)c(C)cc2C)c1 772981738 ABBJOYQHGJZUPV-UYAOXDASSA-N 336.479 5.144 30 20 EKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccc(-c2ccncc2)cc1 794941606 SGZRGTRRRWDVER-KMKOMSMNSA-N 335.353 5.582 30 20 EKED CCCNc1ccc(C#N)cc1NCc1nc(-c2ccccc2)cs1 795268687 ZLBCCWHMWKTYGT-UHFFFAOYSA-N 348.475 5.116 30 20 EKED CCc1noc(C)c1C(C)=NNc1ccc(Cl)c(C(F)(F)F)c1 844607413 XXRXVNUTKACRPR-UHFFFAOYSA-N 345.752 5.054 30 20 EKED CC[C@@H](C#N)[C@@H](OC(=O)c1cscc1C(F)F)c1cccs1 893272147 JGYFWFXJRRVYRO-TVQRCGJNSA-N 341.404 5.195 30 20 EKED CC(=NNc1ncc(Cl)cc1Cl)c1oc2ccccc2c1C 916316921 PLVMXBFVEGUCFZ-UHFFFAOYSA-N 334.206 5.279 30 20 EKED CCCCCCCCC(=O)Nc1ccccc1NC(=O)N1CCCC1 918602405 HAVFPNQBECVRTK-UHFFFAOYSA-N 345.487 5.003 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)c(C)c1 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C[C@@H](Oc1ccc(NC(=O)OC(C)(C)C)cc1)c1cccc(C#N)c1 794721678 VQLZMMFZPJHWOU-CQSZACIVSA-N 338.407 5.045 30 20 EKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797569677 UVPKFFDSARSEPN-NVXWUHKLSA-N 340.492 5.057 30 20 EKED C=CCC[C@@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 857858666 PMOJWRCOMPXXAC-SJORKVTESA-N 349.400 5.103 30 20 EKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 46441624 JRGPYPXZCIAWLC-GFCCVEGCSA-N 347.226 5.093 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]1 329126916 YUAYMJFVWGMUIF-GVDBMIGSSA-N 337.467 5.580 30 20 EKED Cc1cccc(C)c1[C@@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 458643182 DOVCXGJBLRAIGP-UYAOXDASSA-N 349.478 5.099 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(C#N)c1 463071083 QIQPAYWLYRIJSV-MRXNPFEDSA-N 334.463 5.547 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1ccc(C#N)c(F)c1 479523929 BCKPBZMQHVAWLW-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CN(C(=O)CCCCCc1cccs1)c1cc(Cl)ccc1C#N 479577509 UNUAUEUHINSUPF-UHFFFAOYSA-N 346.883 5.039 30 20 EKED CCN(Cc1cccc(OCCCC#N)c1)[C@@H](C)c1ccc(F)cc1 510454544 IWWCHEIYNRCPLD-KRWDZBQOSA-N 340.442 5.091 30 20 EKED Cc1sc(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)c(C#N)c1C 518702423 SQDVHJCBAPJLGM-QZTJIDSGSA-N 346.455 5.132 30 20 EKED C=C[C@@H](CC(=O)N1CCCCC[C@@H]1c1ccc(C)o1)c1ccccc1 533946001 GXVMJNZHPJGFEM-AZUAARDMSA-N 337.463 5.392 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccc(-c2ccc(F)cc2)cc1 536723753 ZSGFLVRIXVSWSB-CQSZACIVSA-N 336.435 5.277 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)o1 540627687 DFIFNPKLAFABQZ-PKTZIBPZSA-N 342.442 5.102 30 20 EKED C[C@@H](NCc1ccc(Oc2ccccc2)c(F)c1)c1ccc(C#N)cc1 549172752 IWUNLYRYSDYHIP-MRXNPFEDSA-N 346.405 5.340 30 20 EKED C[C@@H](Sc1ccccc1C#N)c1nc2ccccc2n1C(F)F 551452292 NXAXOWSPTHHOLR-LLVKDONJSA-N 329.375 5.156 30 20 EKED C=CCC[C@@H](NCc1cc(Cl)ccc1OC(F)F)c1ccco1 556869478 IDOBPELOTFXEPN-CQSZACIVSA-N 341.785 5.332 30 20 EKED C/C=C\c1ccc(NCc2ccc(OC)c(OCCCC#N)c2)cc1 584373173 BHAFIXWJOHTTAN-UTCJRWHESA-N 336.435 5.023 30 20 EKED CC1(C)CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 608891688 FNONANZJKBGILC-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H](Nc1ncccc1C#N)c1ccccc1-c1ccc(Cl)cc1 610077225 KUMGXSDKDZMUIR-AWEZNQCLSA-N 333.822 5.447 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccccc3C(F)(F)F)c2c1 734307804 SKWGVYJPOFUSMH-RMKNXTFCSA-N 345.320 5.091 30 20 EKED CCCc1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1 753142587 RNTCHLDSFXUCGW-CMDGGOBGSA-N 334.444 5.054 30 20 EKED CC[C@@H](NCc1cc(C#N)ccc1F)c1ccc2cc(OC)ccc2c1 773029034 ACNYJSMIWYFTSP-JOCHJYFZSA-N 348.421 5.100 30 20 EKED C#CCOc1ccc([C@@H](C)N[C@@H](C)c2csc3ccccc23)cc1 776723681 SCDDSONKDLUUMZ-CVEARBPZSA-N 335.472 5.325 30 20 EKED C[C@H](CC(=O)OCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 798876938 VPIBNVZZSLKPLY-CYBMUJFWSA-N 341.373 5.072 30 20 EKED FC(F)(F)CCON=C1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 799485824 WLUHLGJPFVYPBG-LLVKDONJSA-N 339.279 5.298 30 20 EKED CCCCCC[C@H](CC)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211155 FFRBGVJBJHAJSJ-ZFWWWQNUSA-N 340.389 5.273 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1cc(Cl)c(F)cc1Cl 815503824 AYWUTNIKJJDWDN-UHFFFAOYSA-N 332.202 5.009 30 20 EKED C[C@@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2c(O)ccc(F)c21 815636490 WDHXYACIYDWCIZ-OLMNPRSZSA-N 338.426 5.104 30 20 EKED FC(F)(F)c1ccccc1ON=C[C@H]1CCC[C@H](C(F)(F)F)C1 853324430 GDNYERZQITUJMW-QWRGUYRKSA-N 339.279 5.439 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1c(Cl)cccc1CC 1776783344 SANGHRIIZSRIHJ-MRXNPFEDSA-N 339.907 5.196 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccccc1C(C)(C)C#N 131708134 KXTQFKSQMDFOGW-INIZCTEOSA-N 349.503 5.494 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2ccccc2n1 189891795 CHXXEMDNYREZNM-UHFFFAOYSA-N 330.431 5.339 30 20 EKED COc1ccccc1/C=C\C(=O)c1sc(-c2ccccc2)nc1C 220909826 JYNHHYRFDWNEMB-SEYXRHQNSA-N 335.428 5.023 30 20 EKED Cc1ccc2cc([C@H](C)Nc3cccc(OCCCC#N)c3)oc2c1 426065482 ZHKPSPQRUBVITG-INIZCTEOSA-N 334.419 5.597 30 20 EKED CCN(C(=O)c1cccc(Oc2ccccc2)c1)c1ccc(C#N)cc1 461510297 AFUSNLBRXKLWAF-UHFFFAOYSA-N 342.398 5.017 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 489084755 XQFXSRLPFCOYOV-HNNXBMFYSA-N 340.389 5.099 30 20 EKED C=CCn1c(S[C@@H](CC)c2ccccc2)nnc1-c1ccoc1C 494127701 NXWXPJZRVMVGNI-KRWDZBQOSA-N 339.464 5.276 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2sccc2C#N)c(C)c1 498456881 IKLVBNLWOGYGED-LBPRGKRZSA-N 330.478 5.071 30 20 EKED Cc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 500743042 LBBAYFRMDDKXLP-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 510075763 WCJIUWHBOSVWNL-HOTGVXAUSA-N 349.434 5.003 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cc2ccccc2s1 524674688 ZQNDOMIDMJRHEL-UHFFFAOYSA-N 338.457 5.159 30 20 EKED C[C@@H](CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(F)(F)F 542012182 PJXWGLQRPFEMJU-UONOGXRCSA-N 332.369 5.074 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C3CCCC3)cc2)n1 558549212 IUSSOOOJVKPLBB-QGZVFWFLSA-N 338.476 5.414 30 20 EKED C=CCOc1ccccc1CNCc1cc(-c2ccccc2)cs1 600809355 CXYBKAPFWNZRPA-UHFFFAOYSA-N 335.472 5.270 30 20 EKED CCc1cc(C#N)c(NC(=O)c2cccc(Oc3ccccc3)c2)s1 604030344 RVBABLKFFXWISB-UHFFFAOYSA-N 348.427 5.227 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)C1CCCCC1 730420151 AKIDYTQDRQFLMU-IUODEOHRSA-N 344.455 5.218 30 20 EKED C[C@@H](C(=O)OCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 738794619 ZVMGJRPPRKIMDQ-OAHLLOKOSA-N 347.439 5.134 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc2c3c(cccc13)CC2 740765443 ZYKKQKIUQQOZST-SEYXRHQNSA-N 335.406 5.383 30 20 EKED CC(C)CN(C(=S)Nc1ccc(Cl)cc1)c1ccc(C#N)cc1 745689459 ZTTUDOPSMZFOGA-UHFFFAOYSA-N 343.883 5.071 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)s1 765013706 IOPYABRLBZTZQV-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C#C[C@H](C)N(C)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 770566166 XIZYNKXYUMJOQC-JKSUJKDBSA-N 338.476 5.025 30 20 EKED C#CC[C@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccccc1 773113292 CZXIFYIZLGQUIL-APWZRJJASA-N 332.472 5.225 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc2cc(OC)ccc2c1)c1ccccc1 773115135 LRPDVTWZTGASCO-UZUQRXQVSA-N 329.443 5.264 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2cc(Cl)cc(C(F)(F)F)c2)cn1 780185946 AOYRFJJTBUMKPA-ARJAWSKDSA-N 342.748 5.032 30 20 EKED CC(C)c1ccc2occ(C(=O)Nc3ccccc3O[C@@H](C)C#N)c2c1 804544047 FMDKNJPRPYDBHF-AWEZNQCLSA-N 348.402 5.099 30 20 EKED CCSc1ccc(C(=O)/C=C\c2ncc(CSC)s2)cc1 834430773 YBIXAWDTKSHOHT-HJWRWDBZSA-N 335.519 5.014 30 20 EKED N#CC1(CCCCSCc2cc3ccccc3nc2O)CCC1 901767204 ZVTHPTRAIFIKSG-UHFFFAOYSA-N 326.465 5.038 30 20 EKED Cc1ccc(F)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915087283 RWMSMVODCYMIDM-NRFANRHFSA-N 344.389 5.042 30 20 EKED CCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917046518 KOLBWFFOWBCTRY-YPMHNXCESA-N 334.872 5.342 30 20 EKED COc1cccc(C=Nc2cccc(COC3CCCCC3)c2)c1O 921138340 FYKYNZBXZLUYSP-UHFFFAOYSA-N 339.435 5.001 30 20 EKED N#C[C@@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2ccccc2s1 89964632 VPQRVSJMHYNYLL-INIZCTEOSA-N 344.395 5.046 30 20 EKED N#C[C@H](NC(=O)CCC1CCCCC1)c1cccc(Cl)c1Cl 303375801 LGTMYPZEHLWIIR-HNNXBMFYSA-N 339.266 5.035 30 20 EKED CCC(CC)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 392245971 PYAYYVBIHSRXNZ-VGOFRKELSA-N 336.479 5.417 30 20 EKED Cc1oc(-c2ccsc2)nc1CS[C@@H](C)c1cccc(C#N)c1 443147353 RHCCKHJIESPGJI-ZDUSSCGKSA-N 340.473 5.578 30 20 EKED CC(C)(C#N)CCCCN1CCSC[C@@H]1c1ccc(Cl)cc1 444643087 SMCWPQBERWPYCV-QGZVFWFLSA-N 336.932 5.150 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(Cl)c1 476164004 UXEIWXVZXORXNB-UHFFFAOYSA-N 348.273 6.098 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(F)c3ccccc23)n1 483708980 IKGCNIDLKGRQTI-HNNXBMFYSA-N 338.407 5.049 30 20 EKED CCC[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 500896800 SDGODJIGGBUIFZ-SFHVURJKSA-N 333.262 5.496 30 20 EKED CC(C)CCOc1ccc(CN[C@H](CCC#N)c2ccccc2)cc1 532669920 PSKZAIDVQJPZAM-JOCHJYFZSA-N 336.479 5.246 30 20 EKED C=CCC[C@@H](NCc1ccc(C)cn1)c1ccc(C(F)(F)F)cc1 532725925 KJQNEOIBPQHVPG-GOSISDBHSA-N 334.385 5.206 30 20 EKED C[C@H](CCC(F)(F)F)NCc1ccc(-c2ccccc2C#N)cc1 541555881 JYOXGIBLHXPFMM-CQSZACIVSA-N 332.369 5.046 30 20 EKED CCC1(c2ccc(Cl)cc2)CCN(C(=O)CCCCCC#N)CC1 588165766 SFYNIEDSNABZRO-UHFFFAOYSA-N 346.902 5.084 30 20 EKED CC(C)c1ccc(NC(=O)N2Cc3ccc(C#N)cc3C2)c(C(C)C)c1 594061155 GNAYIPDUTYVFLH-UHFFFAOYSA-N 347.462 5.353 30 20 EKED C=CCCCN(C)C(=O)c1sc2cc(Cl)ccc2c1Cl 605646243 HBOVUIGLGXFCTN-UHFFFAOYSA-N 328.264 5.246 30 20 EKED C=CCCCCCN(C)C(=O)c1sc2cccc(F)c2c1COC 606817007 OAMPGDQPNFTACB-UHFFFAOYSA-N 349.471 5.005 30 20 EKED CC(C)Oc1ccccc1[C@H](C)NCc1ccc(C(C)(C)C#N)cc1 614179178 HMPFWMWBRGATRF-KRWDZBQOSA-N 336.479 5.126 30 20 EKED CCc1c([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)oc2ccccc12 618802802 FUXWBVGQOUJUFU-VBKZILBWSA-N 330.431 5.205 30 20 EKED O=C1/C(=C\c2cccnc2Cl)CCSc2ccc(Cl)cc21 748442823 YGIAHDPEAMITBH-NTMALXAHSA-N 336.243 5.151 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 756223918 HUCUKIOHBKADDX-KXBFYZLASA-N 328.415 5.238 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C/c2ccc3cnccc3c2)cc1Cl 782348618 TZTHVISOVMVOLG-DUXPYHPUSA-N 343.213 5.020 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C\c2cccc3cnccc23)cc1Cl 782890445 ZMUPCWXUFJJJDK-PLNGDYQASA-N 343.213 5.020 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Nc1ccc(CCC#N)cc1 905856295 VYADJHWJCCQSHX-IRXDYDNUSA-N 349.478 5.095 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 67253626 JAIVWCIZPOYUPC-IBGZPJMESA-N 338.863 5.152 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)oc12 181418020 VCGCOPZXFIQRKZ-LSDHHAIUSA-N 334.419 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(F)cc1Cl 189895559 ZEWRFDRYVTUXMW-UHFFFAOYSA-N 345.845 5.892 30 20 EKED Cc1ccc(CCC(=O)Nc2ccccc2S[C@H](C)CC#N)s1 290767017 KRWGPFBGOKVVPE-CQSZACIVSA-N 344.505 5.022 30 20 EKED CCc1nc2c(s1)[C@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340448364 RSTARFZBMXNRDX-DLBZAZTESA-N 339.508 5.108 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(C2CCC2)cc1)c1ccccc1 352165221 CIKWSHPBGIGNMK-NRFANRHFSA-N 332.447 5.119 30 20 EKED CCO[C@@H](C)c1nc(CSCCC2(C#N)CCCCC2)cs1 419410617 AUHCBFUMTMYUIK-AWEZNQCLSA-N 338.542 5.338 30 20 EKED CN(CCCCC#N)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482991840 VYZIIZIXNSDMRE-IBGZPJMESA-N 330.834 5.194 30 20 EKED C[C@@H]1CCC[C@H](OCc2cccc(NCc3cc(C#N)cs3)c2)C1 532728365 OMXCLQWGUNKQOU-BEFAXECRSA-N 340.492 5.327 30 20 EKED C=C[C@H](CC(=O)Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1 536165880 PXWKPSPBGZFEQL-CQSZACIVSA-N 332.403 5.004 30 20 EKED N#CCCC1CCN(c2cc(C(F)F)nc3ccc(Cl)cc23)CC1 564903862 CDFWCCVNZBCWEG-UHFFFAOYSA-N 349.812 5.346 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2ccc(O)nc12 576380467 SPHVITXPFZGSFN-UHFFFAOYSA-N 346.430 5.045 30 20 EKED CCCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@@H](C)c1ccccc1 604495654 XEPYRHQVOMKQJW-ROUUACIJSA-N 349.478 5.192 30 20 EKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccsc1 619747900 WORZZFYNJXUPGJ-MRXNPFEDSA-N 348.471 5.050 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2csc3ccccc23)cc1 730018913 BUHVUNZQRYEPLZ-HUUCEWRRSA-N 336.460 5.043 30 20 EKED Clc1ccc([C@@H]2CCCC2=NNc2ncnc3sccc23)cc1 741453907 BOBKEHRORZXVBY-ZDUSSCGKSA-N 342.855 5.080 30 20 EKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1ccc(Cl)s1 741840169 IZCUMCQGEHPXAI-WAYWQWQTSA-N 346.757 5.239 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc(-c2ccncc2)cc1 760264734 MJHMFPBLZOYWMS-CMDGGOBGSA-N 346.455 5.369 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)CC(F)(F)F 931059276 JRJKTUJJNJJDPN-UHFFFAOYSA-N 342.405 5.345 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc2ccccc2c1 1776784817 ZSQYINKKFVDBIY-HXUWFJFHSA-N 327.468 5.133 30 20 EKED C=CCc1ccc(OCc2csc(-c3ccc(C)o3)n2)c(OC)c1 60804516 LJSHVLVRSZBDEW-UHFFFAOYSA-N 341.432 5.028 30 20 EKED N#CCC[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 90665734 XAJZXECRQWUOMU-ZWKOTPCHSA-N 342.895 5.512 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)c(F)c1 152862110 UTQHERPZAXDDOR-NSHDSACASA-N 347.390 5.003 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](CC)c2ccncc2)cc1 163810338 GNOYJAGQGHZHBR-KXBFYZLASA-N 330.859 5.015 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/Sc1ccccc1 216054628 KGOPOOPNIHSTAP-ZRDIBKRKSA-N 349.908 5.222 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1cccc(C#N)c1 237794039 AKWDDNFTBWQOEH-FQEVSTJZSA-N 332.472 5.002 30 20 EKED N#CCC[C@H](NC(=O)Nc1cccc2ccsc12)c1ccccc1 337339158 GHWKNARVNAQELH-INIZCTEOSA-N 335.432 5.068 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@@H](N[C@H](CCC#N)c2ccccc2)C1 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30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccccc1C#N 525599386 ONBFPDHGBNAWMM-LSDHHAIUSA-N 338.476 5.191 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1cccc(C)c1C)c1ccccc1 534665218 SDFFSFSPGUUYKM-DENIHFKCSA-N 333.475 5.327 30 20 EKED C[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 540607665 WHYUKSNNLBIJSF-PIGZYNQJSA-N 331.246 5.203 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 588834888 QVHWXBPQBUSAIC-QFIPXVFZSA-N 346.430 5.112 30 20 EKED N#CC1(c2ccc(CN[C@@H](c3ccc(F)cc3)C3CCC3)cc2)CC1 594921728 RYXXAOZXFSAWTC-OAQYLSRUSA-N 334.438 5.012 30 20 EKED C[C@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)CC(C)(C)C 603956466 OYTZLBJQLYAJKT-MRXNPFEDSA-N 338.451 5.147 30 20 EKED CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609046893 KTOPSGMADCOSQA-FQEVSTJZSA-N 349.478 5.021 30 20 EKED CC(C)[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc2ccccc2o1 619754627 GFAFCBBYUCQXFP-HXUWFJFHSA-N 338.838 5.445 30 20 EKED C#Cc1cccc(NC(=O)N[C@@H](C)c2ccc(SC(C)C)cc2)c1 729033888 VMYYJIPAUUFJCT-HNNXBMFYSA-N 338.476 5.051 30 20 EKED N#CCOc1cccc(/C=C\c2nc3cc(Cl)ccc3s2)c1 730151695 PLNPMTYSOPVYTF-DAXSKMNVSA-N 326.808 5.022 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)OCCC(C)(C)C#N)cs2)cc1 776362470 FILURWLQWSZAED-UHFFFAOYSA-N 342.464 5.030 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc(C)c(Br)s1)c1ccccc1 796340052 ILPKYGINGWAOBO-DZGCQCFKSA-N 348.309 5.234 30 20 EKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 93217952 XXEGQEFFGXRCAQ-LLVKDONJSA-N 347.871 5.085 30 20 EKED Cc1cc(Cl)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1C 425675658 BFMQZNUNIUOREM-AWEZNQCLSA-N 341.842 5.053 30 20 EKED CC(C)Oc1ccc([C@@H]2CCC[C@@H]2NCC2CCC(C#N)CC2)cc1 442867711 MCKQOOSRZPCAMV-OWXVKCJTSA-N 340.511 5.029 30 20 EKED C[C@@H](SCC(=O)Nc1cccc2ccccc12)c1cccc(C#N)c1 443161536 TYUIGGNBLZLEOL-OAHLLOKOSA-N 346.455 5.144 30 20 EKED N#Cc1cc(Cl)ccc1N[C@@H]1CCCc2cn(C3CCCC3)nc21 445591167 KEGGSUIROAUKAQ-GOSISDBHSA-N 340.858 5.013 30 20 EKED CC[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 476048724 FTMMSYYIAPFRQJ-CQSZACIVSA-N 346.883 5.084 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C 505009992 AEKRSHYROSVCQR-FXAWDEMLSA-N 334.463 5.215 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCC(C)(C)CCC#N)c1 538832831 OPKHUQPRQNQUJH-UHFFFAOYSA-N 330.419 5.391 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-c2ccc(F)cc2)o1 553305288 OJFJKMSOCRCOHB-NRFANRHFSA-N 346.405 5.125 30 20 EKED CCOc1ccc(-c2nc(CSCCC(C)(C)C#N)cs2)cc1 558094504 CEQKGBQDWXAXSK-UHFFFAOYSA-N 346.521 5.382 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc2c(c1)CCCO2 565659261 JTAPMMAMVTVRAK-UHFFFAOYSA-N 349.474 5.045 30 20 EKED N#Cc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c(F)c1 572207975 WZNFLGPPSMGLIE-GOSISDBHSA-N 349.236 5.245 30 20 EKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccccc3)cc2)s1 604027754 VMMZISNAHBHXPU-UHFFFAOYSA-N 348.427 5.227 30 20 EKED CSc1ccccc1C(=O)Nc1cccc(C#Cc2cccs2)c1 626626813 BWDFANVNPUFGDK-UHFFFAOYSA-N 349.480 5.122 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)CC(C)C)n2)cc1 727953451 BDZKYPBFGPHSKQ-RDJZCZTQSA-N 340.492 5.367 30 20 EKED N#Cc1ccc(CN2CCC[C@H]2c2ccccc2C(F)(F)F)c(F)c1 728061673 XIYLBSBYFMEBTH-SFHVURJKSA-N 348.343 5.053 30 20 EKED CC(=NNc1cccc2cnccc12)c1ccc(Cl)c(Cl)c1O 728433063 PVZCQWKIPLPQQC-UHFFFAOYSA-N 346.217 5.083 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(Oc2ccccn2)cc1 733750062 KUYRQCBYKWNKFZ-UHFFFAOYSA-N 340.382 5.483 30 20 EKED COc1cccc(C=Nc2cccc(CSC(C)C)c2C)c1O 741759114 XGZPNJFCTAQZOT-UHFFFAOYSA-N 329.465 5.101 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2cccc(Cl)c2)c1 746047702 PWYYSUUBOLPMIX-ICSRJNTNSA-N 342.870 5.262 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(SC(F)F)cc2)cc1 774277084 FIZVPAFBIXXUCH-UHFFFAOYSA-N 332.419 5.415 30 20 EKED C[C@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1cccc(C#N)c1 782784389 UPAMDZOZUDCLEM-LBPRGKRZSA-N 330.378 5.187 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(C#N)cc3Cl)co2)cc1 788359925 GBPVZQWYNOJUHF-CLFYSBASSA-N 348.789 5.071 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=S)NCC(C)(C)CCC#N 806598634 UKNSKMNVVYOHEJ-UHFFFAOYSA-N 345.556 5.550 30 20 EKED CC(/C=C\C(=O)c1cccc(C#N)c1)=C/c1ccccc1OC(F)F 811686870 BJZZVQXIRBGEIK-WEJYHURQSA-N 339.341 5.002 30 20 EKED C[C@H](CC(C)(C)C#N)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 926091818 OSHNPYHMTBHWCE-VOIUYBSRSA-N 346.540 5.008 30 20 EKED Cc1ccc(C)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c1 1776133414 WJHBMOACOBPHCM-LUAWRHEFSA-N 346.382 5.158 30 20 EKED CC(C)Cc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776340447 SLXQVPRSPIPRMG-UYRXBGFRSA-N 348.442 5.186 30 20 EKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1(C#N)CCCC1 76183327 NHBUPHMDESUQHJ-QGZVFWFLSA-N 348.446 5.158 30 20 EKED CC(C)(CCC#N)CN1CCc2sccc2[C@H]1c1cccs1 121141594 FQKSQIKVAZRVDI-KRWDZBQOSA-N 330.522 5.087 30 20 EKED C=C(C)[C@H](N[C@H](C)c1csc(C(C)C)n1)c1ccc(F)c(F)c1 186449947 MWEOEHREDZLURA-PXAZEXFGSA-N 336.451 5.513 30 20 EKED Cc1coc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc12 187954216 RODKRFRMPOXHOJ-UHFFFAOYSA-N 347.418 5.055 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc2ccccc12 189904397 VLFPYDWHMKFOQU-UHFFFAOYSA-N 330.431 5.339 30 20 EKED CC(C)(C)[C@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 236718028 PNIMWXXGMSEHIR-OAQYLSRUSA-N 336.479 5.246 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1 268810459 NZWUVQHETQQKQL-STQMWFEESA-N 327.497 5.033 30 20 EKED CC(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303916989 YAAIKZAOSSATAK-LEWJYISDSA-N 346.474 5.353 30 20 EKED Cc1cccc(C(C)C)c1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330021145 XILLIYAYQOBVGY-UHFFFAOYSA-N 342.483 5.632 30 20 EKED Cc1ccc2nc(-c3ccc(NC(=O)CC(C)(C)C#N)cc3)sc2c1 447105093 DMXCUBDDQQNZGZ-UHFFFAOYSA-N 349.459 5.150 30 20 EKED C=CCCCCCN(C)[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 468272780 XUAOCJAWHLHNSL-KRWDZBQOSA-N 327.472 5.093 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@H]1c1cccc(C(F)(F)F)c1 469517451 PUOQPYNXXMQKAR-KRWDZBQOSA-N 338.417 5.562 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccccc1 477528301 WJJICNVNFBZPEH-SFHVURJKSA-N 342.442 5.355 30 20 EKED Cc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)n1 481024502 OWKNYEGVOGQGFO-KRWDZBQOSA-N 341.458 5.088 30 20 EKED N#Cc1cc(F)ccc1CSCc1csc(-c2cccs2)n1 488462696 XJTFHWIVABFGLW-UHFFFAOYSA-N 346.477 5.316 30 20 EKED N#Cc1cccnc1N[C@H](c1ccccc1)c1cccc2ccccc12 520330953 GNRZDOCHZIOAQD-JOCHJYFZSA-N 335.410 5.308 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1cccc(CC#N)c1 521509811 CBIGCSVKKPXQLB-UHFFFAOYSA-N 344.867 5.159 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc2c(s1)CCC2 538527994 LSCYCHIOTAJWLX-AWEZNQCLSA-N 326.465 5.092 30 20 EKED CC[C@@H](C)Oc1cccc(NCc2cccc(OCCCC#N)c2)c1 559312315 GHOYWJTXTHNZHH-QGZVFWFLSA-N 338.451 5.159 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3ccc(F)cc3C#N)sc2c1 610577648 GADYRMHZNJBWBR-UHFFFAOYSA-N 344.798 5.126 30 20 EKED N#Cc1cc(Cl)ccc1SCc1coc(-c2cccs2)n1 610655337 ZYXFIFJGZLDUCD-UHFFFAOYSA-N 332.837 5.220 30 20 EKED Cc1cccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 613407085 IDDZQUILLRZWGN-AWEZNQCLSA-N 340.835 5.057 30 20 EKED Cc1oc(-c2ccccc2)cc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 626467381 QEQIPUIAWWTNLM-INIZCTEOSA-N 348.427 5.079 30 20 EKED C#Cc1cccc(N(C(=O)c2ccc(-c3ccc(F)cc3)o2)C(C)C)c1 728248173 NQQXWZNANLWRMF-UHFFFAOYSA-N 347.389 5.122 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cccc(Cl)c2Cl)s1 736434492 UIFRKDPKLLEIJG-FPLPWBNLSA-N 340.275 5.644 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1 739141839 FHJRPBXPKSHOLC-QAPCUYQASA-N 345.446 5.056 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cc2cc(Cl)ccc2o1 740765425 ZEUDCWCNDNALTP-VOTSOKGWSA-N 333.774 5.531 30 20 EKED CC(=NNc1cc(F)c(F)cc1F)c1cccc(-c2ccncc2)c1 741460979 RVBNNAFEBULBPQ-UHFFFAOYSA-N 341.336 5.002 30 20 EKED C[C@@H]1C/C(=C/c2ccc(Oc3cnccn3)cc2)C(=O)c2ccccc21 751535901 NGZSDMCEDXPIAU-WIZMWCRPSA-N 342.398 5.042 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)s1 762439679 VPEKARVLPJEBOP-GORDUTHDSA-N 341.741 5.188 30 20 EKED Cc1cncc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)c1 767365836 HFDROAGSPNVJMP-SOFGYWHQSA-N 346.411 5.156 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N[C@H]1CCCc2nc(O)ccc21 774812285 ZVKAWAOJBFPHQW-LPHOPBHVSA-N 346.515 5.058 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(C2SCCS2)c1 775974222 FWXUWNRCSSEOMS-CYBMUJFWSA-N 336.526 5.032 30 20 EKED Cc1ccc(C(=O)/C=C/c2c(OC(F)F)ccc3ccccc23)o1 797186044 JQAUMXIEPADJDS-CMDGGOBGSA-N 328.314 5.239 30 20 EKED C[C@@H](Cc1cccc(C(F)(F)F)c1)Nc1ccccc1O[C@@H](C)C#N 798931574 GFEIIASMUMLSAL-KBPBESRZSA-N 348.368 5.039 30 20 EKED C=CCC[C@H](CC(C)C)C(=O)Nc1ccc2sc(C(=O)O)cc2c1 1776165768 CCKSIBLTPGFESM-CYBMUJFWSA-N 345.464 5.167 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cc(-c2ccccc2)no1 114452545 NPQAHAMOLXLSCO-OAHLLOKOSA-N 349.459 5.348 30 20 EKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Cl 118445693 KTXQHMLWVQTYGD-STQMWFEESA-N 344.867 5.033 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1coc(-c2ccccc2)n1 159560387 YBIBCZQIHOVKIH-OAHLLOKOSA-N 349.459 5.205 30 20 EKED Cc1c(Cl)cccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 192505703 GQEZHWSAQFQZRU-LBPRGKRZSA-N 344.867 5.153 30 20 EKED COc1ccc(CN(CCCCC(C)(C)C#N)[C@H](C)C2CC2)cc1 444600827 USXRJSMVPLFIKW-QGZVFWFLSA-N 328.500 5.016 30 20 EKED N#Cc1cc(Cl)ccc1CNc1ccccc1CCC(F)(F)F 478364050 UETGEZISIWAZME-UHFFFAOYSA-N 338.760 5.319 30 20 EKED C=CCCCC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 479212743 STTOLXGQURSITE-LBPRGKRZSA-N 348.899 5.305 30 20 EKED N#Cc1cc(F)ccc1CSCc1csc(-c2ccsc2)n1 488494528 NSFXTQQMXVYQBN-UHFFFAOYSA-N 346.477 5.316 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1csc2ccccc12 500330287 KTXHSBXBZXBZRG-UHFFFAOYSA-N 348.471 5.071 30 20 EKED C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1cccc(C#N)c1 507215414 RRLCGLIQEZRUDA-SNVBAGLBSA-N 329.375 5.279 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2Cl)c1 510995786 JCZFKQUDQBBXNJ-AWEZNQCLSA-N 344.842 5.130 30 20 EKED Cc1sc(NC(=O)c2cc(C(C)C)nc3ccccc23)c(C#N)c1C 513793334 WMBZRGYTGSRDJA-UHFFFAOYSA-N 349.459 5.161 30 20 EKED C=CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 521936047 QVJATUHDAKYRPP-ZWKOTPCHSA-N 345.364 5.028 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2ccncc2)cc1 539609090 DCQWSWSRXBOKAW-HZPDHXFCSA-N 345.421 5.171 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(OC2CCCC2)c1 557522942 GYWWDUXWOAYURE-QHCPKHFHSA-N 346.474 5.047 30 20 EKED N#CCCC[C@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccccc1 580175141 LFTUTJDNRWICRR-LEWJYISDSA-N 338.882 5.742 30 20 EKED N#CCCCCCC(=O)Nc1cccc(CSC2CCCCC2)c1 588158352 SSNSXYSRTWLMGO-UHFFFAOYSA-N 344.524 5.665 30 20 EKED C[C@H](Nc1ncccc1C#N)c1ccc(Oc2ccccc2)c(F)c1 603871574 GUTCQGVREIQCCV-AWEZNQCLSA-N 333.366 5.058 30 20 EKED C[C@H](SCc1csc(-c2ccoc2)n1)c1ccc(C#N)cc1 609825782 TUPGJVYEOIVOTL-LBPRGKRZSA-N 326.446 5.269 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2ccccc2CCC(F)(F)F)C1 666315762 JWVQGIDNOXIKBG-AWEZNQCLSA-N 340.389 5.002 30 20 EKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(Cl)s1 726426219 SCHYIJVRIWQDJW-UHFFFAOYSA-N 343.761 5.128 30 20 EKED CC(C)(C)CN(CCC#N)Cc1cc2oc3ccccc3c2cc1O 729467785 CQFMGYZWRSTRIR-UHFFFAOYSA-N 336.435 5.053 30 20 EKED CCc1nc(C)c(C(C)=NNc2ccnc3cc(Cl)ccc23)s1 735223722 GFTINNSMAJBXJO-UHFFFAOYSA-N 344.871 5.052 30 20 EKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1ccc(C#N)cc1 735675701 MJXFSVJGSPFBMI-CYBMUJFWSA-N 342.851 5.108 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(SC(F)F)cc1 740427364 JFFHJQXLIGIHIS-UHFFFAOYSA-N 328.428 5.211 30 20 EKED C=CCOc1ccc(Oc2nc(C(F)(F)F)nc3ccccc23)cc1 742425048 BPUHEESVRVGVKP-UHFFFAOYSA-N 346.308 5.006 30 20 EKED Cc1ncsc1/C=C1/CCc2c(Cl)sc(Cl)c2C1=O 760265004 PMHSDDHBDMGUCW-DAXSKMNVSA-N 330.261 5.032 30 20 EKED Cc1cccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 783593969 PJXNVNOMVSDEFS-QGZVFWFLSA-N 342.442 5.090 30 20 EKED Cc1ccc(N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 847154044 OHPRZAYUQCDZHI-HNNXBMFYSA-N 339.464 5.058 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NCCC1CC(F)(F)C1 926557223 JZWLLWMLXGQWEL-UHFFFAOYSA-N 341.286 5.065 30 20 EKED CCCCCCC[S@](=O)Cc1csc(-c2ccsc2)n1 133148305 ZXHBLRPFDKUXIU-HXUWFJFHSA-N 327.540 5.091 30 20 EKED COc1cccc2c(N[C@H](CCC#N)c3ccccc3)cc(C)nc12 439098005 GCTUUMVPXMKTAB-GOSISDBHSA-N 331.419 5.009 30 20 EKED N#CC1CCC(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)CC1 442870078 UFYMJUAAMCZTEZ-AJTFCVKESA-N 336.454 5.029 30 20 EKED Cc1cc(C)c2ncc(C#N)c(N3CCC[C@@H]3c3cccs3)c2c1 461465732 UYDICUUEFUZIND-QGZVFWFLSA-N 333.460 5.126 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 466435093 WHVYBEKLMJVDAG-LBPRGKRZSA-N 333.353 5.312 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC/C=C/c1ccccc1 475553607 YYQSFGUVKIENDJ-UKTHLTGXSA-N 334.463 5.373 30 20 EKED N#CCCSc1ccccc1NC(=O)Cc1ccc2ccccc2c1 520807386 COZCVMBGAJPUQH-UHFFFAOYSA-N 346.455 5.027 30 20 EKED C[C@H](SCc1cc(-c2cccs2)on1)c1ccc(C#N)cc1 522968214 DZIVCQOUNYQVGZ-LBPRGKRZSA-N 326.446 5.269 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCCC(C)(C)C1 535157962 RICFIUZNOQWHNE-GJZGRUSLSA-N 330.497 5.236 30 20 EKED Cc1cc([C@@H](Nc2cccc(OCCCC#N)c2)C2CC2)ccc1F 537425191 JCAOHBJGICCZAK-NRFANRHFSA-N 338.426 5.380 30 20 EKED C[C@@H](N[C@H](COc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 539510971 QPVWTZRWXWBZFW-WZONZLPQSA-N 342.442 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(C(F)(F)F)CC1 564252688 VZLNHHCRLNEWOU-UHFFFAOYSA-N 325.374 5.210 30 20 EKED C=CCCOc1cc2ccccc2cc1C(=O)Nc1ccccc1OC 582128878 NIDFYQQGLHTNCK-UHFFFAOYSA-N 347.414 5.056 30 20 EKED N#CCCCCCC(=O)Nc1ccc2nc(C3CCCCC3)[nH]c2c1 588631743 ZLOVDXSXELHSTP-UHFFFAOYSA-N 338.455 5.023 30 20 EKED C=CCCCCCN(C)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 606813991 GCGXBMAEAPIPAN-IRXDYDNUSA-N 339.401 5.014 30 20 EKED CC(C)c1ccc(-c2nnc(SCc3ccccc3C#N)o2)cc1 608929963 HFSQHSKIJPCJDV-UHFFFAOYSA-N 335.432 5.024 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1S[C@@H](C#N)C1CCCCC1 609650914 RJGJDRSHLCHZQW-IBGZPJMESA-N 333.460 5.185 30 20 EKED C[C@@H](Nc1ncc(C#N)cc1Cl)c1cccc(Cl)c1Cl 609797577 RDHRMDMCUYAZMB-MRVPVSSYSA-N 326.614 5.087 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1 613901767 TZJVTBALMBWAII-LEWJYISDSA-N 349.474 5.289 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2)o1 618805184 DQRZHXKKKGLQLN-QRWLVFNGSA-N 328.415 5.156 30 20 EKED Clc1c(C=NNc2ncnc3sccc23)sc2ccccc12 725819194 HGSRIIRKMCCRIE-UHFFFAOYSA-N 344.852 5.005 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1 728694921 NEVKGCFTPWAVDW-TWLAMCEISA-N 346.213 5.180 30 20 EKED Cc1ccc(F)c(CNCc2cccc(-c3ccc(C#N)s3)c2)c1 740010768 HTFNFAUEADSAJG-UHFFFAOYSA-N 336.435 5.024 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744034610 CSEGNYYBFLFQEL-OCCSQVGLSA-N 348.899 5.732 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1F 747003894 UCSJECQYWZSAQV-KXFIGUGUSA-N 325.166 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCC2(CCC2)CO1 890166092 XLTMDAYBQCRIBJ-SFHVURJKSA-N 341.495 5.216 30 20 EKED CCc1oc2ccccc2c1C=NNCc1ccc(C(F)(F)F)cc1 915971864 CQGXZZPDJYBGHK-UHFFFAOYSA-N 346.352 5.138 30 20 EKED CCCCC/C(C=NNc1cccc(C(=O)O)c1)=C\c1ccccc1 1776036595 CKUJNGHHSVPZNZ-NWSQRXPDSA-N 336.435 5.446 30 20 EKED C=CCCCCCCCCCNc1ncnc2cc(C(=O)O)ccc12 1776172546 YRCPJHBOQFMQEF-UHFFFAOYSA-N 341.455 5.047 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1c(F)cc(C)cc1Cl 1776783676 BLFYONLJSPQMNB-CQSZACIVSA-N 343.870 5.081 30 20 EKED C=CCN(C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 71846389 WCVHTHNLMOOZGH-ROUUACIJSA-N 345.364 5.028 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(F)c(F)c1 141468805 ATJXIDUHRVNLPU-RQOWECAXSA-N 333.384 5.046 30 20 EKED CCSc1cccc(NCc2cccc(OCCCC#N)c2)c1 178234864 HTHHCNDLKHQLBP-UHFFFAOYSA-N 326.465 5.093 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(OCC#N)cc1 193007843 YYUHQOMYXAHVEK-KBPBESRZSA-N 348.368 5.020 30 20 EKED CCC(CC)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1 236682279 CTSHKGZGGCSZRD-VGOFRKELSA-N 336.479 5.245 30 20 EKED Cc1oc2ccccc2c1CC(O)=Nc1cnn(C2CCCC2)c1C 329939675 FTJPKNKBYXMBTB-UHFFFAOYSA-N 337.423 5.192 30 20 EKED Cc1cc(Cl)ccc1NC(=O)c1sc2ccc(C#N)cc2c1C 429952797 XNPGGGVECJAMTK-UHFFFAOYSA-N 340.835 5.296 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCC(C)(C)C1 432581284 WOAAWYLUTOAFAD-KRWDZBQOSA-N 328.500 5.581 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432737577 LNCOGOAERIYFEP-IBGZPJMESA-N 349.478 5.541 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(Cl)c1SC(C)C 438246570 MGRWMIPSYOHPJI-UHFFFAOYSA-N 326.893 5.270 30 20 EKED CCN(C(=O)CC[C@@H](C)c1ccccc1)[C@H](C)c1ccc(C#N)cc1 440791638 KEALPRRRGKDWGP-QZTJIDSGSA-N 334.463 5.052 30 20 EKED CC[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 447537393 VNMYEHLKFCZAIK-GOTSBHOMSA-N 344.433 5.528 30 20 EKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455917890 KGBJUDUTHTZZAC-LAUBAEHRSA-N 347.462 5.066 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H]3CCC[C@H](C#N)C3)s2)cc1 463235732 DIUSADQGMHNYDU-ZVZYQTTQSA-N 339.508 5.160 30 20 EKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CCCCCC1 481975946 SWZONLDVNZTKBE-UHFFFAOYSA-N 348.446 5.145 30 20 EKED CC(C)(C#N)CCC[S@@](=O)Cc1ccc(C2CCCCC2)cc1 505731877 AZIKYEJKGLMFSD-HSZRJFAPSA-N 331.525 5.313 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ncc(-c2ccccc2)s1 519959285 GKCKSYPEXQNXNA-UHFFFAOYSA-N 349.459 5.030 30 20 EKED C=C[C@@H](CC(=O)N(C)[C@@H](C)c1cc2ccccc2o1)c1ccccc1 535335440 FPBAXIBWCTXSDF-IRXDYDNUSA-N 333.431 5.312 30 20 EKED C[C@H](NCC(C)(C)CCC#N)[C@H](C)Oc1ccc(Cl)cc1Cl 554066405 HIIDVHMIMJSIFE-STQMWFEESA-N 343.298 5.069 30 20 EKED N#CCCC[C@@H](N[C@@H](CCc1ccccc1)C(F)F)c1ccccc1 556203265 IXIUWIZXEHZDOT-UXHICEINSA-N 342.433 5.278 30 20 EKED CC1(C#N)CCC(Nc2cccc(NC(=O)C3CCCCC3)c2)CC1 579074355 KWALCJQIMXDDRD-UHFFFAOYSA-N 339.483 5.090 30 20 EKED Cc1cccc(-c2nnc(SCCC#N)n2[C@@H]2CCCC[C@H]2C)c1 593578000 IGOUPMPHGPDQFJ-NVXWUHKLSA-N 340.496 5.011 30 20 EKED N#Cc1cc(CNc2ccc(F)cc2-c2ccc(Cl)cc2)ccn1 610956423 RBWQYSFHCAXXJO-UHFFFAOYSA-N 337.785 5.025 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCc2c1ccc(Cl)c2Cl 618806967 UKOHDLIFAOXZHN-QZTJIDSGSA-N 343.257 5.129 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2cc(OC)c(Cl)cc2C2CC2)C1 667304083 LFAHGPDLVWVQOY-CYBMUJFWSA-N 348.874 5.046 30 20 EKED FC(F)Oc1ccc(NN=Cc2cccc(Cl)c2Cl)cc1 726428833 HAEZYYMFHKAJMH-UHFFFAOYSA-N 331.149 5.041 30 20 EKED O=C1/C(=C\c2ccc3ncccc3c2)Cc2c1ccc(Cl)c2Cl 729150813 MWIVDRGQYMSRDT-LCYFTJDESA-N 340.209 5.364 30 20 EKED CCn1cc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)cn1 732530198 KDWQXZHENSHJOD-FPLPWBNLSA-N 342.851 5.181 30 20 EKED CC(C)n1cc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cn1 732713699 FZXHKDZCZIECJO-GHXNOFRVSA-N 340.492 5.395 30 20 EKED N#CCC[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1 749036734 YIPCJTFOOCROFZ-QFIPXVFZSA-N 340.426 5.128 30 20 EKED O=C(/C=C\c1c(OC(F)F)ccc2ccccc12)c1ccsc1 749101600 HUOGIIKARSHDMB-SREVYHEPSA-N 330.355 5.399 30 20 EKED O=C1/C(=C/c2coc(-c3ccccc3)n2)[C@@H]2CCCc3cccc1c32 763290642 RROBSYBSGFBJDD-DAQNXSASSA-N 327.383 5.041 30 20 EKED C=CC[C@H](N[C@@H](C)c1cccc(-c2ccccc2)c1)c1ccncc1 766023383 UMPIOOVQWXDJRM-MBSDFSHPSA-N 328.459 5.717 30 20 EKED N#CC1(CCCS[C@@H]2CCc3cc(Cl)ccc32)CCOCC1 795384591 URUNCTBJZOVQEE-QGZVFWFLSA-N 335.900 5.161 30 20 EKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1coc(C(C)C)n1 799473785 QBOVYOXIZVLHRQ-UHFFFAOYSA-N 336.439 5.108 30 20 EKED N#Cc1ccccc1/C=C\C(=O)Nc1ccccc1Oc1ccccc1 799635890 ASGGGCPCIIAIOJ-PFONDFGASA-N 340.382 5.002 30 20 EKED C[C@@H](C#N)OCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 801655431 ZFXKHIKKTFQOBB-KSSFIOAISA-N 331.868 5.091 30 20 EKED O=C(/C=C\c1ccc(C(F)(F)F)s1)c1c(F)cccc1Cl 809159765 WBKPYNDDZGYYCQ-XQRVVYSFSA-N 334.721 5.456 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccs3)cc2)cc1 1777671109 DMEWEHHIXJTHBJ-XGICHPGQSA-N 334.396 5.009 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(OC(F)F)cc1 172906228 OOJCBVVYVINNGK-ZDUSSCGKSA-N 348.418 5.152 30 20 EKED Cc1ccccc1CNc1ccccc1NC(=O)C1(C#N)CCCCC1 180185908 XLGCUPPGWUHJHC-UHFFFAOYSA-N 347.462 5.020 30 20 EKED CN(CCC#N)c1ccc(CN[C@@H](c2ccccc2)C2CCCC2)cc1 237209790 WYIQQUGVGIPBCP-QHCPKHFHSA-N 347.506 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C)[C@@H](C1)C2(F)F 297754647 KNPROFUFUMRMGV-APWZRJJASA-N 348.437 5.048 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1nc2c(s1)CCCC2 340449421 VDUBXDXNBFCAND-DOTOQJQBSA-N 339.508 5.108 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccco2)C1 365124151 JMXNFIOJXKYWJM-QGZVFWFLSA-N 338.451 5.153 30 20 EKED CC(C)O[C@H](CN[C@H](CCCC#N)c1ccccc1)c1ccccc1 433025266 JGWUBMJHDGRHPR-FGZHOGPDSA-N 336.479 5.177 30 20 EKED C[C@@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 439678893 RQBJWOZJUXVMFY-VGSWGCGISA-N 342.442 5.105 30 20 EKED CCC[C@@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 460341758 XFPVTKDXNOROLC-OAHLLOKOSA-N 340.854 5.181 30 20 EKED C[C@H]1CCC[C@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 482542053 FJQIEMNCVDALBI-LPHOPBHVSA-N 348.446 5.001 30 20 EKED Cc1sc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)c(C#N)c1C 503132317 CAAGYWRVORNVIR-ROUUACIJSA-N 346.455 5.132 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 518277083 COMSAIPBNZVRDQ-CQSZACIVSA-N 336.822 5.322 30 20 EKED N#CCC[C@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 533496403 JEBNXCWFVPTOPJ-FQEVSTJZSA-N 332.472 5.550 30 20 EKED C[C@@H](N[C@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541133937 MGJBLDCUACVEDB-HZPDHXFCSA-N 332.472 5.699 30 20 EKED C[C@H](N[C@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 543961294 HTBHFCWSNLUVSN-JKSUJKDBSA-N 332.472 5.699 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C#N)Cc1ccccc1 609918798 PHDRUTPCCGLHLK-NHCUHLMSSA-N 346.499 5.065 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1c(C)nc2ccccc2c1C 669675449 GGEBMOUEFQKMRH-UHFFFAOYSA-N 344.458 5.151 30 20 EKED C#Cc1cccc(NC(=S)N(Cc2ccc(C(C)C)cc2)C2CC2)c1 726446774 JAOOKTGOOQKLMM-UHFFFAOYSA-N 348.515 5.153 30 20 EKED Clc1ccc(C=NOCc2ncc(-c3ccc(Cl)cc3)o2)cc1 727433333 RRQQRNKCMHIPGZ-UHFFFAOYSA-N 347.201 5.199 30 20 EKED CCCCCCCCOCc1nc(-c2nccc3ccccc23)no1 743277320 COJABNKAHRULQA-UHFFFAOYSA-N 339.439 5.162 30 20 EKED CCOc1cccc(/C=N\[C@H](C)c2ccc(-c3ccncc3)cc2)c1O 746393190 HRGMWFMFTNDTOO-OYJNRBEISA-N 346.430 5.033 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)cs1 758306227 CWAJQUZHVBSFMR-JTQLQIEISA-N 336.869 5.048 30 20 EKED CCCCCCCCCC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 765328985 VJBMNSHGGZYLQC-VQTJNVASSA-N 331.500 5.164 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(OCC(=C)Cl)cc1)c1ccncc1 766022529 WTQVTBSHQLVYRV-JXFKEZNVSA-N 342.870 5.181 30 20 EKED C[C@@H](OC(=O)CCCCCC#N)c1ccc(Cl)c(C(F)(F)F)c1 805902358 PGMFJSHEXODHLX-LLVKDONJSA-N 347.764 5.437 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1nccc2ccccc12 811698173 IVSCJMHSCUYRGB-BQYQJAHWSA-N 348.452 5.316 30 20 EKED CCSc1ccc(C(=O)/C=C/c2ncc(CSC)s2)cc1 834430772 YBIXAWDTKSHOHT-CMDGGOBGSA-N 335.519 5.014 30 20 EKED CC[C@@H](c1ccc(F)cc1F)[S@](=O)CCCCC1(C#N)CCC1 899392017 ODFOEOWQRZPKJK-GAJHUEQPSA-N 339.451 5.029 30 20 EKED O=C(O)c1cc2cc(/C=C\C(=O)c3cccc4ccccc34)ccc2o1 1776113910 BNBQYLCZSUQGGV-NTMALXAHSA-N 342.350 5.180 30 20 EKED C=CCC[C@@H](NCc1nnc(-c2ccccc2)s1)c1ccccc1 119151970 CQDCHCMQIDPBPJ-GOSISDBHSA-N 335.476 5.002 30 20 EKED C=CCC(CC=C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 155442734 QTCMCVXZOUSVPD-UHFFFAOYSA-N 344.455 5.049 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCc2occc21 191417166 QCHHHFDKROLTIY-SFHVURJKSA-N 338.451 5.331 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](C)c1ccc(Oc2ccccc2)cc1 303890448 RTLMHOYGDMKGRG-KRWDZBQOSA-N 338.451 5.148 30 20 EKED CCC(CC)(/N=C(/O)c1cc(C)n(C2CCCCC2)c1C)C(=N)O 330766858 VTUFDSDNWVVTPD-UHFFFAOYSA-N 333.476 5.009 30 20 EKED N#CCCC[C@H](NCc1ccc(Cl)c2cccnc12)c1ccccc1 433015312 WJCUZESHBWVCAT-FQEVSTJZSA-N 349.865 5.413 30 20 EKED CCCCC[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458799768 KDLIHNJRJILQKT-WOJBJXKFSA-N 341.499 5.176 30 20 EKED N#CC[C@H](CC(=O)N1CCC[C@@H]1CCC1CCCC1)c1ccccc1 476379282 VCTGCPTWCIGYPS-NHCUHLMSSA-N 338.495 5.035 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(Cl)c1F 477835153 GFCABPHFICCBGG-CHWSQXEVSA-N 348.874 5.904 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1cccs1 505028235 ALCRIXAOKIGAEF-QGZVFWFLSA-N 326.465 5.236 30 20 EKED CCN(Cc1nc(-c2ccccc2)cs1)[C@H](C)c1ccc(C#N)cc1 508605571 RDCYNFTXCOLORX-MRXNPFEDSA-N 347.487 5.265 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H]1CCC[C@@H](C)C1 520824914 HWKRMJXNBMJTHD-OAGGEKHMSA-N 330.497 5.093 30 20 EKED C[C@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 539506497 JGLFFEVKPVQALG-GTNSWQLSSA-N 331.246 5.203 30 20 EKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1ccc(C#N)cc1 609814013 RWYPWYDAFPHAQB-OAHLLOKOSA-N 341.439 5.345 30 20 EKED CCOc1ccc(C(F)(F)F)cc1N[C@@H](C)c1ccc(C#N)cc1 609825459 YHRAYGOYKXVHCF-LBPRGKRZSA-N 334.341 5.149 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1Cl 619754649 GQTOOXWPZHZOGW-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(OCC#N)cc1 731211981 MDTRPMIXZQWCIP-ZDUSSCGKSA-N 349.261 5.089 30 20 EKED CCCCCCCCCN(C)C(=O)c1cnc(-c2ccncc2)s1 741546214 CHMTUGZMGIKHBL-UHFFFAOYSA-N 345.512 5.028 30 20 EKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1ccsc1 749101162 BVPKRKZLJALRSB-AATRIKPKSA-N 331.849 5.421 30 20 EKED O=C(/C=C/c1cscc1Cl)c1cccc(-c2ccncc2)c1 771861016 UPSOLCMCJJEBGZ-SNAWJCMRSA-N 325.820 5.360 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C(C)C)c(O)cc1C 777279474 PYXIAHVQQKLIML-UHFFFAOYSA-N 341.476 5.354 30 20 EKED C#Cc1cccc(NC(=O)[C@H](Sc2ccccc2)c2ccccc2)c1 817840820 HJQGDTAMXVOMOQ-OAQYLSRUSA-N 343.451 5.140 30 20 EKED C=CCCC(C)(C)CNc1ccc([S@](=N)(=O)C(F)(F)F)cc1 882679901 FBJXCIRMSWTOKB-QFIPXVFZSA-N 334.407 5.016 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(Cl)c(NC(C)=O)c1 920350782 FIUCDKYBPODDGE-UHFFFAOYSA-N 338.879 5.378 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(/C=C/C(=O)O)cc1)CC2 1776374767 NOVMWEWBJSYOGR-BDPZUMOYSA-N 346.426 5.120 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccccc1C(F)(F)F 69124442 PGOYEQLVYFCLQH-CSKARUKUSA-N 327.305 5.150 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1Cl 183798818 XZFPEWVZBFAONF-CYBMUJFWSA-N 330.834 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCO[C@@H](CCC)C1 189879636 PZZVRCZRIYOJSI-ROUUACIJSA-N 329.484 5.072 30 20 EKED N#CC1(CCCSCc2ccc(C(F)(F)F)cc2)CCOCC1 280926657 GZGNPJWUSKFMGV-UHFFFAOYSA-N 343.414 5.039 30 20 EKED C[C@@H](NCCC(C)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 379158419 GBYHAOUSQUOTKJ-MRVPVSSYSA-N 349.265 5.420 30 20 EKED CC(C)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H](C)c1ccsc1 421694163 UJPFASSSLZMHNW-WMZOPIPTSA-N 340.492 5.134 30 20 EKED COc1ccccc1Oc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1 439551058 NVPKDAQYHBTRRQ-INIZCTEOSA-N 344.414 5.532 30 20 EKED C=CCC[C@@H](NC(=O)c1occc1C)c1ccc(C(F)(F)F)cc1 441588867 MISNJOCIQAOOER-OAHLLOKOSA-N 337.341 5.044 30 20 EKED C[C@@H](NCCCC(C)(C)C#N)c1cccc(OCc2ccccc2)c1 444714979 BVFQMZWBNLQKDI-GOSISDBHSA-N 336.479 5.246 30 20 EKED Cc1cc(Cl)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1C 452828490 BAJSSQNOAXDLQK-UHFFFAOYSA-N 326.827 5.010 30 20 EKED CC(C)CC[C@@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 473757813 VYEAIGZXKOXPQI-IBGZPJMESA-N 341.499 5.310 30 20 EKED Cc1cc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)ccc1C#N 488285136 NXMOXNFDZOXVFX-OAHLLOKOSA-N 347.487 5.149 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1csc2ccccc12 493902747 GLSZGCWFPMCFGL-UHFFFAOYSA-N 349.459 5.217 30 20 EKED CC(C)(C)[C@H](CC1CCCCC1)NCCCC1(C#N)CCOCC1 499608791 GUYVFFLLFWKQTF-IBGZPJMESA-N 334.548 5.062 30 20 EKED C[C@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1F 512647882 KGKPZTVWLDMPCQ-NSHDSACASA-N 349.236 5.344 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C)c1ccc(C#N)cc1 524069133 XWHHSTFJWXTKLE-UTKZUKDTSA-N 346.499 5.563 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1Cl)c1ccccc1 534624813 VBNIYAHRBWPJKO-JXFKEZNVSA-N 339.866 5.363 30 20 EKED C[C@H](NCc1cccc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 542014322 GGFLAPRJCJSLGA-INIZCTEOSA-N 330.406 5.215 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cscc2-c2ccccc2)cc1 566708050 APQVQYFQOCAPBJ-UHFFFAOYSA-N 346.455 5.469 30 20 EKED Cc1cc(C)cc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c1 582034582 HOJWYNRMTRPUMO-CQSZACIVSA-N 332.369 5.045 30 20 EKED Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(Cl)c1C 592678708 BMYVEOMAUNEELF-UHFFFAOYSA-N 326.827 5.010 30 20 EKED N#CC1(c2ccc(CNc3cccc(CCC(F)(F)F)c3)cc2)CC1 594932139 MGUTYBRGBZMMKS-UHFFFAOYSA-N 344.380 5.349 30 20 EKED Cc1cc(Oc2ccccc2)ccc1NC(=O)C1(C#N)CCCCC1 609445391 SCJDLYYJDDZJED-UHFFFAOYSA-N 334.419 5.200 30 20 EKED Cc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)n1 611367793 UWSVOVRMLIIRJN-KRWDZBQOSA-N 341.458 5.088 30 20 EKED N#Cc1ccc(CN[C@H]2CCSc3c(Cl)cccc32)cc1Cl 619755049 RMVWXPLJVXYFQR-INIZCTEOSA-N 349.286 5.192 30 20 EKED C#Cc1cccc(N(C(=O)c2ccc(SC(C)C)cc2)C(C)C)c1 728246879 MZQHAEFBZJCPFT-UHFFFAOYSA-N 337.488 5.224 30 20 EKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 741110488 DLXLWYYBMAJJMX-SJORKVTESA-N 348.471 5.302 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cncs1 767729007 MMWPKLJMMJVZLA-VOTSOKGWSA-N 346.864 5.125 30 20 EKED C=CCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 796761539 DNLQUEQEECNUMO-CQSZACIVSA-N 344.867 5.242 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccncc1 796770055 BJEFVAANTXDHRF-KBXCAEBGSA-N 330.859 5.020 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2coc3ccccc23)c(C(F)(F)F)c1 811692414 FLABFSVYINSIEZ-BQYQJAHWSA-N 341.288 5.219 30 20 EKED O=[N+]([O-])c1ccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)cc1 818196040 HNOQAWYJJNLTJY-UHFFFAOYSA-N 344.585 5.001 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1O 841755540 IUHYZOLVYNMQMZ-KDOFPFPSSA-N 328.843 5.131 30 20 EKED CC(C)Oc1ccc(N=Cc2cc3ccccc3nc2O)cc1Cl 914701343 GSARJNASJRXTMU-UHFFFAOYSA-N 340.810 5.132 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccccc3)s2)cc1 1776113922 BYRVZODERJDTLC-ZRDIBKRKSA-N 334.396 5.009 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](C)CCCCC(=O)O)c1 1776787940 IKUXRQQYXPRIJL-SFHVURJKSA-N 349.515 5.159 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)c1ccccc1 108240365 NUZZHSMFPLEXMC-JKSUJKDBSA-N 338.476 5.071 30 20 EKED CCCc1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 110402754 ZBHSXEMMGZPQLT-SDNWHVSQSA-N 333.431 5.218 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1c(Cl)ccc(Cl)c1Cl 179283729 WXSMZPWJIKDVEZ-UHFFFAOYSA-N 339.609 5.079 30 20 EKED Cc1c([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)oc2ccccc12 180539923 VFUXCPMOTHCMCB-HOTGVXAUSA-N 334.419 5.055 30 20 EKED Cc1ccc(C(F)(F)F)cc1N[C@@H](C)c1ccc(OCC#N)cc1 325709620 RAWVQODBVHYCMK-ZDUSSCGKSA-N 334.341 5.089 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(F)cc1Cl 471125049 NJWUZBAZXKKTMX-UHFFFAOYSA-N 332.806 5.089 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(SC2CCCC2)cc1 480791492 RJHARAGFIMNAGM-INIZCTEOSA-N 336.504 5.444 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(C#N)c(C)c3)cc2)cs1 488172026 USRFKPCSBBJMPG-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1F 505057517 JPSFZSUHBPJPRP-OAHLLOKOSA-N 326.415 5.169 30 20 EKED Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1ccc(C#N)cc1F 512289326 SCFSWRIXECPXSB-HNNXBMFYSA-N 340.442 5.494 30 20 EKED C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1F 512619967 NUPSOSCTYLFWGP-VXGBXAGGSA-N 336.332 5.128 30 20 EKED CC(C)(C)c1csc(-c2cccc(Oc3ccc(C#N)cn3)c2)n1 524840004 KGMJCNNBBDGBRP-UHFFFAOYSA-N 335.432 5.167 30 20 EKED COc1cccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542948108 RUIOJIRRYRKPPU-QGZVFWFLSA-N 342.442 5.085 30 20 EKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 550831238 UQEASSWSSHFIKR-KXBFYZLASA-N 342.870 5.434 30 20 EKED N#Cc1ccc(CN[C@H](c2cccc(Cl)c2)C2CCCCC2)nc1 558238188 NZLFZYAQFSLNTI-FQEVSTJZSA-N 339.870 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(Cl)cc1 649956052 BDKSPIZPVCOOFB-OAHLLOKOSA-N 341.882 5.934 30 20 EKED CC(=NNc1ccccn1)c1sc(-c2ccc(Cl)cc2)nc1C 727648480 GSRSNZPWZQHNRN-UHFFFAOYSA-N 342.855 5.003 30 20 EKED Cc1cccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c1C 740011778 SRIJEDRKZZNVKV-UHFFFAOYSA-N 332.472 5.193 30 20 EKED C[C@@H]1CC/C(=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 753578128 CCJGGZOCEZQYBP-AFSDZQSXSA-N 330.431 5.027 30 20 EKED C#CC[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 756996082 NTLPALDORGOQOT-QGZVFWFLSA-N 337.772 5.213 30 20 EKED O=[N+]([O-])c1ccc(NN=CC2CCC(C(F)(F)F)CC2)c(Cl)c1 767376739 DPTNUNMLNRJKMP-UHFFFAOYSA-N 349.740 5.015 30 20 EKED N#CCOc1cccc(NCc2ccc(Oc3cccc(F)c3)cc2)c1 775058510 VCYBHXQZKSQWAX-UHFFFAOYSA-N 348.377 5.132 30 20 EKED C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)c(F)c1 777640783 NWCXEPHSDAHVPZ-CYBMUJFWSA-N 347.393 5.403 30 20 EKED Cn1cc(C=NNc2cccc3ccccc23)c(C2CCCCC2)n1 783836023 ULOXTFQDZUNOOZ-UHFFFAOYSA-N 332.451 5.067 30 20 EKED C=CCC1(c2nc(-c3cccnc3Oc3ccccc3)no2)CCCC1 904452452 CIZFHQNJTPIRLF-UHFFFAOYSA-N 347.418 5.312 30 20 EKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(-c2ccccc2)cc1F 914733160 NMICYCLJWAESFV-ACCUITESSA-N 342.373 5.016 30 20 EKED N#C[C@@H](C(=O)CCC1CCCCC1)c1nc(-c2ccccc2)cs1 917026451 ZGWYRAOKOZWGBP-KRWDZBQOSA-N 338.476 5.347 30 20 EKED C=CCN(C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)C(C)C 920046942 NIMFDCGLFSWELW-QGZVFWFLSA-N 348.899 5.097 30 20 EKED N#CCOc1cccc(NCc2c(Cl)ccc(Cl)c2Cl)c1 37300689 PDBQMWZIUSNFBE-UHFFFAOYSA-N 341.625 5.161 30 20 EKED COc1cccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)c1 60241330 WBYMLUXMNPQEKW-FOWTUZBSSA-N 347.439 5.031 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(S[C@@H](C)c2cccc(C#N)c2)o1 189844541 KYDWVMIXOOYGAZ-KSSFIOAISA-N 349.459 5.336 30 20 EKED C[C@@H](SCc1nc(C(F)(F)F)cs1)c1cccc(C#N)c1 190817232 JUMIVSJYMARJSJ-SECBINFHSA-N 328.384 5.028 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc2c(c1)CCCC2 237334552 VSIUVMWKGCJYME-GOSISDBHSA-N 348.490 5.099 30 20 EKED COc1ccc2c(c1)CC/C(=C\c1cnc(-c3ccccc3)s1)C2=O 303130934 IHFXJNHUDZNNND-FOWTUZBSSA-N 347.439 5.031 30 20 EKED N#CCCC[C@@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 340444329 DAKISKHSKPKGKI-NHCUHLMSSA-N 346.474 5.458 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426137405 NYSTZCSPSAZYME-SFHVURJKSA-N 341.842 5.073 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1c(CC)cc(C)cc1CC 435196569 NIAGKPSFZAZQIY-UHFFFAOYSA-N 342.508 5.401 30 20 EKED C[C@H](c1ccccc1Br)N(C)CCCCC(C)(C)C#N 444591976 DPMHZCYSLQBAQC-CQSZACIVSA-N 337.305 5.162 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(s1)CCCC2 476121680 HEAZQIMOXVXLSY-UHFFFAOYSA-N 339.504 5.731 30 20 EKED C=CCC[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 494809905 PYKLCHJOZQGBHS-QGZVFWFLSA-N 330.815 5.045 30 20 EKED CC(C)(C#N)CC(=O)Nc1cccc(CSC2CCCCC2)c1 498344961 LFDWZQPOGYHJNC-UHFFFAOYSA-N 330.497 5.131 30 20 EKED C=CCN(Cc1ccccc1)C(=O)C(c1ccccc1)c1ccccc1 503079710 CCKJZIMVDCXYIP-UHFFFAOYSA-N 341.454 5.033 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)[C@@H](C)Cc1ccsc1 505045321 ICIVRDPFCSOUGE-INIZCTEOSA-N 342.508 5.352 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 507717377 WZRVPURKSDOPCK-UHFFFAOYSA-N 348.368 5.091 30 20 EKED C=C[C@H](CC(=O)N(Cc1ccccc1)Cc1ccco1)c1ccccc1 534605445 NUXMZVWTRHILGJ-HXUWFJFHSA-N 345.442 5.168 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 535404702 CFMIJPHANWPGCI-OAHLLOKOSA-N 333.353 5.090 30 20 EKED CC(C)[C@@H](NCc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 543185925 AASVGISMUVJEQC-LJQANCHMSA-N 346.396 5.258 30 20 EKED CC(C)(CCC#N)CNC(=O)c1csc(-c2ccc(Cl)cc2)c1 552466630 HLYKWDIYYZFHBD-UHFFFAOYSA-N 346.883 5.128 30 20 EKED N#Cc1ccc(CN[C@H](c2cccnc2)C2CCCCC2)cc1Cl 593711996 KRWMYHRLQFOBPK-FQEVSTJZSA-N 339.870 5.018 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N3CCC(C#N)CC3)sc2c1 732656214 VWJUPEWVTMFBTE-UHFFFAOYSA-N 346.883 5.054 30 20 EKED CC(C)(CCC#N)CNc1cccc(CC[C@H](O)c2ccccc2)c1 770559759 OCYWPLGODCPRCF-NRFANRHFSA-N 336.479 5.095 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1ccccc1 773118054 YJWJXZYXGJXWNI-KXBFYZLASA-N 347.380 5.043 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(SC(F)F)cc1 777599430 JOVJUNWXOVTPQL-QGZVFWFLSA-N 330.403 5.362 30 20 EKED C[C@H](N[C@@H](C)c1ccccc1O)c1ccc(-c2cccc(C#N)c2)cc1 783531999 GYQVNVIAEDWNBN-IRXDYDNUSA-N 342.442 5.343 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1C 792092496 CAGNIMHUPVBVQP-MHNQQFQPSA-N 340.426 5.050 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)CCCCC#N 846849862 IRSWBJLBHHVDEH-UHFFFAOYSA-N 326.827 5.338 30 20 EKED Fc1ccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)cc1 853258853 GOJJVCKPBZMFPQ-UHFFFAOYSA-N 330.247 5.279 30 20 EKED Cc1ccccc1NC(=S)Nc1cccc(C#Cc2ccccc2)c1 909547723 JHLDGMFGSJANNU-UHFFFAOYSA-N 342.467 5.204 30 20 EKED CCCCCCCC(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 917378078 LEFCLUPXLOHNCY-UHFFFAOYSA-N 341.499 5.354 30 20 EKED O=C(O)c1cccc(NN=C2CC=C(c3ccc(Cl)cc3)CC2)c1 1776037269 RBSSYPBIJPHZLX-UHFFFAOYSA-N 340.810 5.074 30 20 EKED CC(C)(C#N)CCCN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 174831918 UDETWMUCHDMVOY-UHFFFAOYSA-N 349.453 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccccc1 191437279 FNDBEXUAEANGGB-UHFFFAOYSA-N 336.479 5.593 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)c(F)c(F)c1 340450330 MMSVDIXPYCFBIN-FZKQIMNGSA-N 332.369 5.190 30 20 EKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2o1 352198377 LFBHZDKHQQORJV-VQIMIIECSA-N 346.430 5.088 30 20 EKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c2ccccc12 420279610 PJABUBYZKGAMCM-QGZVFWFLSA-N 334.444 5.218 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c(C)c1 460080185 VJQVMQCDUALDMD-QRWLVFNGSA-N 342.508 5.298 30 20 EKED CC(C)(C)[C@@H]1CN(C(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc21 470303475 NNVRKUMLEIFTJW-LJQANCHMSA-N 344.458 5.032 30 20 EKED CCOc1cccc([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481927506 YDCFBTUKLHJXNT-KSFYIVLOSA-N 334.463 5.075 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccnc(Cl)c1 492048035 QZRYQOYEABPZFR-KTKRTIGZSA-N 340.854 5.239 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(F)c1Cl 552460715 PKMREHSMPAJEQX-LBPRGKRZSA-N 334.847 5.485 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1Cl 552956746 OJSNTHDVCSIGPP-BLVKFPJESA-N 328.818 5.079 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 554076524 FRTPKXJPOROMGD-DOTOQJQBSA-N 338.417 5.261 30 20 EKED C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554391604 ULBUVNARSGMAKI-NVXWUHKLSA-N 341.499 5.166 30 20 EKED CC[C@H](C)Oc1cccc(NCc2cccc(OCCCC#N)c2)c1 559312312 GHOYWJTXTHNZHH-KRWDZBQOSA-N 338.451 5.159 30 20 EKED CCCC[C@H](CC)COCc1cccc(NC(=O)C2(C#N)CCC2)c1 609856556 ITSIXNKEONGQBJ-KRWDZBQOSA-N 342.483 5.052 30 20 EKED CCCCCN(CCCCC)C(=O)N[C@@H](C)c1cccc(C#N)c1 610408148 KTTYSXOEKRYFCJ-KRWDZBQOSA-N 329.488 5.011 30 20 EKED Cc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1Cl 611093078 AZLCEKHGNQHONW-UHFFFAOYSA-N 339.609 5.079 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1OCCCC 615573650 HPTKNQTYPFYXAH-UHFFFAOYSA-N 338.451 5.086 30 20 EKED Cc1cc(OCc2ccccc2)ccc1NCc1ccc(C#N)cc1 691090885 QYVKILLGQCRBDK-UHFFFAOYSA-N 328.415 5.058 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727973155 SQFDBEPPWIFDOY-ZHACJKMWSA-N 325.820 5.360 30 20 EKED C#CC[C@H](OC(=O)CC1CCC(c2ccccc2)CC1)c1ccccn1 733691938 LPRXQSFWSKDUKP-ZNIKRAEXSA-N 347.458 5.053 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\C(C)(C)C 733924488 QMDBDWICLAIQOL-QXMHVHEDSA-N 334.419 5.200 30 20 EKED N#CCOc1ccc(Cl)cc1COc1c(Cl)cccc1Cl 735231660 YHHXVLTUBIUJCB-UHFFFAOYSA-N 342.609 5.128 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)s1 745990305 QMDQOTKBUZZKHH-CMDGGOBGSA-N 348.471 5.399 30 20 EKED CC1=C(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 747205350 SYXMVYCKXDHXOG-OAHLLOKOSA-N 342.851 5.140 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(OC)c2ccccc12)c1ccncc1 766022560 XDJPHWHFJGPXFC-HRAATJIYSA-N 332.447 5.211 30 20 EKED C=CCC[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 778597982 HHULOCSKPXNHOD-SJORKVTESA-N 346.455 5.223 30 20 EKED C=CC[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccncc1 782443957 DVSSCXILMHBRTR-OAQYLSRUSA-N 343.430 5.247 30 20 EKED O=C(/C=C\c1cscc1Br)c1c(F)cccc1Cl 809158649 BOKNUUUHEMVWEP-PLNGDYQASA-N 345.620 5.199 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)OC(=O)CCCC#N 812997812 GTCASRIFMWJNNO-LBPRGKRZSA-N 348.855 5.070 30 20 EKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccccc1C(F)(F)F 850073255 GAMPKDRJYIKSOD-CQSZACIVSA-N 344.380 5.111 30 20 EKED CCCCCC[C@@H](CC)CN(C)C(=S)Nc1ccccc1C#N 853045198 COVLIHGEYJVCAU-MRXNPFEDSA-N 331.529 5.183 30 20 EKED CCCCCCCCCC(=O)N1CCCCC[C@@H]1c1ccncc1 915870905 SCQPSBIJRWOROI-HXUWFJFHSA-N 330.516 5.666 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1 29150542 SWVGLDVJNHTTDN-UHFFFAOYSA-N 333.218 5.047 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C)c3C)n2)cc1 57526917 RIILRAMNMKOHGD-GOSISDBHSA-N 346.455 5.225 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)NCc2nc(C3CC3)cs2)cc1 90458598 CZLDAUNGWNUKQF-CYBMUJFWSA-N 348.899 5.003 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(F)F)c1 170974567 QDEQNCGUBVROHT-LBPRGKRZSA-N 346.402 5.128 30 20 EKED COc1ccccc1[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 181942834 CWYQARTYCUJUNK-GAJHUEQPSA-N 342.442 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCO[C@@H](CC)C1 276464564 OTCDUHXPBXJTDZ-WMZOPIPTSA-N 329.484 5.072 30 20 EKED CCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 302979498 CRZUYWWQQMQHFP-SWLSCSKDSA-N 346.883 5.466 30 20 EKED CCCCCCCCC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303640705 BCNJEQMWYVSAMO-UHFFFAOYSA-N 347.343 5.080 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 328984025 FYAJGHRRWUKLLC-NUEKZKHPSA-N 332.419 5.628 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1ccccc1 352191680 HNPZDQFESHKQAX-QGZVFWFLSA-N 347.245 5.158 30 20 EKED C[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)c(F)c1 426305823 DRYCDNFCBDYANR-ZUZCIYMTSA-N 334.847 5.140 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cccc2ccccc12)c1ccccc1 431716284 SCEDNAYBOPQPBL-FQEVSTJZSA-N 343.430 5.396 30 20 EKED C=CCC[C@H](NC(=O)N1CCc2sccc2[C@@H]1C)c1ccccc1 435106033 ZFUKEPZHUHURMT-YJBOKZPZSA-N 340.492 5.084 30 20 EKED CC(=O)c1ccc(Cl)c(Cl)c1OCCCCC(C)(C)C#N 436204916 NUDLDYOFKJPZCP-UHFFFAOYSA-N 328.239 5.295 30 20 EKED CC[C@@H](NCc1ccccc1OC1CCCC1)c1ccc(C#N)cc1 447542664 PKJSDOPLFGYQIF-OAQYLSRUSA-N 334.463 5.121 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@@H](C)c1cccc(C#N)c1 447557043 KLDUWQMGYJOZRQ-KBXCAEBGSA-N 332.369 5.211 30 20 EKED C=CC[C@H](C(=O)Nc1cc(-c2ccco2)nn1C(C)C)c1ccccc1 447860798 JSLRJIXJDLZBRI-KRWDZBQOSA-N 349.434 5.022 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1ccc(F)cc1C#N 488514038 MGMMFBCZNVTTHR-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1 532206866 KZOFWNMQIYMRTK-KBPBESRZSA-N 328.843 5.022 30 20 EKED CC[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 596737028 YKBOHAYUDFQMJV-BZUAXINKSA-N 345.512 5.123 30 20 EKED COc1cc(CS[C@@H](C)c2ccc(C#N)cc2)ccc1SC 609825513 CCVDXRLLBCGSBC-ZDUSSCGKSA-N 329.490 5.283 30 20 EKED Cc1cccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)c1 731322332 XGSPIRTWRIARCL-CQSZACIVSA-N 341.505 5.198 30 20 EKED C[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 734643264 AIHZMNYDHMCKCW-OXQOHEQNSA-N 349.478 5.146 30 20 EKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 736348164 OAUQUNMKECECOJ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED CCCCC[C@@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 742654351 UYIQLCXWORMCEV-CVEARBPZSA-N 332.513 5.626 30 20 EKED Cc1cccc2c1[C@H](C)/C(=C\c1cccc(OCCCC#N)c1)C2=O 766694282 BVEDOMMPSTVACD-ZGPWBKFBSA-N 331.415 5.061 30 20 EKED C=CCN(CCc1ccco1)C(=S)Nc1ccc(CCCC)cc1 778532736 ARQFAGQRKAYBDV-UHFFFAOYSA-N 342.508 5.050 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(SC(C)(C)C)cc1C 785770007 VHQPDLKGCYIISB-HNNXBMFYSA-N 332.513 5.458 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1c(F)cccc1Cl 809159728 VNEGXOVNISVJJX-KTKRTIGZSA-N 343.810 5.499 30 20 EKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cc1 818259848 NCVXDTNICDNXSM-MLPAPPSSSA-N 347.439 5.270 30 20 EKED CCCC(=O)Nc1cccc(N=Cc2c(O)ccc3ccccc23)c1C 920387796 ULOYYPUWUUUGHL-UHFFFAOYSA-N 346.430 5.343 30 20 EKED Cc1c(C=NNc2ccc(C(=O)O)cc2)sc2c(Cl)cccc12 1776013042 DVKNMZCPTBSUHD-UHFFFAOYSA-N 344.823 5.007 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 160596732 HRHDLASSNHQNIU-NHCUHLMSSA-N 349.478 5.070 30 20 EKED C[C@H](Nc1ccc(Br)c(Cl)c1)c1cccc(C#N)c1 232191166 UEFUOMDWWJVEGJ-JTQLQIEISA-N 335.632 5.147 30 20 EKED CCC[C@H](NCc1cc(C#N)cs1)c1cccc(C(F)(F)F)c1 237029454 YOWZBKSVOYPYMN-INIZCTEOSA-N 338.398 5.270 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(C(CC)CC)n1 276418485 GVMPXYJTCDTWHE-UHFFFAOYSA-N 339.483 5.348 30 20 EKED CCCCCCCC(=O)N[C@H](C)c1nc2ccccc2n1C(C)C 303755459 JGKIOKKAXPGSFZ-MRXNPFEDSA-N 329.488 5.155 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/[C@H](CC2CCCC2)c2ccccc2)CC(O)=N1 329749304 HIHVQUFCWBIPTF-IPMKNSEASA-N 342.483 5.410 30 20 EKED Cc1c(-c2nc([C@@H]3CCC(F)(F)C3)no2)sc2ccc(C#N)cc12 426602701 ITNUGJVGERUKQJ-LLVKDONJSA-N 345.374 5.034 30 20 EKED CCCc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)sc1C 430602463 LDZDZGVISYYDIX-ZDUSSCGKSA-N 346.521 5.253 30 20 EKED Cc1nc(-c2cc([C@@H](C)NCC3CCC(C#N)CC3)cs2)cs1 442856886 OXQUAQLWLONHLJ-LRVUVFPRSA-N 345.537 5.161 30 20 EKED C=C[C@](C)(CC)C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 467985285 SFVGWDZOPGQUHF-GOSISDBHSA-N 339.401 5.014 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474888149 NTDTXMMUZOYASX-QMCVQRASSA-N 344.911 5.528 30 20 EKED C=C[C@H](CC(=O)Nc1c(F)cccc1SCC)c1ccccc1 484931431 CURAFTONVXDWLX-CQSZACIVSA-N 329.440 5.236 30 20 EKED C[C@H](NC(=O)Nc1ccccc1-c1cccs1)c1ccc(C#N)cc1 505319399 RBXNERBKZFOFGZ-AWEZNQCLSA-N 347.443 5.169 30 20 EKED C[C@@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1F 512647881 KGKPZTVWLDMPCQ-LLVKDONJSA-N 349.236 5.344 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 531309545 JEWILNMZIAMZGC-CYBMUJFWSA-N 346.352 5.018 30 20 EKED C=CCN(C(=O)Nc1ccc(Sc2ccccc2)cc1C)C1CC1 539029320 DHNVXTPODSIDDF-UHFFFAOYSA-N 338.476 5.329 30 20 EKED CC[C@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1 564039497 IAFDPVLOAYBHEA-BBRMVZONSA-N 327.497 5.114 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(CO[C@@H]2CCC[C@H](C)C2)c1 591504540 MXDYGPARSSUPSL-FXAWDEMLSA-N 344.499 5.212 30 20 EKED CC(C)(C#N)c1ccc(CNc2cccc(COCC3CC3)c2)cc1 594496107 HEJKODHPXIRQNQ-UHFFFAOYSA-N 334.463 5.026 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(F)cc1C(F)(F)F 599042263 AKEGQVLMIORUTL-ADLMAVQZSA-N 348.343 5.054 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(Cl)c2ncccc12 606938569 JTSBECMYJCJQBP-UHFFFAOYSA-N 331.847 5.098 30 20 EKED N#Cc1ccccc1-c1ccc(CN[C@H](c2cccs2)C2CC2)cc1 611367405 FDNFZBLVRUVGKP-QFIPXVFZSA-N 344.483 5.528 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)F)cc1F 653760323 RIDVQJHOJADKKX-UHFFFAOYSA-N 347.380 5.868 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C/C(=O)c2ccsc2)c1 731319383 PGIJLMUDFWGVKI-CMDGGOBGSA-N 345.423 5.095 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2cnn(C(C)C)c2)o1 734303937 BJZAQVJJNFSXBX-CLFYSBASSA-N 338.382 5.068 30 20 EKED C[C@@H](SCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C#N)cc1 735675307 DOWHZCSIJFVQMB-LLVKDONJSA-N 332.812 5.114 30 20 EKED Cc1cc(CON=Cc2ccccc2C(F)(F)F)c2ccccc2n1 742351971 JSEIDUKAUZUFKC-UHFFFAOYSA-N 344.336 5.113 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccc(C)cc1 747197635 KZFUOFVPFAPDJP-DOTOQJQBSA-N 340.492 5.335 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)c1 763292262 LBQOSWAXWAPHPB-CLFYSBASSA-N 341.382 5.293 30 20 EKED O=C(/C=C/c1ccsc1Cl)c1sccc1Br 790215486 PMAQPTKCLSOZRQ-OWOJBTEDSA-N 333.659 5.122 30 20 EKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 794945300 LVHLRPZKQLAGFH-BAQGIRSFSA-N 337.709 5.082 30 20 EKED CCCCCCCCCCC(=O)N1CCCC[C@@H]1c1ccnn1C 798596432 HXWAHUCIBZFYTM-LJQANCHMSA-N 333.520 5.005 30 20 EKED Cc1cccnc1[C@@H]1CCCC(=NNc2ncc(Cl)cc2Cl)C1 799106590 CXVUWXNJLTYRCH-GFCCVEGCSA-N 349.265 5.218 30 20 EKED Cc1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1C#N 799299136 WSFSYPGURNMROO-UHFFFAOYSA-N 339.609 5.079 30 20 EKED Cc1cc(Cl)cc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1O 808709337 RUYNEDFAOKAJNQ-CQSZACIVSA-N 344.842 5.210 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@@H]3CC[C@H](C#N)C3)sc2c1 819631601 BOWONZOTVYPZQI-WCQYABFASA-N 346.883 5.100 30 20 EKED CC(C)Nc1cc(Br)ccc1NCCCC(C)(C)C#N 849320614 VWCKROWBYQKPRV-UHFFFAOYSA-N 338.293 5.011 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H](C)C1CC1 920439022 FZPXQMFJSPWEHK-AWEZNQCLSA-N 334.419 5.034 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776370263 XYMWAPHPZBOXLN-OQFOIZHKSA-N 334.371 5.151 30 20 EKED Cc1sc(NC(=O)c2sccc2-c2ccccc2)c(C#N)c1C 69620150 NCBVRALLFFZPCM-UHFFFAOYSA-N 338.457 5.217 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](C)c1ccccc1 108240361 NUZZHSMFPLEXMC-HOTGVXAUSA-N 338.476 5.071 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1cccc(Cl)c1Oc1cccnc1 185466271 KTKXLMTXAYCUEK-CYBMUJFWSA-N 330.815 5.068 30 20 EKED CC/N=C(/O)c1cccc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 328989507 HWZGKQMMQNDJRE-YTQUADARSA-N 342.483 5.074 30 20 EKED C=CCCc1ccccc1NC(=O)c1nc(C)oc1-c1ccccc1 410345046 NIQIJLGKUJDLHU-UHFFFAOYSA-N 332.403 5.021 30 20 EKED CC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCC1 426171273 UIOLWQFDJQLEPW-QGZVFWFLSA-N 338.838 5.124 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc3ccccc3c2)s1 430599915 GUDJTXWUXKMXFS-MRXNPFEDSA-N 334.444 5.084 30 20 EKED C=CCCN(C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 467289994 FPZHFFRSNNUGSD-NSHDSACASA-N 325.239 5.217 30 20 EKED C=CCC[C@@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1ccccc1 469680839 PGLTWCRFSYDEJF-OFLPRAFFSA-N 339.401 5.179 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1CC(C)C 475564483 SYNPQQFWYNQJBK-SFHVURJKSA-N 328.500 5.581 30 20 EKED CSc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1Cl 476222577 BMIFFPPMZLSEDC-UHFFFAOYSA-N 344.867 5.115 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C)cc1C 479782706 ORFGMHJJCQYSGF-UHFFFAOYSA-N 334.872 5.238 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480673656 SBUMZDOJLIKNIM-BFUOFWGJSA-N 346.377 5.149 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(C)c(-c2ncco2)c1)c1ccccc1 489693333 XYULIGLKVIPLPD-LJQANCHMSA-N 346.430 5.339 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 495293294 FXBQIFKAESZFLF-UHFFFAOYSA-N 348.487 5.037 30 20 EKED CC(C)c1ccccc1NC(=O)CSc1cccc(Cl)c1C#N 543959793 WGUKVDVJJNHTIV-UHFFFAOYSA-N 344.867 5.066 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(F)cc1Cl 546048401 XNFMJHUUCRBDNN-LBPRGKRZSA-N 334.847 5.485 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 550829415 FXEAIYWWCLMYJV-IFXJQAMLSA-N 330.834 5.565 30 20 EKED N#CCC[C@@H](N[C@@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593606414 FHLNWGHLRPQCOA-IAGOWNOFSA-N 328.818 5.101 30 20 EKED C[C@H](Nc1ccccc1CN(C)C1CCCCC1)c1cccc(C#N)c1 600848788 JNOKTBRAZNCRPU-SFHVURJKSA-N 347.506 5.496 30 20 EKED CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 610142570 APKCOOFIOAQWAH-BZUAXINKSA-N 345.512 5.171 30 20 EKED C[C@@H](NCc1cccc(Oc2ccccc2)c1)c1cccc(C#N)c1 610344680 FBXAAOPJMVTYHP-QGZVFWFLSA-N 328.415 5.201 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1nc(-c2ccccc2)cs1 618807173 VEABSVSSIXQZIM-AUUYWEPGSA-N 345.471 5.020 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2ccc(CCC(F)(F)F)cc2)C1 666290824 SUVPYLJZKVZKPV-HNNXBMFYSA-N 340.389 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@]1(C)CC1(F)F 666866348 NHGRMCWTZHXTIT-GOSISDBHSA-N 336.426 5.095 30 20 EKED C[C@H](Nc1ccc(N(C)Cc2ccccc2)cc1)c1ccc(C#N)cc1 743471727 CULMDLCVYUXBEA-SFHVURJKSA-N 341.458 5.368 30 20 EKED N#Cc1csc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 748441336 XTYMNRJJABVEHG-NSIKDUERSA-N 347.226 5.665 30 20 EKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1cccc2ccccc12 753136078 VAUMYDOKKAFDMX-QXMHVHEDSA-N 342.423 5.254 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc(Br)ccc1F)c1ccccc1 773117143 UDZHJTLDETVWSY-SCLBCKFNSA-N 346.243 5.003 30 20 EKED N#CC[C@H](CC(=O)Nc1ccccc1SC(F)F)c1ccccc1 792878621 VKNTVLHLBMLCOY-CQSZACIVSA-N 346.402 5.027 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1cnn(C2CCCC2)c1 799896252 DZMAEJGFXGAICV-ZHACJKMWSA-N 349.459 5.018 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2csc(Cl)c2)c(C(F)(F)F)c1 811690620 FPPFISWGGXXYEB-ONEGZZNKSA-N 341.741 5.188 30 20 EKED C[C@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC=CCC1 822495249 CLOQNUDHXYUHFY-UNMCSNQZSA-N 330.431 5.027 30 20 EKED Cc1cc(C)c(C(=O)O)cc1C=NN(c1ccccc1)c1ccccc1 1776032431 JWADVBCYLSBQCL-UHFFFAOYSA-N 344.414 5.174 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cccc(F)c3)cc2)cc1 1776129835 YLSAXTNGHHBQDG-AWNIVKPZSA-N 346.357 5.087 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)s1 1776339616 DWJFFABNOZEYOS-VURMDHGXSA-N 348.851 5.194 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCSc3ccc(F)cc32)c1 179822725 XEXNYVOMUNQKCE-GOSISDBHSA-N 342.439 5.157 30 20 EKED C=C(C)[C@H](N[C@H](C)c1nc2ccccc2o1)c1ccc(F)c(F)c1 187774060 QJCUWXKRLJSIPV-XIKOKIGWSA-N 328.362 5.074 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(C#N)c1 191454771 XTPJLZSHNOORII-UHFFFAOYSA-N 347.462 5.074 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(OCC#N)cc1 192923045 KEPQKBKKYPKNRI-STQMWFEESA-N 349.261 5.308 30 20 EKED CCOCc1cc(/C=C\C(=O)c2ccc3ccccc3c2)ccc1OC 210445039 ZDUMBDTWDQZXJD-WQLSENKSSA-N 346.426 5.281 30 20 EKED CC(C)(C#N)CCCCN[C@H](c1cccc(Cl)c1)c1ccccn1 277870589 YOCUPZYUAKYTPE-LJQANCHMSA-N 341.886 5.134 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 447509273 FFAVXWWDEUNVJJ-SCLBCKFNSA-N 332.369 5.379 30 20 EKED COc1ccc(Cl)cc1CNc1ccccc1S[C@@H](C)CC#N 466387431 JVNHVNMPOGWKDO-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(-c2ccccn2)cc1)c1ccccc1 485157347 FJLOLAHJSJLKFM-FQEVSTJZSA-N 328.415 5.047 30 20 EKED C[C@@H](NC(=O)CC(C)(C)C#N)c1ccccc1-c1ccc(Cl)cc1 498579996 JEJBMGXGOHDGIS-CQSZACIVSA-N 340.854 5.124 30 20 EKED C[C@@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccc(C#N)cc1 507250808 DDVDRJQGRSQRKY-SNVBAGLBSA-N 329.375 5.279 30 20 EKED C[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)cc1F 512297207 VYMTYHZKIFFTJZ-NSHDSACASA-N 349.236 5.344 30 20 EKED Cc1ccc(Sc2ccc(NC(=O)C3(C#N)CCC3)cc2)cc1C 516511496 VSDVRIKECXIPBR-UHFFFAOYSA-N 336.460 5.087 30 20 EKED C=CCC[C@@H](NCc1scnc1C)c1ccc(C(F)(F)F)cc1 532725990 WUKASEFAQGPQTM-OAHLLOKOSA-N 340.414 5.267 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccccc1 535422552 YOOMBNZJKCFZBV-KRWDZBQOSA-N 346.430 5.257 30 20 EKED N#Cc1ccccc1CN[C@H](CCc1ccccc1)c1ccccc1 540381697 VIFUIBIRVSHVNG-HSZRJFAPSA-N 326.443 5.022 30 20 EKED CC(C)(C#N)CC[S@@](=O)[C@@H](c1ccccc1)c1ccc(Cl)cc1 555509377 QYQDOEHALDXHGX-FDDCHVKYSA-N 345.895 5.118 30 20 EKED N#CCCCCCC(=O)N[C@H](CC1CCCCC1)c1ccccc1 588339641 JNMZLHCWSOCWCA-HXUWFJFHSA-N 326.484 5.288 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 606944993 YWZVBNRUDABFHZ-UHFFFAOYSA-N 343.496 5.329 30 20 EKED C=CC[C@H](NCc1ccc(N(C)c2ccccc2)cc1)c1ccncc1 734508710 CLYNVWTZFQPEQU-QHCPKHFHSA-N 343.474 5.257 30 20 EKED Cc1c(C(=O)/C=C\c2cnc(C(C)(C)C)s2)oc2ccccc12 736433243 PVOTUJBLJDWJTJ-KTKRTIGZSA-N 325.433 5.391 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cc(Cl)cc(Cl)c1 746346494 QBOWQDLVHOSWHS-WAYWQWQTSA-N 337.250 5.284 30 20 EKED CCCc1ccc([C@H](C)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772983580 LANVKWMILDQQFS-UWJYYQICSA-N 336.479 5.171 30 20 EKED O=C(/C=C\c1ccc(F)nc1)c1ccc(SC2CCCC2)cc1 777468794 WNHLBPPQYLUCNJ-WZUFQYTHSA-N 327.424 5.152 30 20 EKED Cc1ccc(CCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 797572568 CKXMXBAKQYZRJG-CQSZACIVSA-N 346.521 5.010 30 20 EKED C[C@H](N[C@@H]1CC(C)(C)CCc2ccccc21)c1ccc(OCC#N)cc1 799727123 WVFLFIYBCDUHTM-HTAPYJJXSA-N 348.490 5.343 30 20 EKED CCCCOc1ccc(/C=C/C(=O)c2ccc(F)cc2F)cc1OC 916128004 CMYADYZGJYKVFX-WEVVVXLNSA-N 346.373 5.048 30 20 EKED CCCOc1ccc(/C=C\C(=O)c2ccc(Cl)s2)cc1OC 916135838 WMAYYGGKQGVLLN-XQRVVYSFSA-N 336.840 5.095 30 20 EKED CC(C)c1ccc(NC(=O)NCc2ccc(C#N)cc2)c(C(C)C)c1 916410227 WSIVNRSPXJZOHG-UHFFFAOYSA-N 335.451 5.127 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC[C@H](C)CCc1ccccc1 1776782392 PWGLCUANAOXCTF-UYAOXDASSA-N 333.516 5.049 30 20 EKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2ccc(C(=O)O)s2)c1 1777461813 WVKYCFJZTLUQGS-MDZDMXLPSA-N 348.423 5.318 30 20 EKED C[C@H](Nc1ccc(CC#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 154523816 VDBMJGWZEMXGGH-ZDUSSCGKSA-N 337.810 5.234 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)Sc3ccccc3C#N)o2)cc1C 177354506 BRLOWHJPBTXJGI-CQSZACIVSA-N 335.432 5.078 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(Cl)s1 212104191 MIZYJZZFTZSMDZ-WAYWQWQTSA-N 349.839 5.560 30 20 EKED C[C@@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)C1CCCC1 425457488 KUBZRXBEEBKDGF-IBGZPJMESA-N 340.511 5.093 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 445988389 NQSMRACMXBXXBA-IAGOWNOFSA-N 338.417 5.261 30 20 EKED CCCN(C(=O)CC(C)(C)C#N)[C@@H](C)c1ccc(Cl)c(Cl)c1 447347112 IZEWOPMLVMEWPI-LBPRGKRZSA-N 341.282 5.233 30 20 EKED CC(C)C[C@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458794599 BHWBPPPLFAJFHM-WOJBJXKFSA-N 341.499 5.032 30 20 EKED COc1ccccc1-c1ccc([C@H](C)Nc2ccc(C#N)cc2)cc1 462887975 MTOZGIGXXIMYIC-INIZCTEOSA-N 328.415 5.407 30 20 EKED C=CC[C@H](CC)NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 466538882 JOFRFIJCZVHDEI-KRWDZBQOSA-N 346.430 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C)cc1 475562991 AVGNJGPAEWYIQV-UHFFFAOYSA-N 336.479 5.511 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2CCC[C@@H](C2)C1 482188413 QKZOZCPKROCAKP-IRXDYDNUSA-N 326.484 5.192 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(C#N)s1)C1CC1 486658898 QBEDZSSTDNWLSP-AWEZNQCLSA-N 346.455 5.139 30 20 EKED N#Cc1cc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)ccc1F 518011526 OWUMQMCWWYGQTK-SFHVURJKSA-N 349.236 5.245 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2ncc(C(C)C)n2C(C)C)cc1 523500305 OSIPJALLHZOMOU-KRWDZBQOSA-N 327.497 5.123 30 20 EKED CCCn1c(SCCC(C)(C)C#N)nnc1-c1ccc(Cl)cc1 525708018 BWXYKZSIBQDOGB-UHFFFAOYSA-N 348.903 5.040 30 20 EKED C[C@H](Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 530694933 UCABFSVRARYIFJ-INIZCTEOSA-N 347.462 5.250 30 20 EKED CC(C)CCc1ccccc1NC(=O)N(CCC#N)CCC(C)C 531422440 AVTKJHGAMHEUBB-UHFFFAOYSA-N 329.488 5.069 30 20 EKED CCCCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)CCC 538532335 VBYADCJCUDYYKZ-QGZVFWFLSA-N 326.484 5.063 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccc(CCC(F)(F)F)cc1 540548172 BGXXSPNGOMFESR-CYBMUJFWSA-N 328.378 5.048 30 20 EKED CN(Cc1nc(C#N)cs1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 573650725 GPEAFHZYRAUVNV-GOSISDBHSA-N 345.899 5.031 30 20 EKED CCSc1ccccc1-c1noc(C[C@H](CC#N)c2ccccc2)n1 599180394 MSSUMNQMVHTVDV-INIZCTEOSA-N 349.459 5.089 30 20 EKED N#CCOc1cccc(/C=C/c2nc3c(ccc4ccccc43)s2)c1 727744843 MWNLEVJQLQDDHK-DHZHZOJOSA-N 342.423 5.522 30 20 EKED CC[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 734079314 NYTSAGRFSMQPCB-HKUYNNGSSA-N 334.463 5.408 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)CC(C)C)n2)cc1 753396887 VXNYSEGDVUEOBW-MRXNPFEDSA-N 340.492 5.367 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@@H]1c1cc(C)no1 775147064 RQVZMKDWEYCMQY-FUHWJXTLSA-N 334.504 5.423 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@@H]2CC(C)(C)CCc3ccccc32)cc1 799345218 VTAMXOUVRGMYTN-VGOFRKELSA-N 348.490 5.171 30 20 EKED CCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 800387062 PWPVGLJLLXQWDV-GDBMZVCRSA-N 326.465 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(C2CC2)n1 822365684 ULHHFSJXGMEQHO-UHFFFAOYSA-N 340.492 5.054 30 20 EKED Cc1ccc(-c2ccccc2NCc2c(C#N)cccc2[N+](=O)[O-])s1 864033607 XZJZWHLNBTZGDM-UHFFFAOYSA-N 349.415 5.116 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)CSCC1CCC(C#N)CC1 902570102 NIWFKZLBJQOKDJ-UHFFFAOYSA-N 344.524 5.120 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccccc1Cl 920062965 KUBATWIVYMPCBS-WAYWQWQTSA-N 331.849 5.421 30 20 EKED O=C(O)c1cc(NN=C2CCC[C@H](c3ccccc3)CC2)ccc1F 1776063828 KTAKZNMDKOFYMR-HNNXBMFYSA-N 340.398 5.040 30 20 EKED C[C@H](/N=C(/O)C1CCCC1)/C(O)=N/C1(Cc2ccccc2)CCCC1 328825859 SNVUPHSZYCXNSS-INIZCTEOSA-N 342.483 5.034 30 20 EKED CC(C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H](C)c1ccsc1 421686274 AIDDMMGMARTFRX-HNNXBMFYSA-N 340.492 5.161 30 20 EKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1C(C)(C)C 425617112 BCDFPTBACPDNKI-OAHLLOKOSA-N 335.451 5.081 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NC2CCC(C)(C#N)CC2)cc1 449175407 QUSFCISDAJRPKI-WMAFBANVSA-N 348.490 5.485 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2)cc1F)c1cccc(C#N)c1 503593261 VYQJGDLNCFNUSR-MRXNPFEDSA-N 330.406 5.215 30 20 EKED CCc1ccc2occ(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2c1 505595096 ASSVDLMHPWFQDE-UHFFFAOYSA-N 332.403 5.049 30 20 EKED CCN(C(=O)CCc1ccc(C(C)C)cc1)[C@@H](C)c1ccc(C#N)cc1 509574035 HQNFMHLVWBQXLG-SFHVURJKSA-N 348.490 5.224 30 20 EKED CCN(C(=O)c1ccc(C(C)(C)C)cc1)[C@H](C)c1ccc(C#N)cc1 509581179 YYFZXBFODZANGB-MRXNPFEDSA-N 334.463 5.079 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccc(C#N)cc1 509656254 UWKLYURBPLKKEB-GJZGRUSLSA-N 338.476 5.191 30 20 EKED Cc1cccc([C@@H](NCC2CCC(C#N)CC2)c2cccc(F)c2)c1 510944080 LYTXOLSOZCOQSZ-RWWKDMOOSA-N 336.454 5.143 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1)c1ccccc1 536157200 GXXKVEOLGZSOTB-SIKLNZKXSA-N 333.475 5.327 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 559865964 XEPKPTXFJIRDLX-AUUYWEPGSA-N 347.289 6.079 30 20 EKED COc1ccc([C@H](C)[C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 563671533 YWNOZGHCXQWQJZ-KGVIQGDOSA-N 336.479 5.212 30 20 EKED N#CCCC1CCN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC1 573203340 BFZJYVQELUBRPC-UHFFFAOYSA-N 347.418 5.134 30 20 EKED C=CCC[C@H](NCc1ccc(C(=O)OC(C)(C)C)cc1)c1ccco1 578732624 YPDSIVDXUVVUNU-SFHVURJKSA-N 341.451 5.032 30 20 EKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1ccc2ccccc2n1 613290808 MLPXIWXWAQBULF-OAHLLOKOSA-N 346.386 5.079 30 20 EKED CC(C)C[C@@H](C)N(C(=O)c1ccc(C#N)cc1)c1ccc2[nH]ccc2c1 750825420 GBYHCFPWFQEHHB-MRXNPFEDSA-N 345.446 5.121 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 776075560 XYTFJOMGUAIEAR-PXNSSMCTSA-N 342.442 5.070 30 20 EKED N#CCCCCC(=O)O[C@H](c1ccccc1)c1ccc(Cl)cc1 847635002 UTFIVNBTTPQYKR-LJQANCHMSA-N 327.811 5.057 30 20 EKED CCCC[C@H](CC)CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 78573338 PBVWNJIQLSTJMX-HOTGVXAUSA-N 347.528 5.276 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](C)c1cccc(C#N)c1 153724485 CBGZXKLROXHIIX-HUUCEWRRSA-N 347.487 5.402 30 20 EKED Cc1nc(-c2cccc(NCc3ccc(O[C@H](C)C#N)cc3)c2)cs1 155738657 QXTIITYEBARCJV-CQSZACIVSA-N 349.459 5.022 30 20 EKED Cc1cc(C(C)(C)C)cc(C)c1C[S@](=O)CCCC(C)(C)C#N 177943522 YFDBPHFKWDZLKP-HSZRJFAPSA-N 333.541 5.180 30 20 EKED N#Cc1csc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)c1 189072044 GGYGELNHYBKWDO-UHFFFAOYSA-N 338.819 5.192 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416742375 YENDMWRAWZJVMC-IBGZPJMESA-N 347.462 5.055 30 20 EKED C[C@H]1CCCC[C@H]1N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482605774 OBFGLNNKUWRORM-HRAATJIYSA-N 348.446 5.001 30 20 EKED C=CCOc1ccccc1CN[C@H](C)c1sc(C(C)(C)C)nc1C 482895211 GFQKDUYZWFDRLA-CQSZACIVSA-N 344.524 5.165 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2ccc(SCC)cc2)cc1 504030340 IZAGZPQEJKSXDR-INIZCTEOSA-N 327.493 5.214 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 536841581 WMDFIBYJOXANPL-DNVCBOLYSA-N 342.870 5.434 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc(F)c(OC)c1)c1ccc(F)c(F)c1 547829945 YFOMACVMWQRKEC-BLVKFPJESA-N 335.369 5.081 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 554076526 FRTPKXJPOROMGD-NVXWUHKLSA-N 338.417 5.261 30 20 EKED C/C=C(/CC)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 588567299 STQXKWRKTBXTIB-JYOAFUTRSA-N 342.386 5.006 30 20 EKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CC1CCCCC1 604241148 HVNWKSDCKQNPOP-UHFFFAOYSA-N 332.447 5.062 30 20 EKED CC(C)(C#N)c1ccc(CNC2(c3ccc(F)cc3)CCCC2)cc1 614174345 XXQSYNZONAOABQ-UHFFFAOYSA-N 336.454 5.186 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1-c1ccccc1 642405166 BTFPLLLTKADRMM-UHFFFAOYSA-N 348.471 5.635 30 20 EKED CSc1ccc(C(=O)/C=C/c2cccc(OC(F)F)c2)cc1F 741847614 QUHLDBORBCBHMD-FNORWQNLSA-N 338.350 5.045 30 20 EKED Fc1ccc(/C=C\C=NOc2ccccc2C(F)(F)F)c(F)c1 758128884 LEWVTNKBCBRHKR-XQGJOHEMSA-N 327.252 5.062 30 20 EKED C#CCCCC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 760236943 PPOATWXAZLXNCD-HNNXBMFYSA-N 340.854 5.255 30 20 EKED O=C1/C(=C\c2nc(Cl)cs2)CCc2[nH]c3ccc(Cl)cc3c21 790609934 QPSLJJAGOPPFOW-YVMONPNESA-N 349.242 5.144 30 20 EKED CCN(CC(C)(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 812920383 WGHXFLMBIIQNBG-FQEVSTJZSA-N 349.478 5.242 30 20 EKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cc1 23611719 NCVXDTNICDNXSM-AWNIVKPZSA-N 347.439 5.270 30 20 EKED C=CCCC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 106701519 QVXBQRIZKSTQNJ-UHFFFAOYSA-N 326.396 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1cccc(F)c1 189893891 OTGABSPJIGSYBU-INIZCTEOSA-N 339.454 5.495 30 20 EKED COc1ccc2cc(CNc3cccc(OCCCC#N)c3)ccc2c1 237288803 RPACXANQRCOPDV-UHFFFAOYSA-N 346.430 5.143 30 20 EKED C[C@@H]1Sc2ccc(/C(O)=N/[C@@H]3CC[C@@H]4CCC[C@H]4C3)cc2N=C1O 329536996 BIWKIVRFPKZGCN-PWNZVWSESA-N 344.480 5.042 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Cl)cc1Nc1ccc(F)cc1 426385744 QTEKPDKLVOZHPN-UHFFFAOYSA-N 345.805 5.101 30 20 EKED Cc1ccccc1[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)C(C)C 438846744 KRMYSFQTHOAFLG-NHCUHLMSSA-N 349.478 5.036 30 20 EKED C[C@H](C(=O)Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 462018020 VNGAUVQPVXBGFN-AWEZNQCLSA-N 332.428 5.029 30 20 EKED N#Cc1ccccc1CSCc1csc(-c2cccs2)n1 498119738 RFKRYIKDHIGNSW-UHFFFAOYSA-N 328.487 5.177 30 20 EKED C[C@@H](NC(=O)C1(C#N)CCCCC1)c1ccc(Oc2ccccc2)cc1 506272054 PVPLMXGECIXGPA-QGZVFWFLSA-N 348.446 5.130 30 20 EKED CC(=O)c1cc(NCc2ccc(-c3ccccc3C#N)cc2)ccc1F 506310991 UUHHLTKHOCZSKP-UHFFFAOYSA-N 344.389 5.179 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 514681991 CRUDNJNGIVDCHL-ZHRRBRCNSA-N 332.422 5.675 30 20 EKED CC(C)c1ccc(-c2nc(CN(C[C@@H](C)C#N)C3CC3)cs2)cc1 533139037 IFCHYYUYMJVLCN-HNNXBMFYSA-N 339.508 5.058 30 20 EKED N#CCCN(C(=O)c1ccc(C2CCCC2)cc1)c1ccc(F)cc1 577805603 CMCDMIJDFNWQJD-UHFFFAOYSA-N 336.410 5.044 30 20 EKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)CCCCCC#N)c2)C1 588154671 AYPAJJLVTRINDY-XLIONFOSSA-N 342.483 5.194 30 20 EKED N#C[C@H]1CCC[C@H](NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 618577739 CYFGQSBOMHJEFA-AAEUAGOBSA-N 342.792 5.020 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 619513905 AIVNDWWHUMFTMX-ZDUSSCGKSA-N 333.218 5.019 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cl)cc(Cl)c1 642392317 ORKBRVRYAWEWGJ-UHFFFAOYSA-N 341.263 5.275 30 20 EKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)sc12 685143039 ITRPFLBNQMSPGW-INIZCTEOSA-N 342.423 5.248 30 20 EKED CCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 749057004 TUZHPXMZAROHTG-NEPJUHHUSA-N 348.418 5.091 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1 750897655 ZUEUIYZHHHUVKD-SWZJNJIDSA-N 329.355 5.200 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3cccc(OCCCC#N)c3)oc2c1 754829331 KMWUVYIJULZFIR-NTMALXAHSA-N 345.398 5.320 30 20 EKED N#Cc1cccc([C@H](NCc2ccc3ccccc3c2)C(F)(F)F)c1 783670548 MKYMIWBXBIOAFY-IBGZPJMESA-N 340.348 5.105 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@]3(C)CC=CCC3)n2)cc1 835067251 CVSHENKDPSJABD-OXQOHEQNSA-N 336.460 5.041 30 20 EKED CCC(C#N)(CC)c1nc(-c2cccc(Oc3ccccc3)c2)no1 904590444 RWGNNKRDZKHLQL-UHFFFAOYSA-N 333.391 5.110 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1C 1776089595 ZHNPSWUKOAFCII-KSSFIOAISA-N 344.499 5.724 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C2CCCC2)cc1 1776784151 LEEUECNQLXKYRN-OAQYLSRUSA-N 345.527 5.638 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1 154327513 QIQSXNSPXUNHJX-DLBZAZTESA-N 327.431 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1cccc(F)c1 189893912 OTGABSPJIGSYBU-MRXNPFEDSA-N 339.454 5.495 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H](SC)C1 191421818 QIOQVJCAEFGKDC-QGZVFWFLSA-N 346.540 5.288 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)ccc2SC1 329024992 VCCFBYJSPQFLHV-BPLDGKMQSA-N 344.480 5.575 30 20 EKED Cc1cc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c(C)s1 329942259 CRCYHSKYEMFEAF-JQRITLKVSA-N 348.512 5.308 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 340437976 XFXKEZSQEFFBGZ-VQTJNVASSA-N 326.871 5.816 30 20 EKED Cc1ccc(-c2nnc(SCCC3(C#N)CCCCC3)o2)c(C)c1 412995603 RBDXXYVXWGRXOP-UHFFFAOYSA-N 341.480 5.310 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1Cc1ccccc1 429217965 INTIUWTVDWIQON-UHFFFAOYSA-N 349.478 5.071 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1F 447556962 IHSOTMYCCZNDKK-QWRGUYRKSA-N 337.225 5.416 30 20 EKED N#Cc1cc(CNc2ccccc2COCc2ccccc2)ccc1F 467766562 CDVDLRIHIGHIKY-UHFFFAOYSA-N 346.405 5.026 30 20 EKED CCn1c(S[C@H](C)CCC#N)nnc1-c1ccc(C(C)(C)C)cc1 470451226 IXFJAYDSFHXBQA-CQSZACIVSA-N 342.512 5.047 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)C[C@@H](CC#N)c1ccccc1 475025158 UOPQZXSDTVZTKX-LJQANCHMSA-N 348.490 5.959 30 20 EKED CCN(Cc1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 497619942 WFISOWIDBNMEPZ-CQSZACIVSA-N 332.369 5.160 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)[C@@H](C)c1cccc(O)c1 505016266 DRYQWKDDHDMACH-INIZCTEOSA-N 338.451 5.126 30 20 EKED CC(C)(CCC#N)CN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 507135077 PMQFPMHSRZTGOO-MRXNPFEDSA-N 325.283 5.460 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1F 512632015 VWLZQMFIMJHDLT-RBZFPXEDSA-N 326.390 5.028 30 20 EKED C=CCC[C@@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccccc1 515149643 GDYNVEAHMHQFQK-MOPGFXCFSA-N 325.427 5.119 30 20 EKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1Cl 560612039 PUOCZULUTJJKOK-NSHDSACASA-N 338.760 5.081 30 20 EKED N#Cc1cnc(N2CC=C(c3cccc4ccccc34)CC2)c(Cl)c1 608885527 WVSQCGCCTUFUSM-UHFFFAOYSA-N 345.833 5.054 30 20 EKED C[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C#N)cc1 608982470 LDJWGQSQTXJJAW-LLVKDONJSA-N 338.760 5.081 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)N(CC(C)C)c1ccc(C#N)cc1 609694207 BDRKRQHDMDLRFD-SFHVURJKSA-N 334.463 5.050 30 20 EKED C[C@H](SCc1coc(-c2ccc(F)cc2)n1)c1ccc(C#N)cc1 609824855 AVQYFKGLIQTTCY-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H](C)C(C)C 743294584 PJYPQUHSJNVRQL-UWJYYQICSA-N 349.478 5.240 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(CC[C@H](O)c2ccccc2)cc1 763007513 AIULRLGGLZRHKZ-QFIPXVFZSA-N 349.474 5.060 30 20 EKED Cc1ccsc1CNc1ccc(OCc2cccc(C#N)c2)cc1 779594628 LACDVEZOEOEUEQ-UHFFFAOYSA-N 334.444 5.119 30 20 EKED COc1c(C)cc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1Cl 796838788 ZLSUVKGIMPTENJ-DNVCBOLYSA-N 342.870 5.353 30 20 EKED C/C(=C/c1ccccc1C(F)(F)F)CNc1cccc(OCC#N)c1 800519669 STQKACREBIUXJD-KAMYIIQDSA-N 346.352 5.123 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217088 BPGXOUHAXJUEBE-DZGCQCFKSA-N 340.389 5.273 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cn1 903001656 WRWJGBGBYVMBFI-KDOFPFPSSA-N 347.384 5.186 30 20 EKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 48859247 GPFCKOOGKMCEPS-GOSISDBHSA-N 346.455 5.225 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66907343 GOZBQJIWUHYZEE-CQSZACIVSA-N 325.437 5.033 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2cc(C#N)cs2)cc1)c1ccccc1 84283503 BSMNEADGTIGKLO-CQSZACIVSA-N 347.443 5.045 30 20 EKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2)cc1 194887852 HFARJFQAZKUJGG-GOSISDBHSA-N 342.442 5.107 30 20 EKED CC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)s1 271515643 UDBSPVGNIPTCJQ-DOMZBBRYSA-N 334.872 5.106 30 20 EKED C[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1c(F)cccc1F 321937254 UQZKFWZVFCBHPQ-VIFPVBQESA-N 326.268 5.028 30 20 EKED C[C@H](c1ccc(C#N)cc1)N1CCC[C@@H]1c1nc2ccccc2s1 433952855 HZZCZPLLUSFPOT-RDTXWAMCSA-N 333.460 5.066 30 20 EKED C=CCC[C@H](NC(=O)N(C)Cc1ccc(Cl)s1)c1ccccc1 435103945 CSSOYIDBBUFBJK-INIZCTEOSA-N 348.899 5.250 30 20 EKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cc(C#N)cs1 437157287 YCNGRJLEZSVTRE-MRXNPFEDSA-N 346.455 5.023 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1CC(C(C)(C)C)C1 457569780 HSHBVZTYRCDKQT-NFOMZHRRSA-N 330.497 5.092 30 20 EKED CC(C)c1cnc(NC(=O)c2ccccc2-c2ccccc2C#N)s1 460553179 WRGYDCSLQYRDCT-UHFFFAOYSA-N 347.443 5.057 30 20 EKED C[C@H](CCCC(F)(F)F)NCc1ccc(F)cc1C(F)(F)F 480241411 NHGFWBZJODHUKH-SECBINFHSA-N 331.275 5.055 30 20 EKED C=CCNC(=O)Nc1ccc(N[C@@H](C)c2ccc3ccccc3c2)cc1 495609130 NZWSULAWBMRWDK-INIZCTEOSA-N 345.446 5.320 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCc3ccc(Cl)cc32)c1 542234793 JHLHQHOJJLATHV-IBGZPJMESA-N 326.827 5.122 30 20 EKED CC[C@H](NCc1ccc(C#N)c(OC)c1)c1ccc(Cl)c(Cl)c1 566648529 ADSLBZHFIBNYEC-KRWDZBQOSA-N 349.261 5.115 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCC(C)(C)CCC#N 588231643 GUVVHJKCIZLVES-GOSISDBHSA-N 326.509 5.260 30 20 EKED Cc1ccc(NCc2cccc(OCc3ccccc3C#N)c2)cc1 609433168 AWUFEGWMSRWZGU-UHFFFAOYSA-N 328.415 5.058 30 20 EKED C[C@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 609970486 JXRRTBAZQXQLFB-AWEZNQCLSA-N 348.427 5.154 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2ccccc2F)s1 618741679 KIAPRHNANDCCMY-HXUWFJFHSA-N 348.446 5.203 30 20 EKED C=CCN(C(=O)c1cc(C)ccc1C)c1nc(-c2ccccc2)cs1 641902361 WBTGGGNXYQBQPY-UHFFFAOYSA-N 348.471 5.260 30 20 EKED Cc1ccc(C)c(CNCc2cccc(-c3ccc(C#N)s3)c2)c1 740011195 KEMYDLUTMUDSHT-UHFFFAOYSA-N 332.472 5.193 30 20 EKED CC(C)CC1(C(=O)[C@@H](C#N)c2nc3ccccc3s2)CCCC1 756228743 UBFGMGQKCZQIPN-CQSZACIVSA-N 326.465 5.079 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 766022458 VZQTVBQHIMPGET-DIFFPNOSSA-N 339.241 5.496 30 20 EKED CC[C@H](C)c1ccc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 767968072 FHYWTGLKNDENCX-KRWDZBQOSA-N 344.458 5.001 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1ccc(CCC(F)(F)F)cc1 768795995 SZLWZJZUADHVBZ-UHFFFAOYSA-N 341.373 5.058 30 20 EKED C=CCC[C@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792099860 ANBOIDDEGGYYOO-SFTDATJTSA-N 340.426 5.161 30 20 EKED CCCCCCCC(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 914507372 BSFGOZCENCWUTE-UHFFFAOYSA-N 326.440 5.518 30 20 EKED N#CCCC[C@H](NC[C@H]1[C@H](c2ccccc2)C1(F)F)c1ccccc1 930568963 IXFYGAABYTWKAA-UFYCRDLUSA-N 340.417 5.060 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776697227 BIUVXIAZZNKXJG-YLGBQOPLSA-N 342.822 5.448 30 20 EKED CCCN(C(=O)c1cccc(CC#N)c1)[C@H](C)c1cc2ccccc2o1 54283820 YYSJVTIPHZCPFV-MRXNPFEDSA-N 346.430 5.112 30 20 EKED C=CCOc1cccc(NC(=O)c2oc3c(Cl)cccc3c2C)c1 65749329 ZLKRWZGEHYDNJH-UHFFFAOYSA-N 341.794 5.212 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 90665396 BCUZKIOAKXTOIQ-RTBURBONSA-N 344.405 5.374 30 20 EKED N#CCCCOc1cccc(CNc2ccccc2CC(F)(F)F)c1 151786672 HSNDJJFMSGWKEK-UHFFFAOYSA-N 348.368 5.086 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 429218390 DHELFEKJAHQNBZ-UHFFFAOYSA-N 347.462 5.051 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2C(C)(C)C)s1 430602551 WICZETPQMGDFLV-AWEZNQCLSA-N 340.492 5.228 30 20 EKED CC(=O)c1c(C)cc(C)c(CN[C@H](CCCC#N)c2ccccc2)c1C 433010828 CWUXRBJQNWJNMN-JOCHJYFZSA-N 348.490 5.339 30 20 EKED Cc1ccnc(Oc2cc(N[C@@H](C)c3ccc(C#N)cc3)ccc2C)c1 439622551 ZHLYJYTWBPICRK-KRWDZBQOSA-N 343.430 5.536 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC(C)(C)C1 443606423 XPJVWDODMCPUHS-GJZGRUSLSA-N 345.512 5.029 30 20 EKED Cc1sc(C(C)(C)NCCC(C)(C)C#N)nc1-c1ccccc1F 451167825 TUYXAAYWZQJIKG-UHFFFAOYSA-N 345.487 5.022 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 472249665 DMEBAKKBAYNTNJ-QGZVFWFLSA-N 338.417 5.562 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(F)c(F)c1 476121711 HOUGPDBESZQBKT-AWEZNQCLSA-N 343.417 5.559 30 20 EKED CCN(Cc1coc(-c2ccc(C)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 507705845 WAEDZHVKQBUHGE-KRWDZBQOSA-N 345.446 5.105 30 20 EKED FCCCCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510770236 ZHPYDOBTCUKVTG-GFCCVEGCSA-N 331.275 5.038 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(Cl)c1SCC(F)F 522986974 CTQZDOBCYGRTEI-UHFFFAOYSA-N 348.846 5.127 30 20 EKED C=C(C)[C@H](CC(=O)Nc1cccc(COC(C)(C)CC)c1C)OCC 535153130 LUUNGLMUWXTTEW-IBGZPJMESA-N 347.499 5.010 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 551209451 CIUNAAYRHGRTMF-APWZRJJASA-N 334.488 5.987 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(Cl)c1Cl 574979665 XMLBWIIUUPQCFR-GTNSWQLSSA-N 331.246 5.203 30 20 EKED C[C@@H](NCc1ccc2sccc2c1)c1ccc(C#N)cc1Cl 584082829 LZJAMJDMROACDE-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C[C@H](NC(=O)CCCCCC#N)c1ccc(-c2ccc(F)cc2)cc1 588162921 SLEWKXPZYKLLIK-INIZCTEOSA-N 338.426 5.144 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCC[C@@H]1C#N 602761044 UXHQLYUNFLOALB-QAPCUYQASA-N 327.472 5.089 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ncc(-c2ccccc2)s1 606916212 BBSFPZRPAYFGCP-UHFFFAOYSA-N 329.469 5.020 30 20 EKED N#CC1(C(=O)Nc2cccc(CSC3CCCCC3)c2)CCCC1 609726189 OAUZCHMDXZYLTI-UHFFFAOYSA-N 342.508 5.275 30 20 EKED N#Cc1cc(CNc2ccccc2Oc2ccccc2Cl)ccn1 610956684 PYAPJFACWHYUEL-UHFFFAOYSA-N 335.794 5.011 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCc2c1ccc(Cl)c2Cl 618806970 UKOHDLIFAOXZHN-ROUUACIJSA-N 343.257 5.129 30 20 EKED CCc1oc2ccccc2c1C=NOCc1cc(-c2ccccc2)on1 727490875 UURAIVXYEQDSSL-UHFFFAOYSA-N 346.386 5.201 30 20 EKED COCc1ccc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)cc1 741845026 XSECJVDFPOXROI-IZZDOVSWSA-N 348.414 5.086 30 20 EKED CC(=NO[C@@H](C)c1ncc(C(C)(C)C)o1)c1cc2ccccc2o1 756851004 ZYUKTSBXCKBJCE-ZDUSSCGKSA-N 326.396 5.220 30 20 EKED CCC[C@H](NCc1cccc(O[C@H](C#N)CC)c1)c1ccsc1 785566552 GJKKCTWTHMTUCO-HKUYNNGSSA-N 328.481 5.060 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 887213082 DAZXUASIJLSFMX-SFHVURJKSA-N 347.499 5.118 30 20 EKED C=CCCCCC[C@H](C)N[C@H](C(=O)O)c1cccc2ccccc12 902565139 JSCJEUUXKPGDKJ-JXFKEZNVSA-N 325.452 5.080 30 20 EKED CCCCCCCC(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 915156074 ZGFVBEQQLDYVDC-UHFFFAOYSA-N 330.394 5.070 30 20 EKED CCC(CSc1ccc(Cl)cc1)=NNc1ccccc1C(=O)O 1776030165 KGALUFPLSWBFTG-UHFFFAOYSA-N 348.855 5.008 30 20 EKED CC(=NNc1ccccc1C(=O)O)c1sc2c(C)cccc2c1C 1776031704 SNXGYDNKGRKNPC-UHFFFAOYSA-N 338.432 5.052 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776339858 HONAVJIOKYFXIT-FPLPWBNLSA-N 348.851 5.194 30 20 EKED CC(C)(CCC#N)CNc1ccc(OCc2ccccn2)c(Cl)c1 124024781 RNKBTVUGWLDTPZ-UHFFFAOYSA-N 343.858 5.056 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCc2c(O)cccc21 188070352 PTMAKJCTHLUDHZ-FQEVSTJZSA-N 349.474 5.303 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2sccc2C1 191414676 HJONVWUNPUYROE-UHFFFAOYSA-N 340.492 5.190 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1F 191426446 SESQRPCWAAKRSH-UHFFFAOYSA-N 340.442 5.342 30 20 EKED CC(C)c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)s1 352190458 DDAZGMOESGHEBB-INIZCTEOSA-N 326.465 5.036 30 20 EKED N#Cc1ccc(SCc2coc(-c3cccs3)n2)c(Cl)c1 465387808 KPNGCWMGCKKLRD-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2cnccc12 476123262 ULVUVNLRFGPZOB-UHFFFAOYSA-N 330.431 5.339 30 20 EKED CCOc1cccc2cc([C@@H](C)Nc3c(F)cc(C#N)cc3F)oc12 500505340 SHBAMFZSKWSWHH-LLVKDONJSA-N 342.345 5.154 30 20 EKED N#Cc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)s1 539423960 INQJFSRXACVUNA-OAQYLSRUSA-N 332.472 5.083 30 20 EKED C[C@H](NC(c1ccc(F)cc1)c1ccc(F)cc1)c1cccc(C#N)c1 539494359 HCYNTJYKVHMXJL-HNNXBMFYSA-N 348.396 5.277 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(c1ccccc1)c1nc2ccccc2s1 546629822 JMEASZOLEUICPU-OAHLLOKOSA-N 336.460 5.563 30 20 EKED Cc1coc(-c2cc(NCc3ccc(C(C)(C)C#N)cc3)ccc2C)n1 594504596 JPACZNNYHMYSQU-UHFFFAOYSA-N 345.446 5.372 30 20 EKED CCc1c([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)oc2ccccc12 618802807 FUXWBVGQOUJUFU-XOBRGWDASA-N 330.431 5.205 30 20 EKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1cc(C)cc(C)c1 726471275 JJTSEUCQSNSULW-UHFFFAOYSA-N 343.883 5.052 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccccc1SCc1ccccc1 735171232 YSEHKWDPFGWELO-HNNXBMFYSA-N 326.465 5.065 30 20 EKED N#CCOc1ccc(Cl)cc1COc1cccc(Cl)c1Cl 735230789 IYSLTNJNFJXDKR-UHFFFAOYSA-N 342.609 5.128 30 20 EKED N#C[C@@H](C(=O)/C=C/C1CCCCC1)c1nc2cc(Cl)ccc2s1 735593344 KDKPMAWKEVANLX-OWNNVSBGSA-N 344.867 5.262 30 20 EKED C=C[C@H](CC(=O)O[C@@H](c1ccccc1)c1ccccn1)c1ccccc1 759276534 XDHUKGVTTTUKEN-JPYJTQIMSA-N 343.426 5.074 30 20 EKED C/C=C(/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC 764841769 YHPZQUGIVQORNH-ZRZLKIQGSA-N 330.431 5.193 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)O[C@H](C#N)C(C)(C)C)cs2)cc1 765630264 VECBEWWJNMQDHY-MRXNPFEDSA-N 342.464 5.029 30 20 EKED O=C(/C=C/c1cocn1)c1ccc(-c2ccc(Cl)cc2F)s1 790222837 FZDHBDUJCSCVTH-DUXPYHPUSA-N 333.771 5.092 30 20 EKED C#CCN(Cc1ccccc1)C(=O)Nc1c(CC=C)cccc1C(C)C 806452470 ZWKQGUXAMQDAOM-UHFFFAOYSA-N 346.474 5.206 30 20 EKED Cc1cc(/C=C\C(=O)c2c(F)cccc2Cl)cc2cccnc12 809159424 PIYCZJFMHBSZTH-FPLPWBNLSA-N 325.770 5.232 30 20 EKED N#Cc1ccc(Oc2nc(-c3cccs3)nc3ccccc23)cc1 15175248 LNGLCVBDZZNWKR-UHFFFAOYSA-N 329.384 5.022 30 20 EKED Cc1oc(C)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 55429710 JHOLYMJIOUCRDC-UHFFFAOYSA-N 346.386 5.121 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cccc(Cl)c1 78481755 CQAHCTGJSYWUDE-VOTSOKGWSA-N 331.849 5.421 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@H](C)CC[C@H]1C 135546404 GNOOWHMWLIJNQV-HZPDHXFCSA-N 349.434 5.064 30 20 EKED Cc1cccc([C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 151866529 VLNIWYHEKCNTNH-HOTGVXAUSA-N 338.476 5.132 30 20 EKED CC(C)(C#N)c1ccccc1COc1ccccc1-c1nccs1 183173153 FUHJZOUUOSUQAY-UHFFFAOYSA-N 334.444 5.190 30 20 EKED N#Cc1cccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 254990617 PIOYUJRUVZVXGW-UHFFFAOYSA-N 326.359 5.226 30 20 EKED C[C@H](NCC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 327791813 GOAHMTDCWLNHNO-SFHVURJKSA-N 326.443 5.041 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2n1 340457888 WMMKOCJRSUFGGO-UTKZUKDTSA-N 329.447 5.321 30 20 EKED C[C@@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccc(C#N)cc1 429433045 VLDBBZMRKFNREJ-CYBMUJFWSA-N 332.369 5.571 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1 483045747 KJJCRTQMDJITOZ-UTKZUKDTSA-N 334.463 5.420 30 20 EKED CC(C)c1cccc(NC(=O)Nc2cccc(OCCCC#N)c2)c1 502671264 RHUQDKUUWSOZCB-UHFFFAOYSA-N 337.423 5.137 30 20 EKED C[C@H]1CC[C@@H](C)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 510048764 IHFFJFWSAZVSIR-JKSUJKDBSA-N 349.434 5.003 30 20 EKED C[C@@H](NCc1ccc(CC#N)cc1)c1cc(F)c(Cl)cc1Cl 542255124 CZGRAEKICSUKAW-LLVKDONJSA-N 337.225 5.049 30 20 EKED C=CCC[C@@H](NCc1ccc(F)cc1C(F)(F)F)c1ccco1 552033610 KPBBNASQTNZHDX-OAHLLOKOSA-N 327.321 5.235 30 20 EKED C=C[C@](C)(CC)C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 573825935 WQBVFTZHAGCQGL-MAUKXSAKSA-N 339.401 5.014 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)Nc3cc(C#N)cc(C)n3)s2)cc1 587973459 CTYQYVSNZKATQL-CQSZACIVSA-N 348.475 5.175 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1Cl 590745065 CJERQGBPVUJZBS-ZDUSSCGKSA-N 330.834 5.131 30 20 EKED CC(C)C[C@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727664623 XLNMAXHSWJPMAA-LAUBAEHRSA-N 334.463 5.353 30 20 EKED CC(=NNc1ccccc1Cl)c1sc(-c2cccnc2)nc1C 747602047 JEZYFCBOLHGRGC-UHFFFAOYSA-N 342.855 5.003 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 759188187 SUEZGUGOOSDSLU-RMHQSFGDSA-N 346.817 5.168 30 20 EKED N#Cc1ccc(Oc2ccc(OCc3cnc(Cl)s3)cc2)cc1 760361578 BGYREPOAZMYGBO-UHFFFAOYSA-N 342.807 5.039 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccncc1 766018706 INHTUMZDNFNFQD-CXAGYDPISA-N 334.435 5.364 30 20 EKED C#CCC1(C(=O)Nc2cc(C(F)F)ccc2Cl)CCCCC1 788231576 FJLZJCYXPLQLHK-UHFFFAOYSA-N 325.786 5.190 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1cccc(Cl)c1C 799900716 OGQXZLOTXUGHSC-UHFFFAOYSA-N 330.884 5.576 30 20 EKED N#Cc1sc(N2CCC[C@H]2c2cccc3ccccc23)nc1Cl 804371577 GWMBAOMMQXZGQO-HNNXBMFYSA-N 339.851 5.163 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2ccc(Cl)s2)c(C(F)(F)F)c1 811685594 WWXVQHKZPIPION-ARJAWSKDSA-N 341.741 5.188 30 20 EKED CCC/C(C)=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920323764 JQYLFUKRPBCVGU-HMVFGEFZSA-N 344.867 5.386 30 20 EKED C=C(Cl)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921227001 ZJRTXKZSLDCRGX-UHFFFAOYSA-N 348.638 5.026 30 20 EKED O=C(O)c1ccc(NN=C(CC2CCCC2)CC2CCCC2)cc1 1776014524 UJXPUOMJTLQRSK-UHFFFAOYSA-N 328.456 5.313 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(Cl)cccc1Cl 1776783330 QREAVRICWYAXIP-ZDUSSCGKSA-N 346.298 5.287 30 20 EKED CC(C)(C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 60722050 ZZNMVGIEFGABCA-QGZVFWFLSA-N 340.854 5.370 30 20 EKED CC1(C)C[C@H](c2cccc(Br)c2)Nc2ccc(C#N)cc21 91691852 IQLMLECCXBUHPO-QGZVFWFLSA-N 341.252 5.155 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc3ccccc3c2)cc1 110650071 FVHKHUCKPYYEHB-WDBUWWRISA-N 327.383 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1cccc(F)c1 476149676 NBRCFSGZOGVLTE-INIZCTEOSA-N 339.454 5.810 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CC(C(F)(F)F)C1 482204355 YZNGNYMJUQJEJP-UHFFFAOYSA-N 340.389 5.001 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 488659054 STZHZKZWAOREAS-HXUWFJFHSA-N 332.447 5.176 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cccc(C#N)c1 500443766 VFSREAFPGDOFFY-INIZCTEOSA-N 346.455 5.023 30 20 EKED N#Cc1ccccc1CSCc1coc(-c2cccc(Cl)c2)n1 515723847 HEGXPDLUJKTREZ-UHFFFAOYSA-N 340.835 5.300 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2 517701108 JSOLZNVCHYTJIH-ABSDTBQOSA-N 346.430 5.034 30 20 EKED COc1ccccc1-c1ccc(CN(CCCCC#N)C(C)C)cc1 525123803 BDHRFXSVUXICLA-UHFFFAOYSA-N 336.479 5.266 30 20 EKED C=C[C@@H](CC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccccc1 534623909 SPMMIQHVVYYJGD-SJORKVTESA-N 325.427 5.095 30 20 EKED C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1 540838925 JWGWENSURUFIAI-CQSZACIVSA-N 329.403 5.264 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(Cl)cc1Cl 541172555 DJIOXXPZXNRGRG-UHFFFAOYSA-N 329.639 5.206 30 20 EKED N#Cc1ccnc(Oc2ccc(Cl)c(C(F)(F)F)c2)c1Cl 552909709 NGKDATIRQAKQKV-UHFFFAOYSA-N 333.096 5.071 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)c(F)c1 553770834 WAZWHYIRQQBTTL-OYHNWAKOSA-N 348.396 5.277 30 20 EKED C/C=C\c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 558298375 IPYARANZSVPOGZ-KXFIGUGUSA-N 335.407 5.046 30 20 EKED Cc1cc(Cl)c(NC(=O)c2cc(C#N)ccc2Cl)cc1Cl 565502322 BVKPWMSHLPRNRK-UHFFFAOYSA-N 339.609 5.079 30 20 EKED CC(C)(C)Cc1nc2cc(NCc3cccc(F)c3C#N)ccc2o1 600859937 KALDBAHOXKHULC-UHFFFAOYSA-N 337.398 5.039 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1C 609436683 CTWGEKSPRFYZJE-BZUAXINKSA-N 345.512 5.029 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc2ccccc12 611679262 SWIZCSOOPLIJQJ-SFHVURJKSA-N 344.458 5.299 30 20 EKED COc1cccc(NN=Cc2ccc(-c3nc4ccccc4s3)o2)c1 725852558 AJHKTTWQALVHJD-UHFFFAOYSA-N 349.415 5.011 30 20 EKED C#CCCOc1ccc(CN[C@@H](C)c2csc3ccccc23)cc1 733328471 RVDDZWDEANMGRD-INIZCTEOSA-N 335.472 5.154 30 20 EKED O=C(/C=C/c1ccc(Cl)c(F)c1)c1ccc(-c2ccncc2)cc1 745990627 VXIMVTVJWVJMBG-KRXBUXKQSA-N 337.781 5.437 30 20 EKED CC(C)CC1(C(=O)[C@H](C#N)c2nc3ccccc3s2)CCCC1 756228729 UBFGMGQKCZQIPN-AWEZNQCLSA-N 326.465 5.079 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772240117 ZZKRGWIVCCJQJH-HBGVWJBISA-N 347.462 5.137 30 20 EKED CC(/C=C/C(=O)c1ccc(Cl)nc1)=C\c1ccccc1OC(F)F 811692437 FTEJOVHTRQZXPF-VTKKNFPDSA-N 349.764 5.179 30 20 EKED CC(C)c1cccc(NC(=S)N(C)[C@H](C)c2cccc(C#N)c2)c1 819029004 SGWOUHULEHXSLW-OAHLLOKOSA-N 337.492 5.071 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)[C@]1(C#N)CC12CCCC2 839245235 PEVHPEOZPYEQST-JOCHJYFZSA-N 330.431 5.075 30 20 EKED C=CC[C@H](N[C@H](c1cccc(OC(C)C)c1)C(F)F)c1ccncc1 848531968 YJYZAZHAVZKESE-RBUKOAKNSA-N 346.421 5.082 30 20 EKED C=CCN(C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1)C(C)C 919909996 FTHCUHJVYQRYFJ-UHFFFAOYSA-N 336.863 5.090 30 20 EKED Cc1cc(C)c(C#N)c(SCc2ccc(Cl)c3cccnc23)n1 31647096 CCKGXFXGDMHXCW-UHFFFAOYSA-N 339.851 5.064 30 20 EKED C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 192930453 QZTSQXGOLGSPQG-GOSISDBHSA-N 342.442 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(F)ccc2[nH]1 356816535 PGGJXCGYLALDOZ-UHFFFAOYSA-N 336.410 5.411 30 20 EKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1ccoc1C1CC1)c2C#N 410965372 BOSPKFQWHJYKGZ-MNOVXSKESA-N 340.448 5.028 30 20 EKED CCC[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 431768091 CMEHPNFQBNVEAJ-LEWJYISDSA-N 349.478 5.262 30 20 EKED CC[C@H](C)C[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438049746 LPWMQLNZQMURMA-SOUVJXGZSA-N 333.501 5.027 30 20 EKED COCCSc1ccc([C@H](C)Nc2c(Cl)cccc2C#N)cc1 462812626 IFDBSFVAFAYRGZ-ZDUSSCGKSA-N 346.883 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCC(F)(F)C1 475575524 RFOPAVBVBFCUGH-OAHLLOKOSA-N 336.426 5.238 30 20 EKED C[C@@H](CCCC(F)(F)F)NCc1cc(C(F)(F)F)ccc1F 494849295 WLQNWQSEMPRDLB-VIFPVBQESA-N 331.275 5.055 30 20 EKED N#CCCCCSc1nc(-c2cccs2)nc2ccccc12 500283428 AUJODPXQQRAXFV-UHFFFAOYSA-N 325.462 5.144 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccccc1 505000778 JYKIWPSQSJOBGE-OAQYLSRUSA-N 334.463 5.564 30 20 EKED CC(C)c1ccc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 518849831 ASOSNSVFFXJRPU-KRWDZBQOSA-N 347.245 5.111 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 523110741 AYOLSQPNHZEMRW-SJORKVTESA-N 334.463 5.053 30 20 EKED Cc1ccsc1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542929937 HMNYHWWPSHOEOT-OAHLLOKOSA-N 346.455 5.086 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)c1ccccc1 561133362 LRTQNODWJJHDEX-HWHRFOGPSA-N 345.486 5.141 30 20 EKED CC(C)(NCc1nc(C2CCCCC2)cs1)c1cccc(C#N)c1 595640236 QLTHAZKNGPZCHZ-UHFFFAOYSA-N 339.508 5.087 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC#N)C1 596628601 KIPZYWUOYOSFPW-INIZCTEOSA-N 327.472 5.091 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccccc3Cl)cc2)c1 609427429 RUNZVAXNKXTDIQ-UHFFFAOYSA-N 348.789 5.256 30 20 EKED COc1ccccc1-c1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1 610270665 TYIFBBPZYWJIQX-KRWDZBQOSA-N 342.442 5.085 30 20 EKED CC[C@H](NCc1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 610812768 PHURHTUVLNEQOS-KRWDZBQOSA-N 337.225 5.245 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(Cl)cc2)o1)c1cncc(F)c1 737445077 VTKMGGIELBSBIS-FNORWQNLSA-N 327.742 5.030 30 20 EKED Cc1cccn2c(/C=C\C(=O)c3ccc(SC(C)C)cc3)cnc12 741467278 LZYMVWKGMFZDPB-FLIBITNWSA-N 336.460 5.039 30 20 EKED CCC[C@H](CC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744766312 NLZGWWJTKRTZBH-AZUAARDMSA-N 335.451 5.042 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(C#N)s2)cc1 762448029 UKLOJDRJPCQZJT-XYOKQWHBSA-N 345.423 5.191 30 20 EKED CC(C)C[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccs1 776157537 CMGZCVQIRXGVOY-CRAIPNDOSA-N 328.481 5.088 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 788595547 KTJYEACJQODLLC-RFQIPJPRSA-N 346.883 5.296 30 20 EKED CCCCC1CCC(C(=O)[C@H](C#N)c2nc3ccccc3s2)CC1 916650401 LTUYFROHTVYXTN-GPANFISMSA-N 340.492 5.469 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC#N)CCC(C)C 191418474 LPFJNQWEDBTPAA-UHFFFAOYSA-N 341.499 5.332 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1ccc2ccccc2c1 207186446 HUGVABWLWHWSNJ-RAXLEYEMSA-N 336.394 5.193 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1CCCCCC1 426263865 AUJSUJOAGPKUIT-HNNXBMFYSA-N 330.497 5.380 30 20 EKED CC(C)(C)c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 432474347 WCOSMCJDGSUIMV-HXUWFJFHSA-N 349.478 5.541 30 20 EKED Cc1cc(CSCc2coc(-c3cccs3)n2)ccc1C#N 447415180 WABPZRKEBMJXCY-UHFFFAOYSA-N 326.446 5.017 30 20 EKED Cc1cc(Cl)cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 477114208 OKSOKFNUVCOZAS-CYBMUJFWSA-N 344.867 5.295 30 20 EKED C=CCSc1ccccc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 486839394 KEYORPRMTYSTJC-CQSZACIVSA-N 342.489 5.035 30 20 EKED CCCc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 519904694 YSISTGCFMIHXCP-UHFFFAOYSA-N 349.478 5.201 30 20 EKED CCc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)sc1C 520827486 GMHGDZJQSCQPJW-GFCCVEGCSA-N 344.505 5.123 30 20 EKED C=CCC[C@@H](NCc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 532726053 QHIGUMOQFHVYRH-LJQANCHMSA-N 344.380 5.374 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)Nc2nccc(C)c2C#N)cc1 542282080 NWTNJCYEPGMQTB-MRXNPFEDSA-N 343.430 5.110 30 20 EKED CSc1cc(Cl)ccc1NCc1ccc(C(C)(C)C#N)cc1 600857931 YPSVUBUWSLIYNG-UHFFFAOYSA-N 330.884 5.475 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc2cc(OC)ccc2c1 610829869 QCYQYAYRSDGRMV-HJPURHCSSA-N 344.458 5.522 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc2c(s1)CCCC2 619755621 NOKMIAIJIFUFHA-GFCCVEGCSA-N 330.884 5.003 30 20 EKED Cc1ccc(-c2nc(/C=C3/CCc4cc(O)ccc4C3=O)cs2)cc1 726427674 SPYYZUNOABSHKO-YBEGLDIGSA-N 347.439 5.037 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1nc2ccccc2s1 727264506 SELIOWJHLREAEN-ZHACJKMWSA-N 348.452 5.316 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1nccc3ccccc13)C2=O 740765341 XGUOOUHIIVMPBA-DTQAZKPQSA-N 331.440 5.169 30 20 EKED C#CC[C@H](NCc1ccc(-c2ccccc2OC)cc1)c1ccccc1 756995891 LOLNPXYMAOAQMH-QHCPKHFHSA-N 341.454 5.216 30 20 EKED C[C@H](C#N)Oc1ccccc1NC(=O)C=C1CCC(C(C)(C)C)CC1 780167424 XBMQUUXXVMBUJQ-LDCVWXEPSA-N 340.467 5.079 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C/c2scnc2C2CC2)cc1 782325007 JRKVOYULOBSTIF-MDZDMXLPSA-N 329.490 5.417 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2cccc(-c3ccccn3)c2)c(Cl)c1 788360177 HPOAOSIIKSFXFJ-NTMALXAHSA-N 344.801 5.170 30 20 EKED C#CC[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccccc1 808709207 VVTJCDNEMVZJSC-IFMALSPDSA-N 328.459 5.208 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc(Cl)nc1 811692434 FTEJOVHTRQZXPF-FDAFXCBZSA-N 349.764 5.179 30 20 EKED C=CC[C@H](N[C@H](C)c1ccccc1SC(C)(C)C)c1ccncc1 815580184 FCGONVYYZLVPAW-APWZRJJASA-N 340.536 5.940 30 20 EKED C=CCN(C(=S)Nc1ccc(Oc2ccccc2)cc1)C(C)C 917589038 GHRRYCKIRXFOBP-UHFFFAOYSA-N 326.465 5.072 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1 1776805943 GZZONPJBHMEKKZ-JOBJLJCHSA-N 334.415 5.023 30 20 EKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1cc2c(ccc3ccccc32)o1 97179517 JLINVUPDEDFAEP-ALCCZGGFSA-N 349.367 5.452 30 20 EKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)sc1C 119983817 VLNNCSDUZVSAOU-LLVKDONJSA-N 346.864 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@H]1C1CC1 289605596 GDLGJRFDFVOFPV-HXUWFJFHSA-N 338.495 5.335 30 20 EKED N#CCCC[C@H](NCCc1c(F)cccc1Cl)c1ccccc1 433012339 JWZJYNCQSKAUGZ-IBGZPJMESA-N 330.834 5.046 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(C)c1Br)c1ccccc1 470043937 GQLFRLUCBWLQDN-CQSZACIVSA-N 344.252 5.056 30 20 EKED CCCc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)sc1C 483235238 NIBXGWPJANLSIU-KRWDZBQOSA-N 334.444 5.047 30 20 EKED C[C@H](N(CCCC1(C#N)CCOCC1)Cc1ccccc1)C(C)(C)C 499631531 OWXZUCGPNPIUEB-IBGZPJMESA-N 342.527 5.024 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2[nH]1 513647271 FZHKVYAASXUAMD-SFHVURJKSA-N 343.430 5.101 30 20 EKED C[C@H](NC[C@H](C#N)CCC#N)c1ccccc1-c1ccc(Cl)cc1 538187144 VBLVVXYQVLPPJB-HOTGVXAUSA-N 337.854 5.101 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCC1(C#N)CCCC1 593133167 OPRHHJOXMLMCCD-UHFFFAOYSA-N 327.472 5.139 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1CCCCCCC1 741560718 GRMPSIKDZZKCBE-HNNXBMFYSA-N 330.497 5.380 30 20 EKED Cc1cc2cc(C(=O)/C=C\c3ccc(O[C@H](C)C#N)cc3)oc2cc1C 749132640 PUIXFUFOPWAGRK-CXOKCQFOSA-N 345.398 5.237 30 20 EKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCCC1 749346435 JJUBBLSDKBHOKW-KKSFZXQISA-N 332.447 5.107 30 20 EKED CC(C)CCOc1ccc(CNc2ccccc2O[C@H](C)C#N)cc1 779990951 CFTKBUTXYGOBCJ-QGZVFWFLSA-N 338.451 5.014 30 20 EKED CC(C)N(Cc1ccc(O[C@H](C)C#N)cc1)[C@@H](C)c1ccsc1 817415904 AFRHCYUPQIETGY-CVEARBPZSA-N 328.481 5.011 30 20 EKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)cc1F 1776784578 JVLWJXDZWSCSDH-UHFFFAOYSA-N 337.479 5.487 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Cl)c(Cl)c1 21835807 ULGOAMDXDDUDEN-UHFFFAOYSA-N 341.263 5.275 30 20 EKED CCSCc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 80454319 SAMIUNTVKFEDPS-OAHLLOKOSA-N 344.505 5.010 30 20 EKED CCCC(=O)Nc1cccc(NCc2ccccc2C(C)(C)C#N)c1C 131610231 MVSGPZGIQNSFID-UHFFFAOYSA-N 349.478 5.147 30 20 EKED Cc1cccc(Oc2ccccc2CNCc2cc(C#N)cs2)c1 237776367 FBSIAMWJHXPMKA-UHFFFAOYSA-N 334.444 5.010 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@H](N[C@H](CCCC#N)c2ccccc2)C1 340438991 BFBGEINYRUACAC-BHIFYINESA-N 347.506 5.441 30 20 EKED N#CCC[C@H](NC1CCC(c2ccc(O)cc2)CC1)c1ccccc1 344851232 JMPAYFZVQWACKH-QVHXHXEWSA-N 334.463 5.053 30 20 EKED Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc(C#N)oc1C 436129945 JUYAELKMGGQNAI-UHFFFAOYSA-N 346.386 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(C)(C)C)C1 475574092 VKDHZVWXYFUDKA-QGZVFWFLSA-N 328.500 5.438 30 20 EKED CCN(Cc1cnc(-c2ccccc2)s1)[C@H](C)c1ccc(C#N)cc1 497610647 KOKDOEHTTNKBFL-MRXNPFEDSA-N 347.487 5.265 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@H]1c1ccsc1 529079346 GSWQPBQZKWUYAV-ZWKOTPCHSA-N 340.492 5.278 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1 533360289 SESQGCSSJFUEKH-HSZRJFAPSA-N 326.443 5.488 30 20 EKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N 538072984 CGFSMLVFZJNJMR-VXGBXAGGSA-N 344.505 5.029 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1 540150300 HOHWKHFUYVRCMG-PGRDOPGGSA-N 331.463 5.230 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)CCCCCC#N 588624211 UTPGMVNIFPMBDX-GOSISDBHSA-N 334.463 5.347 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)CC/C=C\c1ccccc1 606161688 ZIOMOSVKUZHDAC-POHAHGRESA-N 345.895 5.410 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(Cl)c(C)cc1Cl 666422527 NQEBCGXRMOOUBY-TXEJJXNPSA-N 325.239 5.017 30 20 EKED CCCCN(C(=S)Nc1ccccc1C#N)[C@@H](C)c1ccc(C)o1 745707774 SPIOLKFFCFCDMC-HNNXBMFYSA-N 341.480 5.020 30 20 EKED COc1ccc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)cc1F 747151285 GGEZHLZSPQDBHR-GORDUTHDSA-N 330.742 5.130 30 20 EKED CC[C@H](NCc1ccc(OC)c(C#N)c1)c1ccc(Cl)c(Cl)c1 773079192 XBJBFDRQPMMYID-KRWDZBQOSA-N 349.261 5.115 30 20 EKED Cc1scc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 773231772 PYVMLHPPLWPOBJ-LJQANCHMSA-N 346.455 5.273 30 20 EKED C[C@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)c(F)c1 777145215 VWEFRGQKZATBPU-AWEZNQCLSA-N 326.415 5.186 30 20 EKED CCCCCCCCCN(C)C(=O)c1ccc2c(C)cc(O)nc2c1 808292227 ALCJOMRXUHPKGX-UHFFFAOYSA-N 342.483 5.071 30 20 EKED FC(F)(F)c1ccccc1C=NNCc1ccc(Cl)cc1Cl 914696987 YAURFKBARZEKFI-UHFFFAOYSA-N 347.167 5.136 30 20 EKED Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)c1cc2ccccc2o1 916138232 BOCKKKFCROCJAM-SEYXRHQNSA-N 342.398 5.131 30 20 EKED C=C(C)c1cccc(NC(=O)N(C)[C@@H](C)c2sc(C)nc2C)c1 934876065 IUNWUSONTYJDRM-ZDUSSCGKSA-N 329.469 5.018 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1 67253635 BZHNSMOFPFDSLO-IBGZPJMESA-N 338.863 5.152 30 20 EKED N#CCC[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1 130412331 BXOHLWCCCVYSMJ-JOCHJYFZSA-N 334.463 5.143 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCCC(C)(C)C#N 177117997 HGDRLWCHKAWVBP-GIPWTMENSA-N 332.296 5.133 30 20 EKED CC(C)(C(O)=Nc1ncc(C2CCCCC2)s1)C1CCOCC1 330090139 WNHMSABMTZYLCV-UHFFFAOYSA-N 336.501 5.232 30 20 EKED COc1cc(Cl)ccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 421855922 NISGUBIEZQDNSX-DNVCBOLYSA-N 342.870 5.434 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 470196267 XYRSERFTIVVHQC-PBHICJAKSA-N 339.401 5.361 30 20 EKED COc1ccc(Br)cc1CSCCCC(C)(C)C#N 480368401 ZBBTXSXKBZEDTG-UHFFFAOYSA-N 342.302 5.021 30 20 EKED N#Cc1ccc(CNc2ccc(-c3ccc(Cl)s3)nc2)s1 509044808 GGSWVRNHUDVKNT-UHFFFAOYSA-N 331.853 5.009 30 20 EKED C=CCn1c(SCc2csc(C(C)C)n2)nc2ccccc21 513955270 YPDBWHYVHRHGRG-UHFFFAOYSA-N 329.494 5.095 30 20 EKED Cc1ccc2[nH]c(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2c1 520187455 NWJJPROCWLXZBT-CQSZACIVSA-N 349.459 5.123 30 20 EKED CCc1ccsc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520915882 CUDXSMALGFTAED-UHFFFAOYSA-N 348.427 5.227 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1C[C@H](C)C[C@@H](C)C1 524832549 ZAVRVFOJCQQKHB-KFWWJZLASA-N 345.512 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)Cc1ccccc1 530402046 BDRNORWFZWTXPQ-IBGZPJMESA-N 335.491 5.746 30 20 EKED N#Cc1cccc(CSCc2csc(-c3ccsc3)n2)c1F 538146651 LPCQQKKOMLLGHC-UHFFFAOYSA-N 346.477 5.316 30 20 EKED N#CCCCCN[C@H](c1ccccc1)c1cc(Cl)ccc1Cl 541390636 JJHABGBSOFQOTN-GOSISDBHSA-N 333.262 5.366 30 20 EKED N#CCC[C@H](C#N)CNc1cccc(CSC2CCCCC2)c1 554727621 XGZTYJKVCYDFFC-QGZVFWFLSA-N 327.497 5.108 30 20 EKED Cc1sc(NC(=O)c2sc3cc(F)ccc3c2C)c(C#N)c1C 569761960 IOKOTUMMKZJWAO-UHFFFAOYSA-N 344.436 5.151 30 20 EKED N#Cc1c(NC[C@H]2CCCO[C@H]2c2ccccc2)cccc1C(F)F 570610328 UDOLNXSFIMOAMG-BEFAXECRSA-N 342.389 5.076 30 20 EKED C[C@@](C#N)(NC(=O)c1cccc(Nc2ccccc2)c1)C1CCCCC1 574194804 QRFIAOBLBSSCKJ-QFIPXVFZSA-N 347.462 5.023 30 20 EKED N#CCCCCCC(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1 589540383 KYQPTXNNBSMOHQ-KRWDZBQOSA-N 339.266 5.035 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@@H]1Cc1ccccc1Cl 590507194 YTHGMHKKOIRTTM-GOSISDBHSA-N 346.902 5.128 30 20 EKED C[C@@H](Cc1cccs1)N(CCCC#N)Cc1ccc(Cl)cc1 611523398 NVHXLQFDIAOHMD-HNNXBMFYSA-N 332.900 5.138 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(C#N)cc3C)cc2)cs1 614407454 RFVWSVXTZQSKRX-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1c(C(C)C)cccc1C(C)C 665131512 RCWSKIQGFRUDOA-CALCHBBNSA-N 326.484 5.648 30 20 EKED C=CC[C@@H](NC(=O)C/C=C\c1ccc(C(C)C)cc1)c1ccncc1 764242393 HCQHODBDYWTCHT-JEUZPXFCSA-N 334.463 5.042 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352875 OJAZRNJUFIOUFE-NHCUHLMSSA-N 347.462 5.138 30 20 EKED CC(C)c1cccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)c1 1776375995 QAEMFLGATHCCGC-PDGQHHTCSA-N 334.415 5.111 30 20 EKED Cc1c(Cl)cccc1NC(=O)c1ccccc1-c1ccccc1C#N 25721021 BAYJYMKQTOTDBQ-UHFFFAOYSA-N 346.817 5.439 30 20 EKED C[C@@H](SCC(=O)Nc1cccc(C#N)c1)c1cccc2ccccc12 63650062 OKQAVSBRHQHLDO-OAHLLOKOSA-N 346.455 5.144 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1 208002772 YJMLIGJRCLNGIU-REPPVQDKSA-N 346.213 5.180 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(C)(C#N)CC2)c(C)c1 272523340 LOYPBAFPZNRVPS-OAHLLOKOSA-N 345.512 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cccc(C)c2C1 429624818 VFYYSDZBVQGRQH-UHFFFAOYSA-N 348.490 5.437 30 20 EKED CC[C@H](Nc1cccc(CN2CCCCC2)c1)c1ccc(C#N)cc1 447574625 NUSQDLJENMJQFN-QFIPXVFZSA-N 333.479 5.107 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CCC)C1 475582213 JJEXKXYKDWHFAR-KRWDZBQOSA-N 328.500 5.583 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 500741976 IRABWJSHDXWIAW-MRXNPFEDSA-N 341.476 5.066 30 20 EKED C=CCC[C@H](N[C@H](C)c1cnn(Cc2ccccc2)c1)c1ccccc1 537950401 VTNYFKIAYANONB-XXBNENTESA-N 345.490 5.290 30 20 EKED COc1ccccc1[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 539214668 TYGOZIRNMJKINT-QGZVFWFLSA-N 342.442 5.085 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 540995126 NZHCQXLKVZVTLF-UHFFFAOYSA-N 348.368 5.091 30 20 EKED Cc1ccccc1C(NCc1ccc(C#N)cc1)c1ccccc1C 546882736 PYLAKQHNQAPHAF-UHFFFAOYSA-N 326.443 5.054 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@H](CCC#N)c1ccccc1 572916484 FNJXTJHSMPBNDR-IRLDBZIGSA-N 343.474 5.488 30 20 EKED Cc1cc([C@H](NCCCCC#N)c2cccc(Cl)c2)c(C)s1 582479022 IWBKEZICCPHNEP-GOSISDBHSA-N 332.900 5.391 30 20 EKED N#Cc1ccc(SCc2nnc(-c3cccc4ccccc34)o2)cc1 611909343 OBUWJYADNWXWHV-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C=CC[C@@H](NCc1ccc(-c2ccc(F)cc2C)o1)c1ccncc1 734510124 QZAUARUPHKCPRI-HXUWFJFHSA-N 336.410 5.196 30 20 EKED CC(=NOCC(F)(F)F)c1sc(-c2ccc(Cl)cc2)nc1C 764845324 TYZQNRHOSKVGST-UHFFFAOYSA-N 348.777 5.075 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(N2CCCCCC2)cc1 765332476 PSCQTJSMGMYAOK-MOPGFXCFSA-N 347.506 5.350 30 20 EKED C=CCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCC1 791772291 AUEDGCVNYBVQGH-MRXNPFEDSA-N 336.460 5.041 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1c(F)cccc1Cl 809159787 WTRUJZTWGSGKNW-KTKRTIGZSA-N 343.810 5.499 30 20 EKED CCC(F)(F)c1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 828990922 JPKSIYPAMOXJBG-INIZCTEOSA-N 342.389 5.214 30 20 EKED CCCCCCCOc1ccc([C@H](C)N[C@H]2CCn3ccnc32)cc1 834836094 LIKVAXFZEWKLBG-PXNSSMCTSA-N 341.499 5.028 30 20 EKED C=CCCC[C@@H](NCc1csc([C@@H](C)OC)n1)c1ccccc1 880388617 MUYYHJKLEDEFMA-CRAIPNDOSA-N 330.497 5.038 30 20 EKED CCCCCCCCC(=O)N1CC=C(c2c[nH]c3ccccc23)CC1 900676103 YDNPAHCGWPYTFT-UHFFFAOYSA-N 338.495 5.534 30 20 EKED Cc1ccccc1-c1noc(-c2sc3ccc(C#N)cc3c2C)n1 904565103 PALBHLSEFLSYOE-UHFFFAOYSA-N 331.400 5.107 30 20 EKED CC(C)(C)c1nc(CON=Cc2cccc(Cl)c2Cl)cs1 918186053 QREPUHCBEFKVGT-UHFFFAOYSA-N 343.279 5.298 30 20 EKED CC(=C/c1ccccc1)/C=C1\S/C(=N/c2c(C)cccc2C)NC1=O 96298340 YCOIRFLWZUWTIH-REFMDLPBSA-N 348.471 5.141 30 20 EKED C=CCN(C)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 429347274 WQRSFFPDBWFSHQ-OAHLLOKOSA-N 326.465 5.190 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(CSC)cc1 471272357 IDVYEUIDXZGJLE-UHFFFAOYSA-N 340.492 5.160 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCCc2nc(CC)sc21)c1ccc(F)c(F)c1 480661960 SXHPLDZQGHCJKW-SJLPKXTDSA-N 348.462 5.268 30 20 EKED CC(C)CCc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 525999336 SQCZHCZFSYREKI-FQEVSTJZSA-N 334.463 5.301 30 20 EKED C=C[C@@H](CC(=O)N(C)[C@H](C)c1cc2ccccc2o1)c1ccccc1 535335441 FPBAXIBWCTXSDF-SJORKVTESA-N 333.431 5.312 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1ccc(Br)cc1)C1CCC1 540376419 FQTMFYRIKHECBA-QGZVFWFLSA-N 349.316 5.210 30 20 EKED CCC[C@H](NCc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 541324243 BURKRGPBOFEEDV-IBGZPJMESA-N 346.396 5.402 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cncs1 542105925 HTJUSZKDJYIXDY-CABCVRRESA-N 333.460 5.094 30 20 EKED Cc1ccc2[nH]c(CN[C@H](CCCC#N)c3ccccc3)cc2c1C 552082861 GGGMNRJZPAZIKK-OAQYLSRUSA-N 331.463 5.310 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccc(F)c(F)c1 575158128 WPUROFXWUJFFAF-YLJYHZDGSA-N 347.380 5.007 30 20 EKED N#CCCC[C@@H](NCCCOc1ccc(Cl)cc1)c1ccccc1 580751930 LUBJVQYYVSZBLG-HXUWFJFHSA-N 342.870 5.134 30 20 EKED N#Cc1ccc(F)c(CSCc2csc(C3CCCC3)n2)c1 609237452 WFBCDJHKQXKBRU-UHFFFAOYSA-N 332.469 5.245 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccc(CC)cc1 609967848 LAYSYQJDXLTWAT-SFHVURJKSA-N 348.490 5.053 30 20 EKED N#Cc1ccccc1SCc1csc(-c2ccc(F)cc2)n1 610207696 VPGSKQDLJWPVLY-UHFFFAOYSA-N 326.421 5.113 30 20 EKED CCCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@H](C)c1ccccc1 610356034 HWXTWBAZWHAUDL-QZTJIDSGSA-N 349.478 5.192 30 20 EKED N#CCOc1ccc(CN2CCC[C@H]2c2cccc3ccccc23)cc1 731212197 YKRGWKAEKAZKIG-QHCPKHFHSA-N 342.442 5.079 30 20 EKED COc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)c1 741468733 HJRYHGNSWJKQQM-GDNBJRDFSA-N 344.410 5.267 30 20 EKED O=C(/C=C/c1cccs1)c1ccc(SCC(F)(F)F)cc1 741843902 RKNOIVKAHABHKK-BQYQJAHWSA-N 328.380 5.299 30 20 EKED C/C(C=NOc1ccccc1C(F)(F)F)=C/c1ccc(Cl)cc1 754713093 ZCLKCOFEXWRONW-RTVIBEEKSA-N 339.744 5.827 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797572179 ZWCZFRLAJWQKIO-CABCVRRESA-N 332.513 5.223 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3nccc4ccccc34)co2)cc1 811698452 JZNHBRHQAWWODC-ZHACJKMWSA-N 340.382 5.094 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(COC)c(F)c1 867727306 TWOOXMHSSZFSPP-UHFFFAOYSA-N 341.426 5.076 30 20 EKED CC[C@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1cccc(C#N)c1 902940791 ZMXUNHNUEUCOAH-IBGZPJMESA-N 349.478 5.415 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCOC2(CCCC2)C1 907676880 MNPONCQFQMODOO-GOSISDBHSA-N 341.495 5.216 30 20 EKED N#CCC[C@@H](NCc1cnc(-c2ccsc2)s1)c1ccccc1 130439614 VEIUBGOKQZJSHS-QGZVFWFLSA-N 339.489 5.006 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1nc2c(s1)CCCC2 340449423 VDUBXDXNBFCAND-NVXWUHKLSA-N 339.508 5.108 30 20 EKED CC[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1 447595656 AJJZDNQZQYIYLP-SFHVURJKSA-N 332.369 5.616 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1cccc(C2CC2)c1 449348241 KSLIGJBWOORCRN-QGZVFWFLSA-N 334.463 5.097 30 20 EKED CCCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](C)c1ccccc1 462014731 ICQLVCBXYIFZDY-QZTJIDSGSA-N 334.463 5.052 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc2ccccc2n1)c1ccc(F)c(F)c1 480680164 KLGRHTZQTGGUNA-QKKBWIMNSA-N 338.401 5.481 30 20 EKED C=CCCc1ccccc1NC(=O)N(CCC)Cc1ccc(C#N)cc1 505023516 MJRXJJGYAAJZIE-UHFFFAOYSA-N 347.462 5.121 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2ccccc2o1 518738861 BRPOGIKUQNDDBJ-ZDUSSCGKSA-N 336.416 5.079 30 20 EKED Cc1c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)oc2ccccc12 538072789 QCDJBZXMDFKGEG-UHFFFAOYSA-N 338.432 5.224 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cc(F)ccc1F 539626730 FIAHWFLXKFHOTO-IBGZPJMESA-N 330.378 5.211 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCCCC(C)(C)C#N 542523472 XBCRPSGFSGUXJQ-GOSISDBHSA-N 326.509 5.260 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)c(C)c1 555336937 MALNHVVFJXEJON-DZGCQCFKSA-N 345.512 5.042 30 20 EKED Cc1c([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 570590212 HWPNZJGNTYVWRS-MGPUTAFESA-N 330.431 5.341 30 20 EKED C=CCC1(NC(=O)Nc2ccccc2S[C@H](C)CC#N)CCCC1 596733896 AMWFBCCCOASXLS-OAHLLOKOSA-N 343.496 5.091 30 20 EKED CCc1c(C)sc(NC(=O)c2ccc(SC(C)C)cc2)c1C#N 609031622 RMGIAQWMWAEPGO-UHFFFAOYSA-N 344.505 5.243 30 20 EKED CCCCc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 609375489 XUFABCSIZAPQJP-UHFFFAOYSA-N 338.476 5.287 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1c(F)cccc1Cl 609384702 JFKQWCZATGSNKM-LBPRGKRZSA-N 334.847 5.343 30 20 EKED CCC1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 609433885 PTPCFAGYUAYIAK-UHFFFAOYSA-N 349.434 5.004 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1cc2cc(Cl)ccc2o1 731835776 QFFGAYOOTYVIDK-FPLPWBNLSA-N 349.773 5.637 30 20 EKED CC1(C)CCCC[C@H]1CC(=O)[C@H](C#N)c1nc2ccccc2s1 752473316 FZURDELYLQKTEN-KBPBESRZSA-N 326.465 5.079 30 20 EKED N#C[C@H](SC1=Nc2ccccc2CS1)c1ccc(Cl)cc1 752934911 YKKGSDSRKQGPSZ-HNNXBMFYSA-N 330.865 5.572 30 20 EKED CC(C)(C=NNc1ncnc2sc(-c3ccccc3)cc12)CCC#N 755521793 UHXACMXZWCLLQZ-UHFFFAOYSA-N 349.463 5.086 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 808351363 OFOYDXGAQWYLKL-LJQANCHMSA-N 326.827 5.194 30 20 EKED C#CC[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccccc1 808709209 VVTJCDNEMVZJSC-IRLDBZIGSA-N 328.459 5.208 30 20 EKED N#C[C@@H](C(=O)CCCc1ccccc1Cl)c1nccc2ccccc12 810717361 VBXHUWZZYQCZNU-SFHVURJKSA-N 348.833 5.087 30 20 EKED CC1(C)CC[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762979 SCDZCESEWDZHHR-KBPBESRZSA-N 344.867 5.076 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 915988211 SEBZOXRNCQZESP-VURMDHGXSA-N 329.421 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1C[C@@H]2CC[C@H](C1)S2 931060208 RCQSDXHSQIVBDS-ALOPSCKCSA-N 344.524 5.087 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C(C)(C)C)cc1 1776784295 PUZSUFAUCIDMMV-IBGZPJMESA-N 333.516 5.278 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](CC(C)(C)C)C(=O)O)cc1 1776787882 CTHPDWMKZWYMMX-IBGZPJMESA-N 349.515 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)n1cnc2ccccc21 189899509 NMHLCXYRGWXBBS-MRXNPFEDSA-N 347.462 5.088 30 20 EKED C=CCC1(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)CCCC1 449182026 ARKZSJGCGSEGFT-UHFFFAOYSA-N 336.479 5.010 30 20 EKED CC[C@@H]1CC[C@H](C)N(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 454775979 YKBOHAYUDFQMJV-HRCADAONSA-N 345.512 5.123 30 20 EKED Cc1cccc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 458392165 AGKYVKFYZBFXFO-RXVVDRJESA-N 349.478 5.099 30 20 EKED C=CCCC[C@@H](C)Sc1nnc(-c2ccco2)n1Cc1ccco1 462417340 MMCHTQIDQPDWPX-CQSZACIVSA-N 343.452 5.016 30 20 EKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C 477356917 CAIDRDKSFKVEEU-TZIWHRDSSA-N 347.462 5.057 30 20 EKED C[C@H](Sc1ccc(C#N)cc1Cl)c1noc(-c2ccccc2)n1 477426374 KGPQTEGYHFPULW-NSHDSACASA-N 341.823 5.115 30 20 EKED CCCN(C(=O)Nc1ccc(F)c(C#N)c1)[C@@H](CC)c1ccccc1 481680788 ACQNSJJJOGGZEL-IBGZPJMESA-N 339.414 5.093 30 20 EKED CC[C@@H](CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 504329825 VONNMRBUPUPUQS-HKUYNNGSSA-N 334.463 5.052 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2cc(Cl)ccc2o1 540607332 PTTXCOZRECHLGW-KDOFPFPSSA-N 338.838 5.782 30 20 EKED Cc1c(COc2ccccc2)cccc1N[C@@H](C)c1cccc(C#N)c1 600851111 VPZFZMHMWSDWPY-SFHVURJKSA-N 342.442 5.619 30 20 EKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(C)s1 609176236 BVTPBEVXVZWGRP-UHFFFAOYSA-N 348.427 5.281 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C)cc3C)n2)cc1 612894853 QWYYGBGHBNCCKT-SFHVURJKSA-N 346.455 5.225 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1c(CCC)cccc1C(C)C 666856303 ZYQOPUMBPRDYKH-HDICACEKSA-N 326.484 5.477 30 20 EKED CC(C)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Cl)cc1 728713292 YLCPBEPPTZWRSX-FOIQADDNSA-N 342.870 5.118 30 20 EKED CCCCCC[C@H](C)NN=Cc1c(-c2ccccc2)nn(C)c1Cl 743450558 MHXSDHJFSBGRTD-HNNXBMFYSA-N 346.906 5.023 30 20 EKED C[C@@H](NC(=O)CCCc1ccc(C(C)(C)C)cc1)c1cccc(C#N)c1 743777444 VLDPYLLYOSVMSR-QGZVFWFLSA-N 348.490 5.056 30 20 EKED CCCC(=NNc1ccc(Cl)nn1)c1ccc(Cl)c(Cl)c1 746678210 ABCKAVYIWJMVBG-UHFFFAOYSA-N 343.645 5.053 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)CC(C)(C)C)n2)cc1 773982395 IEHJATGVAPHJBP-ZBFHGGJFSA-N 340.492 5.367 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 799900676 NPGLAKFZARJTMM-UHFFFAOYSA-N 341.867 5.139 30 20 EKED CCC[C@@H](CC1CCCCC1)C(=O)OCCCC1(C#N)CCOCC1 800169974 YXDBZYAIRZURPK-IBGZPJMESA-N 349.515 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccnc1Cl 834314217 JPPVBFIABIUNDD-UHFFFAOYSA-N 342.870 5.158 30 20 EKED CCCc1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1 915984570 AFGUKLSRKYRBFH-VAWYXSNFSA-N 334.444 5.054 30 20 EKED CCCOc1cc(/C=C\C(=O)c2ccccc2Cl)ccc1OC 916135278 OJVRMHYWMYSFHI-NTMALXAHSA-N 330.811 5.034 30 20 EKED CC(C)COC(=O)Nc1cccc(N=Cc2cc(Cl)ccc2O)c1 920387527 QSCJLFJSRUIKBT-UHFFFAOYSA-N 346.814 5.001 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)N[C@@H]1CCCC(F)(F)C1 925562003 FKEJWGIAWHYWHZ-SNVBAGLBSA-N 341.286 5.208 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2ccncc2)cc1F)c1ccccc1 125777754 PLZYWQIWQRFASD-JOCHJYFZSA-N 345.421 5.022 30 20 EKED CC[C@H](C#N)Sc1nnc(SCc2ccc(C(C)C)cc2)s1 127222715 XWAADICFZNQWPS-CQSZACIVSA-N 349.550 5.348 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2ccc(C#N)cc2F)cc1 177859318 DTNZHFTZUZSCHG-AWEZNQCLSA-N 328.456 5.049 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CCCC2)C1 191462241 FPLCMEMIGFDINL-UHFFFAOYSA-N 326.484 5.337 30 20 EKED N#Cc1ccc(OCc2csc(-c3ccc(Cl)cc3)n2)cc1F 303310106 FJPONXHJIJAGAF-UHFFFAOYSA-N 344.798 5.053 30 20 EKED C[C@H]1C[C@@H](C(O)=Nc2nc3c(ccc4ccccc43)s2)CCC1=O 329386129 POCZWEMTWARQAO-AAEUAGOBSA-N 338.432 5.043 30 20 EKED C[C@H](Cc1nc(C2CCC(C)(C)CC2)no1)/N=C(/O)C1CCCCC1 329680584 RLOCYXQNZXVSFL-CQSZACIVSA-N 347.503 5.221 30 20 EKED Cc1ccc2c(C(=O)N[C@@H](CCCC#N)c3ccccc3)csc2c1 352179717 AYVCPKFSAQGLJE-IBGZPJMESA-N 348.471 5.375 30 20 EKED CC(C)(C#N)CCCCSCc1csc(-c2cccs2)n1 435884582 UQLTVROILOBTJL-UHFFFAOYSA-N 336.551 5.825 30 20 EKED C=C(C)[C@@H](NCc1ncc(C(C)(C)C)s1)c1ccc(F)c(F)c1 447892196 GPBBWUHWZUNLET-QGZVFWFLSA-N 336.451 5.126 30 20 EKED CC(C)(CCC#N)CNCC(C)(C)c1c(Cl)cccc1Cl 462746249 SWUQQLQLOIXOAU-UHFFFAOYSA-N 327.299 5.191 30 20 EKED N#Cc1ccc(SCc2coc(-c3ccc(Cl)cc3)n2)cc1 509650716 QQKKRKLJHDTJQL-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C[C@@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)cc1F 512278119 IVCRXDXWCXPQGG-MRXNPFEDSA-N 337.442 5.251 30 20 EKED CCSc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512624063 HOVQVYCIXAJENO-KBPBESRZSA-N 328.456 5.221 30 20 EKED N#Cc1cnc(N2CCC[C@@H]2c2cccc3ccccc23)c(Cl)c1 513610173 TZKIYOMDFSFDGI-LJQANCHMSA-N 333.822 5.101 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 535373221 OABWRGUGBDJYLU-OAHLLOKOSA-N 334.444 5.109 30 20 EKED CN(C(=O)CCCCC#N)[C@H](c1ccc(Cl)cc1)C1CCCC1 594017071 QFMISVABPPHWCL-IBGZPJMESA-N 332.875 5.114 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@H](C#N)c2ccc(Cl)cc2)cc1 595411452 QEYRKKCMCNICTN-IFXJQAMLSA-N 328.843 5.043 30 20 EKED C[C@H]1CCC[C@@H](C)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610184756 HVEMZRAHUZAXCY-SJORKVTESA-N 348.446 5.001 30 20 EKED CCCCN(C(=O)Nc1cccc(C#N)c1C)[C@H](C)c1ccc(C)o1 610905996 NSUKYAARKAIRIZ-MRXNPFEDSA-N 339.439 5.163 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1cccc(C#N)c1 611166832 AEIJOGHAOHPFNF-PIGZYNQJSA-N 331.246 5.203 30 20 EKED COc1ccc([C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 611438520 AHEUIQSXYYUUCS-HXOBKFHXSA-N 342.442 5.007 30 20 EKED Cc1cc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc(C)c1F 741467724 QGMSUCJFJNCFGL-ARJAWSKDSA-N 343.448 5.524 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](c2ccccc2)C(C)C)n1 747198485 XOHCUTRREDRNEO-SJORKVTESA-N 340.492 5.273 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccccc1OC1CCCC1 754708870 GDVFBBRIUUSKFP-UHFFFAOYSA-N 349.352 5.440 30 20 EKED C=C(C)[C@@H](NC(=S)Nc1cc(C)ccc1C)c1ccc(F)c(F)c1 774205630 LYWDZQJIVOQKRL-GOSISDBHSA-N 346.446 5.185 30 20 EKED CC(C)(CCC#N)CNc1ccc(OC(F)F)c(C(F)(F)F)c1 793315566 CHWFXFVYGIXROC-UHFFFAOYSA-N 336.304 5.049 30 20 EKED N#Cc1sc(N[C@H](Cc2ccccc2)c2cccs2)nc1Cl 804462071 DCOLNSWLTLXRKA-GFCCVEGCSA-N 345.880 5.126 30 20 EKED Clc1ccc(Cl)c(NN=Cc2conc2Cc2ccccc2)c1 814861697 ZLIVNYURKPGZBX-UHFFFAOYSA-N 346.217 5.018 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 90665363 GMQPQDZGKCGLHW-KSSFIOAISA-N 343.268 5.145 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(-c2ccncc2)c1 90665486 XQCUSJLZYNRKKD-WZONZLPQSA-N 341.458 5.444 30 20 EKED CC(C)(C#N)CCSc1nc(-c2ccccc2)c(-c2ccccc2)o1 97599227 MQQXAKFSPVRWAV-UHFFFAOYSA-N 348.471 6.041 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)sc1Cl 154328808 FIXQWFJCQONYPC-ZJUUUORDSA-N 325.264 5.338 30 20 EKED CC(C)c1ccc([C@@H](NCc2ccc(C#N)o2)c2cccs2)cc1 174249791 MKWWWOPDDBWETO-HXUWFJFHSA-N 336.460 5.215 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 186454730 BHTSBLDGJHTERO-YVEFUNNKSA-N 336.451 5.260 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CCSC 191444784 NREHAFHQCHBQJW-HNNXBMFYSA-N 334.529 5.144 30 20 EKED C=CCCc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)o1 409854605 KKGMMLFUWYMOBU-UHFFFAOYSA-N 339.826 5.121 30 20 EKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CCCCC1 510648307 LEPIDSRYEWJIEC-UHFFFAOYSA-N 349.434 5.147 30 20 EKED C=CCC[C@H](N[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 526982212 WFQGAVJMNIBYPP-KSSFIOAISA-N 341.417 5.117 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)Cc1cccc(C#N)c1 531587174 CNWRHJMVYBEYDM-MRXNPFEDSA-N 347.487 5.183 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 537928498 UTKUFJYJKWVVJF-CRAIPNDOSA-N 349.434 5.145 30 20 EKED C=CCC[C@@H](NCc1ncc(CC)o1)c1ccc(C(F)(F)F)cc1 539333798 NQAVOTNPAVYGKW-MRXNPFEDSA-N 338.373 5.053 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C#N)s2)cc1 539529714 XSOXFDXRRLYLDO-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C[C@H](Nc1cc(Cl)cc2cccnc12)c1ccc(C#N)cc1F 541897138 XCPBABXQMXZHRP-NSHDSACASA-N 325.774 5.072 30 20 EKED CCN(C(=O)c1cc(F)c2ccccc2c1)[C@@H](C)c1ccc(C#N)cc1 555431067 HDDLXTOZZSXIRL-HNNXBMFYSA-N 346.405 5.074 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc(F)c(Cl)cc1Cl 571008610 AYBMKJRUGHDRGC-YPMLDQLKSA-N 349.236 5.342 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)[C@@H]1C1CC1 574799092 LWSYIKVFBCZFDX-IBGZPJMESA-N 326.484 5.191 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC[C@@H](C#N)CCC#N 591773845 INATZGUAFKYHPP-MRXNPFEDSA-N 327.497 5.275 30 20 EKED N#CCC[C@H](N[C@@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593606413 FHLNWGHLRPQCOA-DLBZAZTESA-N 328.818 5.101 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCSc2ccc(Cl)cc21 618803811 IWTPRLLABKMDCD-ZWKOTPCHSA-N 340.879 5.026 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)CC(C)(C)C 730421779 PKGQLNZTZCPYAX-WCQYABFASA-N 332.444 5.074 30 20 EKED N#CCOc1ccc(Cl)cc1CSCc1ccc(Cl)s1 735318294 JYBHHOIJVIIWPL-UHFFFAOYSA-N 344.288 5.391 30 20 EKED COc1cccc2cc(C(=O)/C=C\c3cnc(C(C)(C)C)s3)oc12 736432671 DPZUDQVWIXKBJQ-HJWRWDBZSA-N 341.432 5.092 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@@H](CC2CCCC2)c2ccccc2)cc1 752103209 OMEIZXYKPGZBMK-JPYJTQIMSA-N 348.490 5.389 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)/C=C\c1ccccc1C#N 799483689 RNACDPMHTZJTPC-SEYXRHQNSA-N 332.447 5.457 30 20 EKED C=CCN(C(=O)Nc1ccc(Oc2ccccc2Cl)cc1)C(C)C 916706810 NGMVNRAMWGYSQR-UHFFFAOYSA-N 344.842 5.561 30 20 EKED O=C(O)c1ccc(NN=C2CCCCC[C@@H]2c2ccccc2)cc1F 1776076167 AAVQICSUPQJFRC-MRXNPFEDSA-N 340.398 5.040 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776119815 MKGKELNWKYEVGP-DHZHZOJOSA-N 342.822 5.232 30 20 EKED Cc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)oc2c(C)cccc12 80456884 SRLJLOZKGBQVKW-CQSZACIVSA-N 338.432 5.120 30 20 EKED CCCCCCCC(=O)Nc1cccc(NC(=O)c2ccccc2)c1 100321818 MGZMPKXEBGTTHL-UHFFFAOYSA-N 338.451 5.238 30 20 EKED CCCCCCCC(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1 109420071 IWYHBUIIBDPIMO-KRWDZBQOSA-N 327.472 5.005 30 20 EKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCCCC1 111766046 UHIFNPCTRZGLAI-OAHLLOKOSA-N 345.512 5.125 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CCCCCCC1 217050000 BEUYPEPHMBRSSH-HNNXBMFYSA-N 345.512 5.315 30 20 EKED C=CCOc1ccc(CNc2cccc(COCc3ccco3)c2)cc1 236685908 CKEOXABJKYOFKL-UHFFFAOYSA-N 349.430 5.173 30 20 EKED OC1=Nc2ccccc2[C@@H]1CC/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329024351 UUGFBEXVEJFYKF-IDCNUPLLSA-N 340.467 5.325 30 20 EKED N#CCCC[C@@H](NCc1cscc1Br)c1ccccc1 353913257 ICACXJURIGHJBG-MRXNPFEDSA-N 349.297 5.035 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@]1(F)c1ccccc1 413745837 JQJXVNUGSQEVCS-SIKLNZKXSA-N 337.438 5.362 30 20 EKED CC[C@H](N[C@@H]1CCCOc2cc(Cl)ccc21)c1ccc(C#N)cc1 447578680 GKGXAFNWJMQYCW-RBUKOAKNSA-N 340.854 5.166 30 20 EKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3ccccc3)c3ccccc23)C1 450684248 RGCFGRDQXIJJGG-GOEBONIOSA-N 331.444 5.081 30 20 EKED C=CC[C@H]1N(C(=O)Nc2ccc(CC#N)cc2Cl)CCCC1(C)C 455737756 UPXAUJXVISSKJY-QGZVFWFLSA-N 345.874 5.005 30 20 EKED C[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccc(C#N)cc1 542721677 NARNEEPVTDMODH-JTQLQIEISA-N 349.768 5.032 30 20 EKED N#CCCC[C@H](NC1CC(c2ccccc2Cl)C1)c1ccccc1 560563595 BIWPQTFIMYUQDT-NGICGMGXSA-N 338.882 5.611 30 20 EKED C[C@@H](Cc1ccc(Cl)cc1)N[C@H](CCCC#N)c1ccccc1 590069241 LDUATWVREHCEGV-OXJNMPFZSA-N 326.871 5.296 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1sc2cccc(C)c2c1Cl 610907295 BBKSNVHMHFQMPS-UHFFFAOYSA-N 340.835 5.296 30 20 EKED C/C(=C\C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 731332021 ASTMPXIQKHJCBQ-UTZKEFOASA-N 336.460 5.123 30 20 EKED CC(C)CC(=NNc1cccc(C(F)(F)F)n1)c1cccs1 739422424 URVWFXUBFAKBMM-UHFFFAOYSA-N 327.375 5.024 30 20 EKED C=CC[C@@H](N[C@@H]1CCCc2c1sc1ccccc21)c1ccncc1 766023033 ZPXCXTMIESUXDA-RTBURBONSA-N 334.488 5.581 30 20 EKED CC(=NNc1nc2cc(Cl)ccc2cc1C)c1nc(C)sc1C 778552345 VNKINTMFXUAOLN-UHFFFAOYSA-N 344.871 5.106 30 20 EKED CCCCCCCC[S@@](=O)Cc1csc(C2CCCC2)n1 790140317 RVRROSOUIMWBFV-OAQYLSRUSA-N 327.559 5.410 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1cccc(C#N)c1 811686867 BJZZVQXIRBGEIK-POLRJCGMSA-N 339.341 5.002 30 20 EKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1 842940842 FKKJIJHGHQNBLE-IAGOWNOFSA-N 338.476 5.027 30 20 EKED N#C[C@@]1(c2nc(-c3c(Cl)cccc3Cl)no2)CC2CCC1CC2 904306788 MKTNIMDMTJXOJY-IGCAFJPESA-N 348.233 5.015 30 20 EKED C=CCN(Cc1ccccc1)C(=S)Nc1c(CC)cccc1CC 914601694 FEEJBBBXTDKEES-UHFFFAOYSA-N 338.520 5.196 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1ccccc1C#N 97221719 HWWGAFLBGCCEGY-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1Br 192641202 QHFHFNQMIJJRAD-UHFFFAOYSA-N 348.240 5.146 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCC[C@@H](C)C1)C(O)=N2 329701464 HJVBXZOBNPAUGT-BMFZPTHFSA-N 328.456 5.107 30 20 EKED COc1ccc2oc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 358344247 VXVUOFIKVCEBBJ-UZLBHIALSA-N 348.446 5.446 30 20 EKED CC(C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H](C)c1ccsc1 421686275 AIDDMMGMARTFRX-OAHLLOKOSA-N 340.492 5.161 30 20 EKED N#C[C@@H]1CC[C@H](Nc2cc(Cl)ccc2SCC(F)(F)F)C1 442856633 OLSZTQQJPSNNCX-KOLCDFICSA-N 334.794 5.099 30 20 EKED Cc1ccc([C@@H](C)N(C(=O)CCCC#N)c2cc(C)ccc2F)cc1 464393901 UERJZUXPMPYLRH-QGZVFWFLSA-N 338.426 5.231 30 20 EKED Cc1cccc(C)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 474702918 LRHKWAIPTPVPSA-UHFFFAOYSA-N 342.398 5.220 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(-c2cccs2)c1)c1ccccc1 475534856 VVCXUSBFQMXROE-QGZVFWFLSA-N 346.455 5.441 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc(Cl)c1 476123073 NPIVBKSRARANCW-UHFFFAOYSA-N 343.854 5.209 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477508041 HEOVSQRVROBGAX-FQEVSTJZSA-N 349.478 5.493 30 20 EKED CCC[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 500896798 SDGODJIGGBUIFZ-GOSISDBHSA-N 333.262 5.496 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1cccc(C#N)c1F 540347149 VXHALYSEPWJMCN-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CC(C)(C#N)CCCN(Cc1cccs1)C1Cc2ccccc2C1 551428934 WDKOFEFAEVNGEY-UHFFFAOYSA-N 338.520 5.047 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCSc4c(Cl)cccc43)CC2)c1 551805157 QCSJIHSJQRDCMY-KRWDZBQOSA-N 340.879 5.027 30 20 EKED CC(C)C[C@@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 727953790 GNLUVHLRFHNILX-DGCLKSJQSA-N 334.872 5.198 30 20 EKED C[C@@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 765330307 JROLNVFLMIEGCK-BZNIZROVSA-N 347.245 5.039 30 20 EKED FC(F)(F)C1CCC(C=NNc2nc3ccccc3s2)CC1 767351433 BFJTXUITOCSLLN-UHFFFAOYSA-N 327.375 5.063 30 20 EKED CC(C)c1ccc(N2Cc3ccc(N[C@H]4CC[C@@H](C#N)C4)cc3C2)cc1 799718834 AKRYIODLKXMAMX-UTKZUKDTSA-N 345.490 5.434 30 20 EKED CC(=Nn1c2ccccc2c2ccccc21)c1cc(C(=O)O)ccc1C 1776112965 RHXUIAPZZOJWRA-UHFFFAOYSA-N 342.398 5.073 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(SCC)c1 1776783997 SJQNSANGQRVDPH-KRWDZBQOSA-N 337.529 5.092 30 20 EKED Cc1csc([C@@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)n1 41521726 JIMCNILSWBBAEB-INIZCTEOSA-N 346.411 5.149 30 20 EKED CC(C)C[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 109028018 CFVHEAAXBBXMQO-JKSUJKDBSA-N 345.512 5.123 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2-c2cccs2)cc1Cl 153937939 FOHWOIAMSXZYLC-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#CCCC[C@@H](NC(=O)CC/C=C/c1ccccc1)c1ccccc1 352207125 UESNMCWGZUTRRO-FAKWYAOSSA-N 332.447 5.031 30 20 EKED COc1cc(Cl)ccc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 421839429 XMQJAQUYRBWUFQ-KDOFPFPSSA-N 328.843 5.044 30 20 EKED N#Cc1ccc(SCc2nc3ccccc3n2C(F)F)c(Cl)c1 465387298 GSFVPWZAAQIUJA-UHFFFAOYSA-N 349.793 5.249 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cncc(C)c1)c1ccc(C(F)(F)F)cc1 467746277 NDENTTJMGSIWNV-HNAYVOBHSA-N 348.412 5.767 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(F)cc1 476086010 UKGJKSZFINHPFX-HNNXBMFYSA-N 341.426 5.084 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(OC)cc1F)c1ccc(F)c(F)c1 480659099 MGLFBYIBXRFEBA-CWTRNNRKSA-N 335.369 5.081 30 20 EKED CC(C)C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 504191791 QXCYAGCOLUCROQ-HXUWFJFHSA-N 349.478 5.397 30 20 EKED C[C@@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccc(C#N)cc1 513004421 NZQOOKPTHKRCMW-LLVKDONJSA-N 338.760 5.081 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518260345 YLPRTHKHXCJWDK-GOSISDBHSA-N 349.434 5.147 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc3ccccc3c2)cc1 520993598 OJYQRPZQYKWSIX-RUZDIDTESA-N 348.449 5.591 30 20 EKED C[C@H]1CC[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@@H]1C 543594547 SUQYMSAVIWCKRP-CAOSSQGBSA-N 345.512 5.027 30 20 EKED Cc1ccccc1C(NCc1ccc(F)c(C#N)c1)c1ccccc1C 546180245 TXAXQRZCFQOAOK-UHFFFAOYSA-N 344.433 5.193 30 20 EKED C=CCC[C@H](NCc1ccccc1OCC(F)(F)F)c1ccco1 552038029 GAEMTEBYUBYCRJ-HNNXBMFYSA-N 339.357 5.018 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 556208585 WGGCIGREEVVQNJ-LIRRHRJNSA-N 347.289 6.079 30 20 EKED N#CCCC[C@H](NCc1cc(-c2ccccc2)cs1)c1ccccc1 560561007 AYVQAQNPDRTVQU-QFIPXVFZSA-N 346.499 5.940 30 20 EKED N#CCCC[C@H](NCCc1ccc(F)cc1Cl)c1ccccc1 577596273 YVXHNYVTNNUDSL-IBGZPJMESA-N 330.834 5.046 30 20 EKED CCN(C(=O)CCCCCC#N)[C@H](C)c1cccc(C(F)(F)F)c1 588327761 KNVXBRRQGWYRPO-CQSZACIVSA-N 340.389 5.089 30 20 EKED N#C[C@H](C(=O)c1cccc2ccccc12)c1nc2cc(F)ccc2s1 592974065 NHTUXQNSDRAMMV-MRXNPFEDSA-N 346.386 5.079 30 20 EKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 728764507 RYYQEQFJZPTEOR-PMACEKPBSA-N 342.442 5.241 30 20 EKED COc1c(Cl)cc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1Cl 777671778 PIJXZLREUKRRBR-VIFPVBQESA-N 339.197 5.186 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1cccc(SC(F)F)c1 777672673 BNRSVRVZOBFDHX-QGZVFWFLSA-N 330.403 5.362 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1ccc2cnccc2c1 782326132 BIURHIYRJVPASB-VURMDHGXSA-N 336.460 5.193 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3ncc(C(F)(F)F)s3)oc2c1 788353226 FBOZUJHJNUSZJD-SNAWJCMRSA-N 337.322 5.113 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1c[nH]c2ccccc12 916249863 OVEXANZXKFQXCT-UHFFFAOYSA-N 325.415 5.209 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(CSc2ccccc2)cc1 60850951 QMPRRPMKLKRGSN-UHFFFAOYSA-N 325.477 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1Cc2cc(C)c(C)cc2O1 189872008 ZXVVMPIEZKGXCG-OAQYLSRUSA-N 349.474 5.098 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C/c1ccc(F)cc1 189883746 BXYLUAFRTMKGNO-VMPITWQZSA-N 337.438 5.720 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([C@@H](C)CC)no1 189889738 QYPKOKIHGZGKOS-AWEZNQCLSA-N 326.440 5.292 30 20 EKED Cc1nc(N[C@@H](CCC#N)c2ccccc2)c2c(C)c(C)sc2n1 439092119 OASLUQMTESTCQB-INIZCTEOSA-N 336.464 5.074 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@H](c2ccc(Cl)cc2)c2ccsc2)C1 463300684 LCDDBVJHRJKMFP-FSPWUOQZSA-N 330.884 5.163 30 20 EKED C=C(C)[C@H](NCc1cnc(C(C)(C)C)s1)c1ccc(F)c(F)c1 479412742 JXRGQIJONMBWPQ-INIZCTEOSA-N 336.451 5.126 30 20 EKED C[C@@H](CCCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 480169648 XCCPZBSJPIOAOA-GWCFXTLKSA-N 345.302 5.530 30 20 EKED CC[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 487449973 SIYWYMRIILDIJZ-DENIHFKCSA-N 348.490 5.430 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 554366178 HXPNXYHLHVRQJC-DLBZAZTESA-N 338.417 5.261 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 559569720 BVIXOANOTQVRME-UHFFFAOYSA-N 346.386 5.319 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC[C@@H](C#N)CCC#N)cc1 575741500 ZAISAANKWDJACF-DLBZAZTESA-N 335.476 5.395 30 20 EKED COc1ccc2c(c1)CC/C(=C/c1cnc(-c3ccccc3)s1)C2=O 727263795 IHFXJNHUDZNNND-VBKFSLOCSA-N 347.439 5.031 30 20 EKED CCn1cc(/C=C\C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cn1 732528907 FLLKFSFYMJMGPO-BAQGIRSFSA-N 342.851 5.181 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 739155489 IFYDPKADBKRGRL-YJBOKZPZSA-N 346.430 5.321 30 20 EKED COc1ccccc1/C=C/C=C/C(=O)c1cccc(-c2ccncc2)c1 741473239 OUKZLGLSAYHKKD-LWUHNEAVSA-N 341.410 5.210 30 20 EKED CCCCCCOc1cccc(CN[C@@H](C)c2cccc(C#N)c2)c1 743496841 SONUTHWDMJKDPV-SFHVURJKSA-N 336.479 5.368 30 20 EKED C[C@H]1CCC[C@H](OCCCCCC(=O)OCC2CCC(C#N)CC2)C1 755974879 MGPKUYSFEGVWFM-FVELJTHGSA-N 349.515 5.015 30 20 EKED C#CCCCCC(=O)N(Cc1cc(C)nc2ccccc12)C1CCCC1 773357079 QNYIZHWLCHQEAH-UHFFFAOYSA-N 348.490 5.008 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccccc1 774266878 RZEHIYNMBHJGDN-SJKOYZFVSA-N 334.246 5.114 30 20 EKED C[C@@H]1/C(=C\c2ccccc2OCc2ccccn2)C(=O)c2ccccc21 809156606 MTWJQRBADCCVSF-YIRPMMGJSA-N 341.410 5.044 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1O 810213516 UOWBFODTASBIKA-PXAZEXFGSA-N 348.368 5.085 30 20 EKED C=CCCC[C@@H](Nc1cccc([C@H]2CCC(=O)N2)c1)c1ccccc1 883229532 LMPMHYQAESQRMN-NHCUHLMSSA-N 334.463 5.147 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)ccc1Cl 1776783008 QNGKMYYNAIAMDC-OAHLLOKOSA-N 346.298 5.287 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccccc1F 1776784570 HYDPPXXPXUQFMN-IBGZPJMESA-N 337.479 5.414 30 20 EKED N#Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)c1 56517832 JNNTYLJEQYYUSV-OAQYLSRUSA-N 341.414 5.080 30 20 EKED C=CCOc1cccc(NC(=O)c2sc3ccc(F)cc3c2C)c1 65749665 LEZJCJMHTATJBJ-UHFFFAOYSA-N 341.407 5.166 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc12 118443152 YGDYXDPFMPYRFL-LSDHHAIUSA-N 334.419 5.115 30 20 EKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1cc(F)ccc1F 179799668 INENUVAXEJTQEW-LJQANCHMSA-N 328.406 5.007 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2n1 179824985 ATWSIPNURBLIRK-MRXNPFEDSA-N 331.419 5.090 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(Cl)s1 189912466 PJMZBQXOXSWWGC-CYBMUJFWSA-N 347.911 5.996 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Br)cs1 194121253 MUUXGZALKNNRCI-WFASDCNBSA-N 349.297 5.206 30 20 EKED COc1ccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc1O 211279754 DNFPCUVEPRBMCA-TWGQIWQCSA-N 344.366 5.196 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1O 287616894 JOTOQGGRPSXPAM-MSOLQXFVSA-N 328.843 5.131 30 20 EKED COc1ccc(C(=O)/C=C/c2ccccc2OC2CCCC2)c(F)c1 303006453 LUFGVCZTKDKZOT-JLHYYAGUSA-N 340.394 5.052 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 340443203 FMLFIBIZQQOUOI-MAUKXSAKSA-N 341.524 5.661 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(F)c2ccccc12)c1ccccc1 352166171 MENFCEZICKPKNW-OAQYLSRUSA-N 346.405 5.144 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)CC1CCCCCC1 426281831 OXCUWRUNFIRSKZ-HNNXBMFYSA-N 330.497 5.237 30 20 EKED COc1cccc2c(N[C@@H](CCC#N)c3ccccc3)cc(C)nc12 439098008 GCTUUMVPXMKTAB-SFHVURJKSA-N 331.419 5.009 30 20 EKED CCC1(CC)CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 447060101 NTQQVZRWBHPALI-OAHLLOKOSA-N 345.512 5.125 30 20 EKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)CC(C)(C)C#N)c1 447202383 YHIKKHRXVVFVRL-UHFFFAOYSA-N 342.826 5.319 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCc2ccccc2C1 476086645 ZHCQTLRHQYXTJI-GOSISDBHSA-N 347.502 5.672 30 20 EKED C[C@H]1C[C@]1(NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 503441342 ZQEYBSVRCRUDQV-YCRPNKLZSA-N 338.882 5.166 30 20 EKED CCN(C(=O)CCCC1CCCCC1)[C@@H](C)c1ccc(C#N)cc1 509616091 HVOXHMMNDGLVJL-KRWDZBQOSA-N 326.484 5.218 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cccc(OCC)c2)cc1Cl 518786031 LYVIFABSAJJAPX-HNNXBMFYSA-N 345.870 5.154 30 20 EKED CC[C@@H](C)c1ccc([C@H](NCc2nc(C#N)cs2)C(C)C)cc1 571845042 NGWZQDUVRFDTRM-AUUYWEPGSA-N 327.497 5.015 30 20 EKED Cc1cc([C@H](N[C@H]2CCCc3cc(C#N)ccc32)C2CC2)ccc1F 584177089 JLYRPEYTVLUUPP-FCHUYYIVSA-N 334.438 5.124 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2ccc(OCC)cc2)cc1Cl 589639072 KLKVPPBXAWBWGC-OAHLLOKOSA-N 345.870 5.154 30 20 EKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2cccc(C#N)c2)c1 609805892 MKOGDEOQXDQBOV-FQEVSTJZSA-N 333.435 5.016 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1cccc(-c2nccs2)c1 611482449 IRVLSCUBHJBTSX-IBGZPJMESA-N 331.444 5.171 30 20 EKED C=C[C@@H](CC(=O)N[C@H]1C[C@H](c2ccccc2Cl)C1)c1ccccc1 647544301 LUJWIOGBBHFYNH-SZMVWBNQSA-N 339.866 5.062 30 20 EKED C=CCC[C@@H](NCc1oc(C)nc1C)c1ccc(C(F)(F)F)cc1 685571482 HLXSILKHYXWCSI-MRXNPFEDSA-N 338.373 5.107 30 20 EKED C[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2nc3ccccc3s2)CC(C)(C)C1 727629852 WURUOUPPRMTDRU-QLFBSQMISA-N 340.492 5.325 30 20 EKED CCn1cc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)cn1 732530197 KDWQXZHENSHJOD-BQYQJAHWSA-N 342.851 5.181 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 739142184 HAEPNYXWCJKWFL-RHSMWYFYSA-N 348.471 5.229 30 20 EKED C#CC[C@H](OC(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1ccccn1 739171244 YVUBFGUBIBKYGI-UTKZUKDTSA-N 335.447 5.006 30 20 EKED CC(C)c1ccc(NC(=O)Cc2ccccc2CC#N)c(C(C)C)c1 776813130 LXPGSNFLXBTWOD-UHFFFAOYSA-N 334.463 5.181 30 20 EKED C#CC[C@@H](N[C@H](c1cccc(OC(C)C)c1)C(F)F)c1ccccc1 788684387 CVYCUKHMAVAVLC-WOJBJXKFSA-N 343.417 5.134 30 20 EKED CCCCCCCC[S@@](=O)Cc1coc(-c2cccc(F)c2)n1 790138025 CQJYDOBJVSUMEH-HSZRJFAPSA-N 337.460 5.090 30 20 EKED O=C(/C=C/c1cocn1)c1ccc(Oc2ccc(F)cc2)cc1Cl 790222682 DRVGHXHBDBDJHQ-FPYGCLRLSA-N 343.741 5.156 30 20 EKED CCCCCCCCC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 886731541 HPLAVINXEVEOAE-HNNXBMFYSA-N 332.513 5.566 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc(OC2CCCC2)cc1 912963392 KAVSRHFWBSZNOJ-UHFFFAOYSA-N 332.403 5.012 30 20 EKED O=C(O)c1ccc(NN=C2CCC(C3CCCCC3)CC2)cc1F 1776075172 RPGKYCYIICCBKX-UHFFFAOYSA-N 332.419 5.062 30 20 EKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccsc3)cc2)c1 1777686063 BQASFPSPFAPMLT-RMKNXTFCSA-N 334.396 5.009 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 178639667 DCTJIHZIHYETAV-OAHLLOKOSA-N 348.233 5.160 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)o2)cc1 303680067 ITSOANOLELTJJE-CQSZACIVSA-N 349.459 5.585 30 20 EKED N#CC1(CC[S@@](=O)Cc2ccc(Cl)c(Cl)c2)CCCCC1 417172034 HLJUZXCSKBTGML-OAQYLSRUSA-N 344.307 5.106 30 20 EKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(C)cc1Cl 430614408 ZADJVFNKJWPGCC-ZDUSSCGKSA-N 346.883 5.201 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1SC 437163784 IFVGYBIJJMLOSU-UHFFFAOYSA-N 343.467 5.652 30 20 EKED CC[C@@H](N[C@@H]1CCCOc2c(Cl)cccc21)c1ccc(C#N)cc1 447580153 NGYJJQSFPDBFCM-RTBURBONSA-N 340.854 5.166 30 20 EKED CC(C)(C)C[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458804754 SWTJCSVYVZYIEO-MOPGFXCFSA-N 341.499 5.032 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458805187 UFPQCOQZWLBXGF-GHTZIAJQSA-N 349.478 5.133 30 20 EKED C[C@@H](C#N)C(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 469223371 HSPMFLSFOBXCGY-INIZCTEOSA-N 326.399 5.119 30 20 EKED C[C@@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)c(F)c1 539607520 QPWAEWZIOXHAMZ-GFCCVEGCSA-N 342.464 5.261 30 20 EKED N#CCC1CCN(Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 541920336 DYMVQDXTTXAKNC-UHFFFAOYSA-N 348.368 5.091 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1coc2ccccc12 560655428 QTXDYWXXPPILIT-UHFFFAOYSA-N 333.431 5.466 30 20 EKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(Cl)c1Cl 574979666 XMLBWIIUUPQCFR-PIGZYNQJSA-N 331.246 5.203 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)NC1(c2ccc(C#N)cc2)CCC1 594516331 CMMFUZRHRKRILY-HNNXBMFYSA-N 339.508 5.177 30 20 EKED C[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1cccc(C#N)c1 612605163 CVOUEQJNAYKEEF-SNVBAGLBSA-N 349.768 5.032 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 613290337 CYMWJGHDUBVIPP-NRFANRHFSA-N 348.405 5.392 30 20 EKED N#C[C@@H](Sc1nc2ccccc2n1C(F)F)c1ccc(Cl)cc1 619863643 GNEBHQFGXGMRHH-CQSZACIVSA-N 349.793 5.442 30 20 EKED C=CCN(C(=O)N[C@H](C)c1ccc(Oc2ccccc2)cc1)C(C)C 726270328 VPHGQDBRGPQXBY-QGZVFWFLSA-N 338.451 5.146 30 20 EKED Cc1ccc2c(c1)C(=O)/C(=C\c1cnc(-c3ccccc3)s1)CCO2 727264377 PUOBHRNHLKQBCO-VBKFSLOCSA-N 347.439 5.167 30 20 EKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccc(F)c1 743474137 IMMULTLLXVUYQN-INIZCTEOSA-N 346.405 5.449 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)cn1 750909884 ONBZLGHAKVKXBU-SOFGYWHQSA-N 340.423 5.228 30 20 EKED C=CCCC(=O)O[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753365363 UDQPHBQWYNKUFL-SNVBAGLBSA-N 340.206 5.219 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(C(F)F)cc2)ccc1SC 794935930 VKOSLBIXUJXDES-WEVVVXLNSA-N 334.387 5.251 30 20 EKED C[C@@H](CCC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797568954 YSBGMLSKXFNNTN-HOCLYGCPSA-N 340.492 5.201 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccc(SC(C)(C)C)cc1 806250053 RMHNMAPOOSFRJN-UHFFFAOYSA-N 333.501 5.029 30 20 EKED Cc1cc(Cl)ccc1CNc1ccccc1SC[C@H](C)C#N 864006408 URQKYARHEMRXDW-CYBMUJFWSA-N 330.884 5.512 30 20 EKED CSc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1 916133299 DDVFWODXCHUDEG-XFXZXTDPSA-N 337.469 5.428 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccccc2)C2CC2)cc1Cl 303228090 XFWFSHXFSBVRTC-HXUWFJFHSA-N 327.855 5.146 30 20 EKED CCSc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 349317777 DJIYYIQUOUCIGO-UHFFFAOYSA-N 342.489 5.057 30 20 EKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1cccc(CC#N)c1 455925198 WTJZYZWXIRXWFP-KRWDZBQOSA-N 347.462 5.148 30 20 EKED Cc1ccc(-c2csc3ncnc(S[C@H](C)CCC#N)c23)cc1 470442341 OABCVMUBARAVBD-CYBMUJFWSA-N 339.489 5.451 30 20 EKED C=CCCCCNCc1cccc(NC(=O)c2ccccc2Cl)c1 472040994 BQEUTOLKXPBOAR-UHFFFAOYSA-N 342.870 5.038 30 20 EKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nccc2ccccc12 483191636 FTVOIXGCIOYULZ-JOCHJYFZSA-N 348.405 5.392 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 487595526 UWMMUSJGJPYZFT-SFHVURJKSA-N 334.444 5.109 30 20 EKED CC(C)CN(C(=O)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1 514535570 SGEJMKVFUHKRRQ-UHFFFAOYSA-N 347.245 5.168 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 551530861 YDZRBXYZNSUUEB-LSDHHAIUSA-N 342.870 5.411 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 554364533 HXSMLRXBGCHNFN-IRXDYDNUSA-N 338.417 5.261 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 586795008 TZCZHLIDXXTSBJ-BVPBIZIASA-N 336.401 5.013 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3ccc(C#N)c(F)c3)sc2c1 589800193 YXXSWCARPBQTCN-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C[C@@H](c1ccc(CNC(C)(C)c2cccc(C#N)c2)cc1)C(F)(F)F 595633248 QCISQDKCMBNBDS-AWEZNQCLSA-N 346.396 5.249 30 20 EKED C[C@@H](Nc1ncccc1C#N)c1ccccc1-c1ccc(Cl)cc1 610077228 KUMGXSDKDZMUIR-CQSZACIVSA-N 333.822 5.447 30 20 EKED CC(C)c1ccc(CSCc2nnc(-c3cccc(C#N)c3)o2)cc1 610218291 USQDKXMLORZSQD-UHFFFAOYSA-N 349.459 5.165 30 20 EKED N#Cc1cc(CNc2ccccc2Oc2ccc(Cl)cc2)ccn1 610955809 AYBUULYYPRXCGT-UHFFFAOYSA-N 335.794 5.011 30 20 EKED CC(C)(C)c1ccc(Cl)cc1NC(=O)c1c(F)cc(C#N)cc1F 619760905 SRKFIKRVUXWVHG-UHFFFAOYSA-N 348.780 5.040 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cc1OC 728441648 NTZTZUFRNDCUEQ-WZUFQYTHSA-N 342.460 5.100 30 20 EKED N#Cc1ccc(CSCc2csc(Cc3ccccc3)n2)cc1 729855592 JUCDVYFOXBJSKH-UHFFFAOYSA-N 336.485 5.039 30 20 EKED C=CCN(C(=O)Nc1cccc(Sc2ccccc2)c1)C(C)C 731107829 HIGRSYVYJPGSTP-UHFFFAOYSA-N 326.465 5.266 30 20 EKED C[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 734080534 UXOIOUTUVUIKNR-WMLDXEAASA-N 338.476 5.203 30 20 EKED O=C(/C=C/c1ccc(Cl)c(F)c1)c1cccc(-c2ccncc2)c1 741474757 ZMRWPSGDHNRJKT-FNORWQNLSA-N 337.781 5.437 30 20 EKED C=CCN(C(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)C(C)C 745277791 USJPPCJLCWCRFK-YLJYHZDGSA-N 344.499 5.210 30 20 EKED CCCC[C@@H](NCc1cccc(O[C@H](C#N)CC)c1)c1ccccc1 746046577 AGKGJKVKDRVYEF-RBBKRZOGSA-N 336.479 5.389 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccncc1 766017375 ATEYUYDKGABYSI-JTSKRJEESA-N 329.447 5.112 30 20 EKED C#CC[C@@H](N[C@@H](CC)c1ccccc1OC(F)F)c1ccccc1 773106237 KWTXMQDDIKZBHW-ZWKOTPCHSA-N 329.390 5.093 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccc(OCC#N)cc1 806664101 ZWCCRMNUTOAVGZ-HOTGVXAUSA-N 348.421 5.293 30 20 EKED CCCC[C@@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 810158502 NPPHADVHRMIPKV-DYESRHJHSA-N 349.478 5.384 30 20 EKED C[C@@H](c1cccs1)N(C)C(=O)Nc1scc(C(C)(C)C)c1C#N 821488253 KFFDTZLEBJGBHE-NSHDSACASA-N 347.509 5.204 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1ccc([C@@H](C)C(F)(F)F)cc1 834571283 POUCIPWOMZLYJD-ZIAGYGMSSA-N 348.368 5.255 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)CC(C)(C)C 917041574 VNKMDOFTZIAMGN-OLZOCXBDSA-N 347.409 5.070 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(CCC#N)CC1CC1 78439753 ZTDOIUNHYNGTJZ-UHFFFAOYSA-N 327.472 5.091 30 20 EKED N#C[C@H](C(=O)CC1=CCCCC1)c1nc2cc(Cl)ccc2s1 106985533 IRERFDZVBNNGFH-CYBMUJFWSA-N 330.840 5.016 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)S[C@@H](C)c2cccc(C#N)c2)n1 443138594 FDPTZRCYTFNZCJ-LSDHHAIUSA-N 349.459 5.472 30 20 EKED CC(C)(C#N)CCCCN1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 444680000 CJOOODYWJFGBPM-MRXNPFEDSA-N 338.417 5.215 30 20 EKED Cc1cccc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 458392164 AGKYVKFYZBFXFO-NQIIRXRSSA-N 349.478 5.099 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CCCc2ccccc21 497488598 BMLGUTMDNVGLHF-QGZVFWFLSA-N 345.895 5.036 30 20 EKED C=C(C)CCSCc1csc(-c2ccc(OC)cc2OC)n1 507118276 BUDIWGXIEIMQGF-UHFFFAOYSA-N 335.494 5.027 30 20 EKED CC(C)(NCc1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 507344189 WTNBECLZXQRRPL-UHFFFAOYSA-N 337.225 5.029 30 20 EKED N#CC1(CCCSCCCc2ccc(Cl)cc2)CCOCC1 507716753 FTLHIRKXLYEYBI-UHFFFAOYSA-N 337.916 5.106 30 20 EKED C=C1CCN([C@@H](C)c2ncc(-c3ccc(Cl)cc3Cl)o2)CC1 510565703 OHLVWGFMJGFWFA-LBPRGKRZSA-N 337.250 5.361 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2)c1 521326455 RTKKIEVVMPGYRQ-UHFFFAOYSA-N 347.349 5.134 30 20 EKED Cc1ccccc1-c1cnc(CS[C@@H](C)c2ccc(C#N)cc2)o1 534527752 VDXFDSUOBUUGFH-HNNXBMFYSA-N 334.444 5.516 30 20 EKED C[C@H](NCc1ccc(F)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542013106 FGNDLPVPOORKFY-INIZCTEOSA-N 330.406 5.215 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1ccc(F)cc1)c1cccs1)CC2 580803896 XKUCQJWMIMCORV-FPOVZHCZSA-N 348.446 5.125 30 20 EKED N#Cc1c(F)cccc1NCc1ccc(COCc2ccccc2)cc1 603856321 NEQVHUNIWPYIHC-UHFFFAOYSA-N 346.405 5.026 30 20 EKED CCCCN(Cc1ccccc1Cl)C(=O)Nc1ccc(C#N)cc1 608860893 NLPLRGWKCNHVQS-UHFFFAOYSA-N 341.842 5.046 30 20 EKED CC(C)(C#N)c1ccc(CNC2(c3ccc(Cl)cc3)CCC2)cc1 614174256 PTEHULOMQWBKPG-UHFFFAOYSA-N 338.882 5.310 30 20 EKED C=CC[C@@H]1CCN(C(=O)Nc2cccc(COC(C)(C)CC)c2C)C1 626424718 TYWCDZMLMWVTMR-QGZVFWFLSA-N 344.499 5.130 30 20 EKED C=C[C@](C)(CC)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 685383481 FYAOPQRZQZTVPP-SWLSCSKDSA-N 328.309 5.001 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(C(C)C)cc2C(C)C)c1 726458337 YVPIPWXRAVLQRC-UHFFFAOYSA-N 336.504 5.724 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C/c1cnc(-c3ccccc3)s1)CC2 741848790 PTEXDROOHRLEFD-LFIBNONCSA-N 347.439 5.031 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](c2ccc(F)cc2)C(C)C)n1 756571978 QSAFDGXVWAFDLA-WBVHZDCISA-N 344.455 5.022 30 20 EKED O=C(/C=C\c1ccc(F)nc1)c1ccc(Cl)c(Cl)c1Cl 777464503 XDTOAGLPFBBOHH-KTAJNNJTSA-N 330.573 5.077 30 20 EKED CCCCCCCCC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813216630 VXVFIIBRQRSORT-AWEZNQCLSA-N 326.362 5.027 30 20 EKED CC(=NNc1nncc2ccccc12)c1ccc(-c2cccs2)cc1 818215092 XCMFRUHPBSZBOV-UHFFFAOYSA-N 344.443 5.194 30 20 EKED FC(F)(F)c1ccccc1ON=C[C@H]1CCC[C@@H](C(F)(F)F)C1 853324431 GDNYERZQITUJMW-WDEREUQCSA-N 339.279 5.439 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(=O)c1ccccc1 907675513 DSGKVNKRNSAATR-UHFFFAOYSA-N 349.474 5.530 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC[C@@H](C)CCc1ccccc1 1776782390 PWGLCUANAOXCTF-ICSRJNTNSA-N 333.516 5.049 30 20 EKED O=C(/C=C/c1csc(Br)c1)c1cc2ccccc2o1 31823919 ULRCGAVKPKAOEJ-AATRIKPKSA-N 333.206 5.153 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)cn1 60212573 FYWCOMUBQUTDAC-VQHVLOKHSA-N 340.423 5.228 30 20 EKED C[C@H](Nc1cccc(COCc2ccco2)c1)c1cccc(C#N)c1 179732714 KPACFQNQQUUAQZ-INIZCTEOSA-N 332.403 5.041 30 20 EKED Cc1cc2nc(/C=C\c3ccc(O[C@@H](C)C#N)cc3)sc2cc1C 208009003 HSHKDJCLEPELLI-AJHXJQRKSA-N 334.444 5.374 30 20 EKED CC1(C#N)CCN(C(=O)Nc2ccc(/N=N/c3ccccc3)cc2)CC1 272530240 MPCKRLGSDJCAOC-WCWDXBQESA-N 347.422 5.260 30 20 EKED Cc1cccc([C@H](Nc2c(Cl)cccc2C#N)c2ccccn2)c1 301906718 ZGVGEZJXIQPDOS-FQEVSTJZSA-N 333.822 5.117 30 20 EKED CC1(C)CCC[C@@H](CC(O)=Nc2cccc([C@@H]3CN=C(O)C3)c2)C1 328855132 JVAFBWSYIIMVEX-HOCLYGCPSA-N 328.456 5.325 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cnn(C2CCCC2)c1 340446355 NGXVQNUQGGWRNY-UWJYYQICSA-N 336.483 5.084 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)c(F)c1 447566401 SPMXFIDNLQRJHN-GHMZBOCLSA-N 337.225 5.416 30 20 EKED CC[C@H](N[C@@H]1CCCOc2c(Cl)cccc21)c1ccc(C#N)cc1 447580152 NGYJJQSFPDBFCM-RBUKOAKNSA-N 340.854 5.166 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3ccco3)cc2F)cc1 477094152 VTAMQQCPTCVXCL-UHFFFAOYSA-N 348.377 5.139 30 20 EKED C=C(C)[C@H](N[C@H]1CCCc2nc(CC)sc21)c1ccc(F)c(F)c1 480661961 SXHPLDZQGHCJKW-WMZOPIPTSA-N 348.462 5.268 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2c(Cl)cccc2C1 505009986 ABWBVWNKYCVUTM-UHFFFAOYSA-N 340.854 5.049 30 20 EKED N#CC1(CCCS[C@@H]2CCCCc3ccccc32)CCOCC1 507717447 XKYDOIRKBRXTKD-LJQANCHMSA-N 329.509 5.288 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(C(F)F)c1 512007287 JNNIVBDUDJLMOO-UHFFFAOYSA-N 341.810 5.168 30 20 EKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519988470 UAOZRGDYNNKTAG-HXUWFJFHSA-N 349.434 5.003 30 20 EKED C=C(C)CN(CC)C(=O)c1csc(-c2cccc3ccccc23)n1 539777702 YCXIRDNXGAMBTE-UHFFFAOYSA-N 336.460 5.002 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@H]1CCc2ccc(C#N)cc21 569513781 PXSAQWSONOSIOY-RBUKOAKNSA-N 344.380 5.137 30 20 EKED CC1CCC(CC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 609651341 AJHLONCOCHOHJR-HWOWSKLDSA-N 330.497 5.093 30 20 EKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)cc2c1 647379788 NQTVETFASPSJSZ-ZDUSSCGKSA-N 338.457 5.034 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2s1 735204192 RCPHCIZQHSENNC-HUUCEWRRSA-N 328.481 5.469 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc(C#N)cc1C 747776874 XKHMJKPLYOVLLT-UHFFFAOYSA-N 326.399 5.094 30 20 EKED Cc1cc(C)c(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1C 753134644 KWFDYWBCSSXBHH-FPLPWBNLSA-N 334.444 5.026 30 20 EKED C#CCC(C)(C)C(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 767086173 OGXQFBCWQICGCX-QGZVFWFLSA-N 335.447 5.123 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@@H]1C[C@H](O)c1ccccc1 769735866 ZBLHQSOEKYBCBX-RTWAWAEBSA-N 342.527 5.075 30 20 EKED CC(C)c1cnc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 782523842 MDEOKGZKRIBQSN-MRXNPFEDSA-N 345.446 5.187 30 20 EKED O=C(/C=C\c1cccc(-c2cccnc2)c1)c1nccc2ccccc12 811699291 QMXPMGWSTFSNIU-KHPPLWFESA-N 336.394 5.193 30 20 EKED CC(=NO[C@H](C)c1ccccc1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776082960 DHSMXNVDRLBFTJ-OAHLLOKOSA-N 349.386 5.147 30 20 EKED CCCCCCCCCN(C)c1c(C(=O)O)cnc2ccc(C)cc12 1776785413 XDTQVYJWYXMGFM-UHFFFAOYSA-N 342.483 5.428 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)c3ccc(C)o3)cc2)o1 98042515 UTOCENHRUQRYIA-DSOJMZEYSA-N 346.382 5.282 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1nc2cc(C)ccc2[nH]1 105464662 PPEOJLQEAGAJGZ-IBGZPJMESA-N 341.499 5.285 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(-c2ccccc2)no1 114452543 NPQAHAMOLXLSCO-HNNXBMFYSA-N 349.459 5.348 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2ccc(OC)cc2)o1)c1ccccc1 180037590 FYZJOPHJFFGGKA-HXUWFJFHSA-N 348.446 5.147 30 20 EKED CC(C)C[C@@]1(C)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458857040 ZJDNMRJKYRGDBA-PZJWPPBQSA-N 341.499 5.032 30 20 EKED N#CCCCC(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1 461927408 IABYKJAJJKUGLR-UHFFFAOYSA-N 330.840 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc2cc(C)c(C)cc12 476132730 FEAYDLFPZGTZDI-UHFFFAOYSA-N 347.458 6.154 30 20 EKED C[C@H](CCCC(F)(F)F)NCc1cc(C(F)(F)F)ccc1F 494849294 WLQNWQSEMPRDLB-SECBINFHSA-N 331.275 5.055 30 20 EKED C=CCc1cc(CN[C@H](CC(C)C)c2ccccc2)cc(OC)c1O 500258251 RQKLBJBUHKKOJP-HXUWFJFHSA-N 339.479 5.006 30 20 EKED C[C@@H]1CCC[C@@H](OCc2cccc(NCc3ccc(C#N)s3)c2)C1 552554249 BFTWLKZPXMXLBF-CRAIPNDOSA-N 340.492 5.327 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Cl 559862232 BYIJLYWTTMZEOO-LIRRHRJNSA-N 330.834 5.565 30 20 EKED Cc1cccc([C@@H](C)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 571936344 VHRBFSGKULVZHQ-MRXNPFEDSA-N 329.403 5.227 30 20 EKED N#Cc1ccc(CNCc2ccc3ccccc3c2)c(C(F)(F)F)c1 589310564 KRWSTXRSBCZQRC-UHFFFAOYSA-N 340.348 5.020 30 20 EKED CC(=NNc1ccccc1F)c1sc(-c2ccc(C)cc2)nc1C 727650912 BQCYKFAXYQRNPJ-UHFFFAOYSA-N 339.439 5.402 30 20 EKED O=C1/C(=C\c2csc(-c3cccs3)n2)CCc2sccc21 728440497 PBMAPEVYNWTPHQ-NTMALXAHSA-N 329.471 5.146 30 20 EKED Clc1cc(Cl)cc(NN=Cc2conc2Cc2ccccc2)c1 814912671 AVTVDYOPWHYXFN-UHFFFAOYSA-N 346.217 5.018 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C)[C@@H]1CCC[C@H]1C#N 878545848 OPDKSUIATNKDEX-WMLDXEAASA-N 345.512 5.042 30 20 EKED CCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915086467 LBNUCEOHMYBECL-QFIPXVFZSA-N 340.426 5.157 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(N=Cc2ccccc2O)cc1Cl 920942261 USDQPAHKUFYGJT-IBGZPJMESA-N 346.817 5.452 30 20 EKED CC[C@H](C)c1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 1776697999 BXFURCPMUQGJFV-QMGNKTGZSA-N 334.415 5.038 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cccc(C(F)(F)F)c1 69130163 HPWBCDKJMLAPTC-VQHVLOKHSA-N 327.305 5.150 30 20 EKED C[C@@H](Nc1ccc(Cl)c(Br)c1)c1cccc(C#N)c1 94667966 LWFTXSWBLWZTOY-SNVBAGLBSA-N 335.632 5.147 30 20 EKED C[C@H](Nc1snc(Cl)c1C#N)c1cccc(Cl)c1Cl 301301801 VNSLXSIFCCOPTF-LURJTMIESA-N 332.643 5.148 30 20 EKED Cc1sc2ncnc(S[C@H](C)c3ccc(C#N)cc3)c2c1C 303741431 ZFPQGUPXAFCHPY-GFCCVEGCSA-N 325.462 5.033 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccc(Br)cc1 444587624 AHDSZQMRWGTUOE-KRWDZBQOSA-N 349.316 5.306 30 20 EKED CC[C@H](N[C@H](c1ccc(F)cc1F)C(C)C)c1ccc(C#N)cc1 447589044 WKSHSTLEJBBNFK-PMACEKPBSA-N 328.406 5.274 30 20 EKED N#CCCCCN[C@@H](CCc1ccccc1Cl)c1ccccc1 482461464 SFEBKVLXJQFAPW-FQEVSTJZSA-N 326.871 5.297 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nccc2ccccc12 483191646 FTVOIXGCIOYULZ-QFIPXVFZSA-N 348.405 5.392 30 20 EKED C[C@@H](Oc1ccc(C#N)cc1F)c1ncc(-c2ccc(Cl)cc2)o1 507828868 HZFLTMDMNVKFLJ-LLVKDONJSA-N 342.757 5.146 30 20 EKED CCc1ccc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 525044332 OGSCKVDNZRACNU-UHFFFAOYSA-N 346.455 5.030 30 20 EKED C[C@@H](Sc1cccc(Cl)c1C#N)c1nc(-c2cccs2)no1 543958897 KNAQXQXOXQLJNA-SECBINFHSA-N 347.852 5.176 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 559857171 CJMWNTPFACYYAE-MAUKXSAKSA-N 344.405 5.374 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2cccc(F)c2o1 607771123 WCLYSEMAQBBQMG-UHFFFAOYSA-N 349.814 5.115 30 20 EKED CCCCC[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1 728134975 SAIIPKCGKKKGRW-NRFANRHFSA-N 349.478 5.021 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCCCCC3)cc2)c1 731400786 UJLFPUCLNNZLGO-UHFFFAOYSA-N 349.434 5.149 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(Cl)cc2)c1 743476021 BDSLKYFNDNDGQS-AZUAARDMSA-N 342.870 5.262 30 20 EKED O=C(/C=C/c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1Cl 747003471 HSRDESSLLJUEKY-RMKNXTFCSA-N 343.213 5.075 30 20 EKED N#Cc1csc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)c1 748441263 VYLBZDQIQKLFQC-KPKJPENVSA-N 347.411 5.147 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cc(C#N)cs2)cc1 748441328 XSIZAZWCIORTIW-KHPPLWFESA-N 345.423 5.191 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)NCC3(CC#N)CC3)sc2c1 797563907 HFCUAYSZAQSASR-UHFFFAOYSA-N 346.883 5.102 30 20 EKED N#CCCC[C@@H](NC(=S)Nc1ccccc1Cl)c1ccccc1 814211091 ZTYPEXRUDDLSLA-MRXNPFEDSA-N 343.883 5.062 30 20 EKED CC(=Nn1c2ccccc2c2ccccc21)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776113171 ZZDNMBOISFHBKX-QAPCUYQASA-N 348.446 5.156 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1oc2ccc(F)cc2c1C 1776786754 JUWPPLFBANRYKJ-MRXNPFEDSA-N 349.446 5.174 30 20 EKED C=C(C)CN(CC)C(=O)c1sc2cc(Cl)ccc2c1Cl 60624844 SVWYAZAEKDXVJN-UHFFFAOYSA-N 328.264 5.246 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)c(Cl)c2)c1 113952471 VBEHJFCJNTYGBF-CZUORRHYSA-N 346.833 5.011 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)Nc1ccccc1SCCC#N 116021993 JKUBOXUPZXJJOE-INIZCTEOSA-N 338.476 5.133 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2cccs2)cc1)c1ccc(C#N)cc1 174026069 QILXPXWIPGFETL-AWEZNQCLSA-N 347.443 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CCSCC 191462374 PDEWCFYRUKEKQF-OAHLLOKOSA-N 334.529 5.192 30 20 EKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)s1 214129302 JBFRWGQLXIAMCC-UTCJRWHESA-N 346.757 5.239 30 20 EKED C[C@H]1Cc2c(sc(NC(=O)c3ccoc3C3CC3)c2C#N)[C@H](C)C1 410965360 BOSPKFQWHJYKGZ-GHMZBOCLSA-N 340.448 5.028 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc(O)c1 442875948 UQFKMCWUWAATOI-SJORKVTESA-N 342.442 5.343 30 20 EKED Cc1cc(C)c(-c2nnc(SCc3ccc(C#N)c(C)c3)o2)c(C)c1 447291979 IJXJAOIYXZLSMF-UHFFFAOYSA-N 349.459 5.134 30 20 EKED CC(C)CN(C(=O)Cc1csc2ccccc12)c1ccc(C#N)cc1 480128308 YZTRBTZNORDORM-UHFFFAOYSA-N 348.471 5.005 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2ccccn2)cc1 485176509 KHCHOGFFEPKNLP-UHFFFAOYSA-N 346.455 5.279 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1cccs1)C1CC1 505051912 NHPIOXMWUUNJNO-UHFFFAOYSA-N 326.465 5.063 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2cccc(OC)c21 506046511 YLSMVOLZMVHNEF-LJQANCHMSA-N 349.474 5.216 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c1 510995081 HZSFNEQGTPVNIO-AWEZNQCLSA-N 344.842 5.130 30 20 EKED C[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 514231933 FMCRQRQXSQXUSA-INIZCTEOSA-N 330.406 5.138 30 20 EKED CCc1cc(C#N)c(NC(=O)C[C@H](CC)c2ccc(C)cc2)s1 523102225 XXJVBOIJRBYVMQ-AWEZNQCLSA-N 326.465 5.013 30 20 EKED CCCC[C@H](CC)CC(=O)Nc1ccccc1SC[C@H](C)C#N 524210465 DBYOSFABRIDQCU-CVEARBPZSA-N 332.513 5.483 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 539047621 UVZGTIPLFWCBLN-LAUBAEHRSA-N 338.520 5.883 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 539047856 XTWAXAJTBHCHQE-UGSOOPFHSA-N 333.262 5.689 30 20 EKED C=CCC[C@H](N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 560545427 VLQUSINXSXGNDY-DLBZAZTESA-N 329.415 5.318 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc(Cl)ccc1Cl 562104611 UWDMBQBDYKCQQI-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED N#Cc1cc(NCc2ncc(-c3ccc(Cl)cc3)o2)ccc1Cl 585725598 YCMXSMCDMBKPAP-UHFFFAOYSA-N 344.201 5.132 30 20 EKED CC1CCC(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 609435162 UBZJCUSLPDPIJO-PCKAHOCUSA-N 345.512 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2cc(F)ccc21 613901111 NZKVKKLBAHRRJD-FQEVSTJZSA-N 337.438 5.346 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2ccc(F)cc2)s1 618743053 VGTOLIULBINVIP-HXUWFJFHSA-N 348.446 5.203 30 20 EKED Cc1ccccc1-c1nnc(S[C@@H](C#N)c2ccc(Cl)cc2)o1 619863838 JDILLZNKWYFCCL-HNNXBMFYSA-N 341.823 5.055 30 20 EKED COc1ccc2cc(C(=O)/C=C\c3nccc4ccccc34)ccc2c1 740764591 YZSJHFPJJSOJAJ-KHPPLWFESA-N 339.394 5.293 30 20 EKED CC(C)Oc1ccccc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741467948 BFVGMNOGOYXVBF-KHPPLWFESA-N 343.426 5.432 30 20 EKED COCc1ccc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)cc1 741847365 FVKCAPIAJUBOMM-SOFGYWHQSA-N 326.779 5.129 30 20 EKED CSc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990739 XMTICOYMYZLXFJ-NYYWCZLTSA-N 331.440 5.367 30 20 EKED N#Cc1ccc(/C=C(/Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764431059 ABLLJKOHFLYEHI-NTUHNPAUSA-N 348.711 5.455 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1ccc(-c2ccncc2)cc1 772806232 LBFRJLABSPTJHY-KTKRTIGZSA-N 336.394 5.193 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3C=CCCC3)n2)cc1 778607169 SHEQHZSGFXXCDP-DOTOQJQBSA-N 336.460 5.041 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1sc2ccccc2c1Cl 779741823 DQTAGIQYQIVDQW-LBPRGKRZSA-N 342.851 5.458 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792096528 PKPDTDQCUHGLBD-RXXLQFRUSA-N 346.817 5.168 30 20 EKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1c(F)cccc1Cl 809159634 SWBDGYBAGBMMNK-XQRVVYSFSA-N 330.573 5.077 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccn2)c(C)c1 819841764 FQHXMMOTFJPFLD-ACCUITESSA-N 343.426 5.174 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1C 916850005 XSOXAPCRZRIFCF-YBNHLDJLSA-N 340.426 5.050 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(F)c2ccccc12 1776784244 XKXPZXPYMNXBMM-QGZVFWFLSA-N 345.458 5.272 30 20 EKED Cc1cc(C)c(C#N)c(SCc2csc(-c3cccs3)n2)n1 4365232 WLOZDCXDSIITAD-UHFFFAOYSA-N 343.502 5.047 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 177764687 JECWQHKVXNATNN-HOCLYGCPSA-N 326.465 5.027 30 20 EKED CC[C@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1Cl 180557402 KDZJSHUPZSOFMI-SFHVURJKSA-N 349.261 5.137 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](CCC)c1ccccc1 195548128 ZROLZXFEZCLPPQ-HXUWFJFHSA-N 340.442 5.065 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2sc3ccccc3c2Cl)cn1 214918400 MIBNBDIGJGABTQ-FPLPWBNLSA-N 330.840 5.228 30 20 EKED C=CCC1(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)CCCC1 410467737 LIKABCJPVCWKGR-UHFFFAOYSA-N 342.483 5.055 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2cccc(C#N)c2)n1 442911009 DPASEZSYSMFHIS-NSHDSACASA-N 347.365 5.005 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 449444429 BNKAALYNLRMOHG-DHXZDTOLSA-N 336.401 5.013 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H]3CC[C@@H](CC#N)C3)s2)cc1 453290639 KVYVNGUHBGLDIG-ZVZYQTTQSA-N 339.508 5.160 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466230949 APKZMLSRRUFNIG-IAGOWNOFSA-N 332.447 5.005 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1CCCCCC1 475569811 QSHHONXNSFPGMS-UHFFFAOYSA-N 328.500 5.725 30 20 EKED C[C@H](Nc1ccc(Cl)cc1C#N)c1nc2ccccc2n1C(F)F 486454263 YMBNQWJQPLTQIL-JTQLQIEISA-N 346.768 5.130 30 20 EKED Cc1cc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)ccc1C#N 488120045 DBNVNEBQBFLEHU-UHFFFAOYSA-N 348.396 5.024 30 20 EKED CC(C)(C)c1cnc(CSc2ccc(C#N)c(C(F)(F)F)c2)o1 541073971 IWIHKNBGVSLULS-UHFFFAOYSA-N 340.370 5.155 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 556203277 JBQLJQSEEAQBLB-KUHUBIRLSA-N 347.289 6.079 30 20 EKED Cc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3ccc(F)cc3)n1)C2 730949728 ZZRRZFVZQJJQQB-XNTDXEJSSA-N 335.403 5.080 30 20 EKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)Cc2cc(Cl)ccc21 742438285 VRHJVLHHKVLUSF-UVTDQMKNSA-N 337.831 5.286 30 20 EKED CC(C)(C#N)CCCCN1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 769788646 KGLJMNQBRAUVDK-MRXNPFEDSA-N 338.417 5.215 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2cccnc2)C2CC2)cc1 773119291 ODJNUMNFBPNLEQ-YWZLYKJASA-N 342.870 5.015 30 20 EKED O=C1/C(=C\c2cnc(-c3ccco3)s2)[C@H]2CCCc3cccc1c32 789143691 QFZARKTYQQVWSR-KWZJRMENSA-N 333.412 5.103 30 20 EKED CSc1ccc(C(=O)/C=C/c2cn(C(C)C)nc2C)c(Cl)c1 798370715 VPRBPUFWLBZERA-VMPITWQZSA-N 334.872 5.044 30 20 EKED CCCCOc1ccc(/C=C/C(=O)c2cc(F)ccc2F)cc1OC 916134930 UESQCFZCYZQSDE-WEVVVXLNSA-N 346.373 5.048 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1 1776805944 GZZONPJBHMEKKZ-LTNDZONTSA-N 334.415 5.023 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1c(C)cccc1C(C)C 62373512 OOYCSSYCOBPBBE-UHFFFAOYSA-N 336.479 5.381 30 20 EKED N#CCCCOc1cccc(NCc2cccc(-c3cccnc3)c2)c1 131496868 XPRIGGHKENNVIQ-UHFFFAOYSA-N 343.430 5.043 30 20 EKED CC(C)Oc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1Cl 193008138 ZYDYDUZFFANWSZ-AWEZNQCLSA-N 344.842 5.203 30 20 EKED C[C@@H](CC1CCCCC1)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431908733 GBYAXMSJEWFDSQ-PXNSSMCTSA-N 341.499 5.080 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccccc1Oc1ccccc1Cl 469025139 SJTLQOZUOHOXRD-UHFFFAOYSA-N 328.799 5.011 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(CSC)cc1 485321728 RAUPRCIOYWGWKL-UHFFFAOYSA-N 332.513 5.150 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 512534812 VTNPVVNDKXMMSU-MRXNPFEDSA-N 349.434 5.147 30 20 EKED C=C[C@H](CC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccccc1 534623906 SPMMIQHVVYYJGD-DLBZAZTESA-N 325.427 5.095 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1 544577692 HOANKFZBDNGRGH-JKSUJKDBSA-N 332.472 5.699 30 20 EKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3CC#N)c(F)c2)cc1 559251140 HLHUPMFBEXGJQM-UHFFFAOYSA-N 344.389 5.120 30 20 EKED COc1cc([C@@H](C)Nc2ccc(C#N)cc2)ccc1OC1CCCC1 603861166 QCOFOMXLFSWEKD-OAHLLOKOSA-N 336.435 5.061 30 20 EKED COc1cc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)ccc1OC(C)C 609500245 XVRJEZMSRFLFDS-CYBMUJFWSA-N 344.842 5.181 30 20 EKED CC(C)C[C@@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727664622 XLNMAXHSWJPMAA-DYESRHJHSA-N 334.463 5.353 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1ccc(F)c(Cl)c1 735230356 JUHLRMCBDKSCAR-UHFFFAOYSA-N 342.222 5.327 30 20 EKED COc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)c1 741468735 HJRYHGNSWJKQQM-XNTDXEJSSA-N 344.410 5.267 30 20 EKED CCOc1cccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741474295 WZKPRINMOYKNKR-MDZDMXLPSA-N 329.399 5.043 30 20 EKED N#CCSCCCSc1nc2cc(C(F)(F)F)ccc2s1 745974331 OPAHPHKBXXYUFV-UHFFFAOYSA-N 348.440 5.054 30 20 EKED CCCCOc1ccc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)cc1 746346253 NSHGNNROGKUCDI-RAXLEYEMSA-N 340.467 5.156 30 20 EKED C[C@H](NCc1ccc(-c2cccs2)cc1)c1ccc(OCC#N)cc1 769785429 BKRZONPXXZDVIQ-INIZCTEOSA-N 348.471 5.168 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1cccc3cnccc13)C2=O 782889191 FFVUQEUYDOOOIZ-WJDWOHSUSA-N 331.440 5.169 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1ccc(C(F)(F)F)cc1 782889756 LUKZFDIPSWHFTM-TWGQIWQCSA-N 327.305 5.150 30 20 EKED O=C(/C=C\c1cocn1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 790216354 WZUNDVVHUCYGPL-WAYWQWQTSA-N 349.333 5.318 30 20 EKED CC(CCCCCCC(=O)O)=NNc1ccc(Cl)c(Cl)c1 1776032676 IXGCMXDCNPZCON-UHFFFAOYSA-N 331.243 5.206 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776697576 ISSJYMFRSMQEKE-IUZNHRGFSA-N 348.398 5.541 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2ccc(F)cc2)n1 24284676 AGVDZYMXQSWHOL-SNVBAGLBSA-N 340.345 5.273 30 20 EKED CC(C)(CCC#N)CNc1ccc(N2CCc3sccc3C2)cc1 127582204 GWXZRSBQRCIZLZ-UHFFFAOYSA-N 339.508 5.053 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(-c2cccnc2)cc1 181322691 NSAMOIHJWIHEMY-SJORKVTESA-N 327.431 5.032 30 20 EKED N#Cc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1 303177060 XQXDGFOGBGPWER-OQLLNIDSSA-N 341.382 5.085 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccoc3C3CC3)n2)cc1 342637158 MISSXJDIGAVWJV-INIZCTEOSA-N 348.427 5.079 30 20 EKED CC(C)[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 431767875 BLJHKTOGJLBGFJ-NHCUHLMSSA-N 349.478 5.118 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 447509272 FFAVXWWDEUNVJJ-FZKQIMNGSA-N 332.369 5.379 30 20 EKED CC[C@H](N[C@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(C#N)cc1 447586623 OLZYLOGYYCIAHH-ACJLOTCBSA-N 348.368 5.259 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2oc(C)nc12 471155364 AITDRQQDIBYATO-UHFFFAOYSA-N 334.419 5.240 30 20 EKED N#Cc1ccc(OCc2nc(-c3ccccc3Cl)cs2)c(F)c1 478923606 IACPUQHZGNXTJJ-UHFFFAOYSA-N 344.798 5.053 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1ccccc1 487349331 BDHHVGLLIOQQBM-WJMWBRGCSA-N 338.495 5.144 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 503132416 CRWNXSSMDNSDHK-SFTDATJTSA-N 347.483 5.220 30 20 EKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc2ccccc12 515770069 PGTUZABRKJDABN-UHFFFAOYSA-N 346.430 5.069 30 20 EKED CC(C)[C@@H](NCc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 533360060 BYYCTBYFWFEADY-GOSISDBHSA-N 332.369 5.064 30 20 EKED CC(C)OCc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 538828430 FWLDVQBDFQSNJY-UHFFFAOYSA-N 348.490 5.428 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 540151218 PADFESCRGZTEPZ-SWLSCSKDSA-N 340.414 5.520 30 20 EKED C=CCC[C@H](NCc1cc(C(C)=O)ccc1OCC)c1ccccc1 540457566 FRKMEVNVGRQALC-NRFANRHFSA-N 337.463 5.085 30 20 EKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cccc2ccccc12 609669450 MTHUOHGAYXQXTK-GFCCVEGCSA-N 341.336 5.298 30 20 EKED CC[C@H](C)n1ncc(N[C@@H]2CCCc3cc(C#N)ccc32)c1C1CC1 611477229 ABDGWFKYYCJNTD-IFXJQAMLSA-N 334.467 5.093 30 20 EKED C[C@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cccc(C#N)c1 613667601 QJZXHPNHYICFNE-NSHDSACASA-N 340.295 5.385 30 20 EKED N#C[C@H](C(=O)/C=C/C1CCCCC1)c1nc2cc(Cl)ccc2s1 735593343 KDKPMAWKEVANLX-IZPAUZPXSA-N 344.867 5.262 30 20 EKED CC(C)(C)CCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 740434942 KBTUEYSPFMIWCG-FQEVSTJZSA-N 349.478 5.290 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 744115392 JRTYRDHIWBRRAE-OCCSQVGLSA-N 332.444 5.218 30 20 EKED Cc1cc(C)c(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1C 753135499 RISOAEQUIFQICC-PLNGDYQASA-N 334.444 5.026 30 20 EKED CCc1noc(C)c1C(C)=NNc1c(Cl)cc(Cl)cc1Cl 769796300 WCJOBPBLFBGWFZ-UHFFFAOYSA-N 346.645 5.342 30 20 EKED CSc1ccc(C(=O)/C=C\c2ccc3cnccc3c2)c(Cl)c1 782351731 NQIDSRRDJSPWCJ-CLTKARDFSA-N 339.847 5.506 30 20 EKED CCOc1cc(/C=C/C(=O)c2csc(Cl)c2)cc(Cl)c1O 787185846 JMTFSHDVWSRBFR-ONEGZZNKSA-N 343.231 5.055 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1c1ccccc1 808281731 LOKULOUDXONEQX-ZWKOTPCHSA-N 344.439 5.029 30 20 EKED COc1ccc2oc(/C=C\C(=O)c3c(F)cccc3Cl)cc2c1 809159762 WAYYGAZTVURQQM-ALCCZGGFSA-N 330.742 5.130 30 20 EKED CC(C)(C)c1cnc(C=NOCc2ccc(C(F)(F)F)cc2)s1 814882284 MFQTWGAINPIQDV-UHFFFAOYSA-N 342.386 5.010 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1 915985500 MIMYZLTVUWTSPA-ZHACJKMWSA-N 334.444 5.225 30 20 EKED CSc1ccc(C(=O)/C=C\c2ccc(Br)s2)cc1 916133497 SSRYBWYARYBZSM-VURMDHGXSA-N 339.279 5.129 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1 1776038051 POLHIFRSLOCQJC-KDOFPFPSSA-N 330.472 5.415 30 20 EKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cccc(C(=O)O)c2)c1 1777461784 SZELYKNEKJTLQL-OUKQBFOZSA-N 342.394 5.256 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)C1CCC(C(F)(F)F)CC1 354559902 CEQBXFSABDCECI-VSVYTNTFSA-N 338.417 5.378 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1COC(C)(C)C 410365936 PEKPJFOMXIMCJA-UHFFFAOYSA-N 337.463 5.373 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1cccc(OCc2ccccc2)c1 442866051 HIXCVRGOLRMMTF-XEVCZEQESA-N 348.490 5.246 30 20 EKED Cc1nc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c(Cl)cc1C#N 461966746 QRPXHRSBWBHRHV-ZDUSSCGKSA-N 348.837 5.150 30 20 EKED CC[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cccc(Cl)c1 463007716 GXWNROYOLNBTRX-CYBMUJFWSA-N 339.748 5.189 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC)c1cccc(Cl)c1 500423408 SUXUFLOKGVEWHT-LJQANCHMSA-N 342.870 5.189 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 520197738 NEQFERZEXWUKPV-INIZCTEOSA-N 349.434 5.004 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H](c2nc3ccccc3s2)C1 533013019 APJPWITWFLNMGH-YJBOKZPZSA-N 347.487 5.109 30 20 EKED Cc1c(Cl)cnc(N[C@@H](C)c2ccc(-c3ccncc3)cc2)c1C#N 544067985 XVLHJBDXJWPTKF-AWEZNQCLSA-N 348.837 5.150 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1cccc(F)c1 682803826 SMZWGIUFGXCHQQ-UHFFFAOYSA-N 341.426 5.085 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cc(C)ccc2C)c1 727284619 JIDSYTQCDHYKMH-UHFFFAOYSA-N 326.465 5.067 30 20 EKED Cc1ccccc1N(C(=S)Nc1ccc(C#N)c(Cl)c1)C(C)C 729821858 ZTFPINLZDMUTBV-UHFFFAOYSA-N 343.883 5.132 30 20 EKED Cc1cccc(NC(=S)Nc2ccccc2SC[C@H](C)C#N)c1 730954889 NMLIXQGBWNHXCD-CQSZACIVSA-N 341.505 5.056 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 735214224 NYDYYGNONILOOM-UKRRQHHQSA-N 346.471 5.608 30 20 EKED CCCCN(C(=S)Nc1ccccc1C#N)[C@H](C)c1ccccc1 745689253 WOWWRKUEYWLZDU-MRXNPFEDSA-N 337.492 5.118 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccccc1C(F)(F)F 749885831 GIOYXMSZYJGXLP-ZHACJKMWSA-N 343.304 5.257 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1nc2ccccc2s1 756519434 OJBLXMHIHOXFSW-CAOSSQGBSA-N 338.476 5.079 30 20 EKED Cc1nc(-c2cccs2)sc1C(=O)OCCCCC(C)(C)C#N 768522584 HREXFEOGPSAXFF-UHFFFAOYSA-N 348.493 5.057 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccccc1 774266879 RZEHIYNMBHJGDN-YVEFUNNKSA-N 334.246 5.114 30 20 EKED CC[C@@H](Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(C#N)cc1 774378426 ABZQUFYBLCKBRU-BULFRSBZSA-N 331.463 5.110 30 20 EKED O=C(/C=C\c1scnc1C1CC1)c1ccc(SC(F)F)cc1 782324524 CYCWJYOYNMCIIN-FPLPWBNLSA-N 337.416 5.231 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1cc(Cl)sc1Cl 782887274 KKWRNSVYAOSSJR-PLNGDYQASA-N 334.227 5.499 30 20 EKED N#CCCCCCC(=O)Nc1ccc2cc(Br)ccc2c1 805190447 GKUWGYIYLQTKHP-UHFFFAOYSA-N 345.240 5.015 30 20 EKED CC(C)(CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 815010962 UZKAPIBCEXCSTE-HXUWFJFHSA-N 332.447 5.107 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(C)CC(F)(F)C1 879352331 ODMXWQXHCVSNHD-UHFFFAOYSA-N 336.426 5.095 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(C(=O)N2CCCC2)cc1 890888340 AUYNTXGOOMEABH-UHFFFAOYSA-N 344.499 5.002 30 20 EKED CC(C)(C#N)CCCSCc1coc(-c2c(F)cccc2F)n1 155763888 NZRAZPCBRWVVNG-UHFFFAOYSA-N 336.407 5.183 30 20 EKED C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 463070931 PMJTWRDTCSTTMN-MRXNPFEDSA-N 342.398 5.093 30 20 EKED C[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccc(C#N)cc1 474478447 LQNYFACSYFDPTD-AVRGHOLYSA-N 330.884 5.116 30 20 EKED N#CCCCCN[C@@H](Cc1ccc(F)cc1)c1ccccc1Cl 482442393 YHGVZPPDTKLFTD-IBGZPJMESA-N 330.834 5.046 30 20 EKED C=CCN(C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 484259152 VSWYORUEFLUXDS-IRXDYDNUSA-N 345.364 5.028 30 20 EKED C=C[C@H](CC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1)c1ccccc1 495359598 SMKZFZIYMBVFJW-GCJKJVERSA-N 331.459 5.100 30 20 EKED C=CCC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 498949637 WFZIKEQLTOWYPG-INIZCTEOSA-N 332.447 5.005 30 20 EKED CCN(C(=O)c1ccc(C(C)C)cc1)c1ccc(C#N)c(Cl)c1 535878463 SWDPHZIDYPZPOH-UHFFFAOYSA-N 326.827 5.002 30 20 EKED CSc1cccc(NCc2cccc(OCCCC#N)c2)c1C 538124140 BLPLUNBWLGHIER-UHFFFAOYSA-N 326.465 5.012 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)o1 540627686 DFIFNPKLAFABQZ-GOTSBHOMSA-N 342.442 5.102 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(SCC(F)F)cc1 554074780 FWEXEVAOYWCHKX-CYBMUJFWSA-N 326.456 5.024 30 20 EKED CC[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1F 618801326 ACILSMJOUCLLGB-ZWKOTPCHSA-N 328.818 5.079 30 20 EKED CCCCCCCCC(=O)N[C@@H](c1ccccc1)C1CCOCC1 734349666 IDQUBDYODINXCH-NRFANRHFSA-N 331.500 5.021 30 20 EKED CCCCCCCCOCC(=O)Nc1c(C)cc(C)cc1Cl 741516592 YIKQFKFGMXGRMI-UHFFFAOYSA-N 325.880 5.272 30 20 EKED Cc1c(C(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)oc2ccccc12 747138453 DMDNXSBAQSFALY-VQHVLOKHSA-N 341.750 5.199 30 20 EKED N#Cc1cccc(COc2cccc(/C=C\C(=O)c3ccsc3)c2)c1 749103848 DDBOCGWMRCENPK-FPLPWBNLSA-N 345.423 5.095 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3c[nH]c4ccccc34)co2)cc1 749892185 SCNVPIMOBZVLTB-KHPPLWFESA-N 328.371 5.027 30 20 EKED CCCc1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1 753143338 WQTIIKVPSYUHKD-VAWYXSNFSA-N 334.444 5.054 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 756227073 NVCNMJCOXKIKKL-XJKSGUPXSA-N 334.444 5.300 30 20 EKED O=[N+]([O-])c1cc(Cl)ccc1NN=CC1CCC(C(F)(F)F)CC1 767371465 ZKXLMCIUMQXTIE-UHFFFAOYSA-N 349.740 5.015 30 20 EKED C[C@@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc(C#N)cc1F 781423777 YNSMMKJEJYJXTR-CYBMUJFWSA-N 343.833 5.124 30 20 EKED CCCCCCCC(=NNc1ccc(C(=O)O)cc1)c1ccccc1 1776012003 NGCOBAPFJWQVQP-UHFFFAOYSA-N 338.451 5.562 30 20 EKED CCCCCCc1ccc(C(C)=NNc2ccccc2C(=O)O)cc1 1776030017 FRGNCCIRAWGNCZ-UHFFFAOYSA-N 338.451 5.344 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776697865 SXFNLGKXOOCJOQ-OCHBPSSRSA-N 342.822 5.448 30 20 EKED C[C@H](Sc1nnc(-c2ccc(Cl)s2)o1)c1ccc(C#N)cc1 127069461 LEXGTSQWZVHKPG-VIFPVBQESA-N 347.852 5.176 30 20 EKED C/N=C(/O)c1ccc(C)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329006949 NEKQCQZFVVAQTG-USXIJHARSA-N 328.456 5.124 30 20 EKED OC1=Nc2cc(Cl)cc(N=C(O)[C@H]3C[C@@H]3C3CCCCC3)c2OC1 329205144 DHQCAEGWOAOUMX-OLZOCXBDSA-N 348.830 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)c1ccc(F)cc1 415512900 CWKPCYANMXWVPX-IBGZPJMESA-N 339.454 5.810 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)[C@@]1(C#N)CC12CCCC2 449999176 KYFRSMVCWJPKEM-FQEVSTJZSA-N 342.508 5.049 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)C[C@H](CC#N)c1ccccc1 475364944 CDQWYBHLCFLRDT-SFTDATJTSA-N 334.463 5.074 30 20 EKED CC(C)CN(C(=O)c1cc2ccccc2s1)c1ccc(C#N)cc1 499330994 WWTHNIYZARLQNZ-UHFFFAOYSA-N 334.444 5.076 30 20 EKED Cc1ccc(-c2ccc(CN(CCC#N)Cc3ccccn3)s2)cc1 513737267 YVMNJXZCOGBWSA-UHFFFAOYSA-N 347.487 5.034 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 539047854 XTWAXAJTBHCHQE-SCLBCKFNSA-N 333.262 5.689 30 20 EKED CC[C@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(Cl)c1F 563464553 ZEZSTVUITCANSO-KRWDZBQOSA-N 328.818 5.081 30 20 EKED C=C[C@](C)(CC)c1nc([C@H](CCCOC)c2ccc(Cl)cc2)no1 583050686 CPRWPWIKKLAODZ-VQIMIIECSA-N 348.874 5.135 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)CCC(C)(C)C 609929569 FDKDSKHAJCATJJ-CABCVRRESA-N 347.528 5.417 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619755909 YJOCEKVMFQVBAI-LLVKDONJSA-N 347.915 5.125 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 744037837 FJBJJGKPZQUHQW-KGLIPLIRSA-N 347.409 5.214 30 20 EKED Cc1ccccc1[C@H](OC(=O)c1cccc(CC#N)c1)c1cccs1 748505793 SQPFKXSVZSZZIC-FQEVSTJZSA-N 347.439 5.069 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(-c2cccs2)cc1)c1ccncc1 766019555 MNSUEZDOTADXNI-JXFKEZNVSA-N 334.488 5.778 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1cc(C)no1 775147065 RQVZMKDWEYCMQY-SJLPKXTDSA-N 334.504 5.423 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc2cccc(OCC)c2o1)c1ccncc1 776155805 IWLHGRUZCVJCKK-CRAIPNDOSA-N 336.435 5.195 30 20 EKED CC(C)c1cnc(CNc2ccc(Oc3ccccc3)c(C#N)c2)o1 777616931 MDROLQNZDDBHDE-UHFFFAOYSA-N 333.391 5.074 30 20 EKED COc1c(C)cc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1Cl 796990656 RMORCDQMMNRHMF-GFCCVEGCSA-N 349.261 5.033 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)[C@H](C)c1ccccc1C(F)(F)F 799726356 OASQNDJSWFUWOK-QRNKSROTSA-N 338.417 5.117 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(F)c3ccccc23)cc1 808437908 YGILSBOXLSXKGT-JKSUJKDBSA-N 348.421 5.121 30 20 EKED CCCCCCCC(=O)N1CCC(c2noc3cc(F)ccc23)CC1 811603254 BXKHHGOIOIZYQT-UHFFFAOYSA-N 346.446 5.033 30 20 EKED CCSCc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1 834899372 KAJNPESVVYTULO-HNNXBMFYSA-N 326.465 5.015 30 20 EKED O=C(/C=C\c1cn(C2CCCC2)nc1-c1ccccn1)c1cccs1 840712270 IDSRZHBMTIYAHN-KHPPLWFESA-N 349.459 5.018 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c(C)c1 1776132850 HRDLMQWGZQDLDA-DHZHZOJOSA-N 346.382 5.158 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc2sccc2c1 1776784798 XYXNFNVPXHRAGC-KRWDZBQOSA-N 333.497 5.195 30 20 EKED O=C(/C(=C/c1ccsc1)c1nc2ccccc2s1)c1ccccc1 7745107 PUHKENJWQJIHDV-VBKFSLOCSA-N 347.464 5.781 30 20 EKED N#Cc1ccc(OCc2csc(-c3ccc(F)cc3)n2)c(Cl)c1 61412385 PWTXQWSXQMTQGL-UHFFFAOYSA-N 344.798 5.053 30 20 EKED C[C@H](Nc1ccc(NC(=O)C(C)(C)C#N)cc1Cl)c1ccccc1 78466866 KDHYHZKHWJDPQW-ZDUSSCGKSA-N 341.842 5.001 30 20 EKED CC(C)[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 155961660 FYLCCDUAIFVDQY-NVXWUHKLSA-N 345.512 5.123 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1coc(-c2ccccc2)n1 159560509 YBIBCZQIHOVKIH-HNNXBMFYSA-N 349.459 5.205 30 20 EKED O=C(/C=C/c1cccc(OC(F)F)c1)c1cc(Cl)sc1Cl 195741293 YWVNTBLDKHGUIY-SNAWJCMRSA-N 349.185 5.552 30 20 EKED N#CCC[C@H](Nc1ncc(C(F)(F)F)cc1Cl)c1ccccc1 301764803 CNGCGHGWDLRILX-AWEZNQCLSA-N 339.748 5.211 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1F 340449819 XBIITHAWBZESPN-OALUTQOASA-N 344.861 5.955 30 20 EKED CCOc1cccc2cc([C@H](C)NCCCCC(C)(C)C#N)oc12 444685838 PZTRJBWCAVPOJI-HNNXBMFYSA-N 328.456 5.202 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)c1cccc(CC#N)c1 462232028 ZCIJSVREUGEURA-UHFFFAOYSA-N 334.806 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(SCC)c1 476081420 SQPXISWWCSAFDK-UHFFFAOYSA-N 339.504 5.903 30 20 EKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1SC(C)C 493949830 MOWSOBFFWQHNTL-UHFFFAOYSA-N 344.480 5.043 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1CCCCC1 500739646 QCPDMEKNYNRLGH-UHFFFAOYSA-N 334.419 5.178 30 20 EKED C=C(C)COc1cccc(NCc2cnc(-c3ccsc3)s2)c1 532887063 IJEJQLRZTJKRRY-UHFFFAOYSA-N 342.489 5.439 30 20 EKED C=CCC[C@H](N[C@@H](CC)[C@H]1CCOC1)c1ccc(C(F)(F)F)cc1 540150004 CMCQVJSOJMOGAU-SZMVWBNQSA-N 341.417 5.117 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccc(F)cc2)o1)c1ccccc1 560565050 SGONJUHISBMEBZ-NRFANRHFSA-N 348.421 5.610 30 20 EKED CC(F)(F)c1ccc(-c2noc(-c3ccc(C#N)c(Cl)c3)n2)cc1 564381537 PMYPKXSZLFMBFB-UHFFFAOYSA-N 345.736 5.040 30 20 EKED CCCCOc1ccc([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 585765165 VSLSREGUSKSECR-OPAMFIHVSA-N 334.463 5.075 30 20 EKED COc1cc(C)ccc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 727264039 MJJAVQUKVMGNRQ-LUAWRHEFSA-N 335.428 5.023 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)CC(C)C)n2)cc1 727953450 BDZKYPBFGPHSKQ-NVXWUHKLSA-N 340.492 5.367 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cn1 732713934 OCYVJHHCHITLQT-ZZXKWVIFSA-N 343.641 5.320 30 20 EKED O=C1/C(=C/c2csc(-c3cccs3)n2)Cc2cc(Cl)ccc21 742438205 TZHDFZHMSBKYPI-DHZHZOJOSA-N 343.860 5.347 30 20 EKED CC(C)CC1(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)CCCC1 756274730 HXJJVGWMDMYPCT-CQSZACIVSA-N 344.455 5.218 30 20 EKED C#CCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 757791892 HXTSKMLVUIWKDW-UHFFFAOYSA-N 334.444 5.073 30 20 EKED C=CC[C@H](NCc1ccc(Oc2cccc(F)c2)cc1)c1ccncc1 767690468 NWXNGNOQAXNUIH-QFIPXVFZSA-N 348.421 5.420 30 20 EKED N#Cc1csc(CNc2ccccc2SCc2ccccc2)c1 770513581 VKMOMKIEOCENLH-UHFFFAOYSA-N 336.485 5.524 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2C[C@@H](C)c3c(C)cccc32)c1 772982280 BNIWPQKJNXQFDX-HGHGUNKESA-N 334.463 5.014 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(-c2coc(C)n2)cc1)c1ccccc1 777469298 AMFRDWMYFXMSPL-HXUWFJFHSA-N 346.430 5.339 30 20 EKED CC1CCN(c2ccc(N[C@@H](C)c3ccc(C#N)c(F)c3)cc2)CC1 777613455 NSKAHLKSJWBQFT-INIZCTEOSA-N 337.442 5.107 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CC/C=C/c2ccccc2)s1 797566293 FLBRDMYJSFLAKW-AYAUWGRQSA-N 338.476 5.110 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(F)c(Cl)c1 920067799 CXVWVWDHSWADIW-RQOWECAXSA-N 349.839 5.560 30 20 EKED CCCCCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920804766 YUPIQZZTTNUUSQ-LBPRGKRZSA-N 348.418 5.235 30 20 EKED Cc1c(NN=C2CCC[C@@H](c3ccccc3)CC2)cccc1C(=O)O 1776088767 HJEMADDMUYQCJZ-QGZVFWFLSA-N 336.435 5.209 30 20 EKED O=C(O)c1ccc(C=Nn2c3ccccc3c3ccccc32)c(Cl)c1 1776112735 ITWBKZFJWIOZFV-UHFFFAOYSA-N 348.789 5.028 30 20 EKED CCCCCCC[C@@H](C)CN=c1c(C(=O)O)c[nH]c2c(C)cccc12 1776782436 ZSFVHVOTQNEQCC-OAHLLOKOSA-N 342.483 5.072 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 15710470 NIXZJNRVGSRVOK-UHFFFAOYSA-N 348.789 5.256 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)s1 125561853 YRMMTEQYPJZQIC-VOTSOKGWSA-N 334.444 5.225 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])c(C)s1 189881933 NQPMTGMVSAWZAN-UHFFFAOYSA-N 344.436 5.069 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 303747527 DLCBRHAFHVHFCU-UHFFFAOYSA-N 346.540 5.850 30 20 EKED Cc1nc(C2CC2)oc1/C(O)=N/[C@@H](c1ccccc1F)C1CCCC1 329510695 KESCNNKFMSKNSW-QGZVFWFLSA-N 342.414 5.236 30 20 EKED CC(O)=Nc1ccc(F)c(/C(O)=N/[C@@H]2CCCCC23CCCC3)c1 329633701 SPXNRLKJEBXTQW-QGZVFWFLSA-N 332.419 5.241 30 20 EKED CC[C@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1 447533647 YBRCSWNDKKAGGQ-ZWKOTPCHSA-N 332.369 5.293 30 20 EKED C[C@H](SCc1ccc(F)cc1C#N)c1ncc(-c2ccccc2)o1 471418848 LSODGBPJVWWVDU-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC=C)Cc1ccccc1 475554706 JFYYSXRXFAMIRK-UHFFFAOYSA-N 348.490 5.759 30 20 EKED C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccccc1 484054883 GEGIFNFEHJVZBY-AWEZNQCLSA-N 332.428 5.029 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2ccccc2)cc1 484438396 CKWDDWGCAZNKOB-UHFFFAOYSA-N 336.435 5.023 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(C(F)F)ccc1Cl 497396546 VCWZYZHJJQPIKX-UHFFFAOYSA-N 330.806 5.488 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C)c1ccccc1 533948448 VOCVAEIBGHEUQH-QKNQBKEWSA-N 333.475 5.059 30 20 EKED COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)s2)cc1 538395591 QCVCARXGFSZLPI-HNNXBMFYSA-N 348.471 5.146 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc(F)c(Cl)cc1Cl 571008602 AYBMKJRUGHDRGC-MGNBDDOMSA-N 349.236 5.342 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1ccc(F)cc1)c1cccs1)CC2 580803895 XKUCQJWMIMCORV-CTNGQTDRSA-N 348.446 5.125 30 20 EKED C=CCOc1ccc(CNc2ccc([C@H]3CCOC3)cc2)cc1Cl 582110630 DCVRMGBATXMERG-KRWDZBQOSA-N 343.854 5.021 30 20 EKED CC(C)(C#N)CCCCSCc1cnc(-c2ccccc2)nc1 596405816 JCKLTICSNNOVQI-UHFFFAOYSA-N 325.481 5.097 30 20 EKED C[C@@H](NCc1ccc(F)c(-c2cccs2)c1)c1cccc(C#N)c1 610344908 LVOYDFZQRJGVHW-CQSZACIVSA-N 336.435 5.277 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@@](C)(C#N)C1 612290747 OZSDQQLPRILWRS-FQEVSTJZSA-N 327.472 5.091 30 20 EKED C#Cc1cccc(N(CC)C(=S)Nc2ccc(Cl)cc2Cl)c1 728447754 QTINBCQGOQOAHQ-UHFFFAOYSA-N 349.286 5.198 30 20 EKED C=CCN(C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1)C(C)C 734655231 DHIPDVBXEORZHE-KRWDZBQOSA-N 338.451 5.255 30 20 EKED Cc1ccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)cc1 747705924 LBHNGRXVLZALOI-UHFFFAOYSA-N 349.503 5.008 30 20 EKED N#CCC[C@H](NC(=S)Nc1ccc2ccccc2c1)c1ccccc1 747710934 XMMNXJAVGSWLCD-FQEVSTJZSA-N 345.471 5.171 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)OCC(C)(C)CC#N)cs2)cc1 764844868 XVRMEHKSXZUNNQ-UHFFFAOYSA-N 342.464 5.030 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 766022913 YRVQUXMLVXTMAK-MBSDFSHPSA-N 344.458 5.842 30 20 EKED C#CCCCCC(=O)Nc1ccccc1OCc1cccc(Cl)c1 773387539 GGDLCGRMVWGHIL-UHFFFAOYSA-N 341.838 5.051 30 20 EKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)Nc1ccccc1O[C@@H](C)C#N 780743404 BHFBWWMTDSJKDB-KBPBESRZSA-N 348.368 5.039 30 20 EKED FC(F)(F)CCNN=Cc1c(Cl)cccc1Oc1ccccc1 794551548 GKBLQHHYAUZMID-UHFFFAOYSA-N 342.748 5.008 30 20 EKED N#Cc1ccc(NC(=S)Nc2ccc(F)c(C3CC3)c2)cc1Cl 798385006 DMAXOGRWTFHREJ-UHFFFAOYSA-N 345.830 5.037 30 20 EKED CC(=NOCc1cc(-c2cccs2)on1)c1cc2ccccc2o1 836547488 KURZQCYEHYZTCM-UHFFFAOYSA-N 338.388 5.090 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Cl)c(Cl)c1 1776784004 CYFXNEQSJMSGBR-AWEZNQCLSA-N 346.298 5.287 30 20 EKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)sc1C 119983940 VLNNCSDUZVSAOU-NSHDSACASA-N 346.864 5.118 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 324870274 OIQYFFVCTUJXNG-AWEZNQCLSA-N 335.369 5.121 30 20 EKED Cc1nc([C@@H](C)SCC2(C#N)CCC2)oc1-c1ccc(Cl)cc1 419586088 QWBPIWNOCUUHBP-CYBMUJFWSA-N 346.883 5.792 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3c(s2)CCCCC3)n1 474433932 KTGMNGVWMHZOGB-ZDUSSCGKSA-N 344.505 5.087 30 20 EKED CC(C)(CCC#N)CN1CCC(c2ccc(C(F)(F)F)cc2)CC1 500722410 KALGIHXVGBBZPI-UHFFFAOYSA-N 338.417 5.215 30 20 EKED Cc1cc(CNc2ccc3nc(C(F)F)sc3c2)ccc1C#N 513027395 KKIHTARRMWGRDZ-UHFFFAOYSA-N 329.375 5.026 30 20 EKED C=C[C@H](CC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccccc1 534982963 XNODCQQWERVNKN-HZPDHXFCSA-N 337.467 5.030 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1Cl 551530858 YDZRBXYZNSUUEB-CABCVRRESA-N 342.870 5.411 30 20 EKED N#CCCCCCC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 588298185 PPBZPHANZRVAKL-GOSISDBHSA-N 346.883 5.081 30 20 EKED Cc1cccc2sc(C(=O)Nc3ccc(F)c(C#N)c3)c(Cl)c12 609102617 WZEJOIVIOLMHBY-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CCCc1ccc(-c2ccc(NC(=O)N3CCC(C#N)CC3)cc2)cc1 609810273 QRMVYCBMHXQJRO-UHFFFAOYSA-N 347.462 5.074 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 676391076 KJGZLYPMSRSKHB-QGZVFWFLSA-N 328.415 5.022 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2ccc(O)cc2)CC3)cc1 727654053 GPPVHVLMECBZGB-FOWTUZBSSA-N 347.439 5.037 30 20 EKED CC(C)c1ccc(C(C)(C)NCc2ccc(O[C@@H](C)C#N)cc2)cc1 729686650 RBQFYOXDISXXFC-KRWDZBQOSA-N 336.479 5.126 30 20 EKED N#Cc1csc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 752265903 RQLJSFOLTHGNHU-UHFFFAOYSA-N 332.388 5.287 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)N[C@H](CC)c1cccs1 794996159 TYOVCRMDCSHCBH-QGZVFWFLSA-N 344.549 5.152 30 20 EKED CCCCCCC[C@H](C)CNC(=O)Nc1ccc(C)c(NC(C)=O)c1 918035634 WYFOIZXIOJCSQQ-HNNXBMFYSA-N 347.503 5.072 30 20 EKED O=C(O)c1cc2cc(/C=C/C(=O)c3cccc4ccccc34)ccc2o1 1776113909 BNBQYLCZSUQGGV-CSKARUKUSA-N 342.350 5.180 30 20 EKED CC(C)c1ccc(NC(=O)CCc2ccc(C#N)cc2)c(C(C)C)c1 27137838 PNRYBAAUCOPFFZ-UHFFFAOYSA-N 334.463 5.376 30 20 EKED CCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538371 BVPVYYPXMHVGKT-NSHDSACASA-N 339.247 5.093 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)Nc3cccc(F)c3)c2)cc1 84713141 WLBUIAJFQZTLQU-UHFFFAOYSA-N 347.349 5.134 30 20 EKED C[C@@H](NCCCCC#N)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 174056919 HNEBOWLDOCGHOP-SNVBAGLBSA-N 338.295 5.069 30 20 EKED C[C@H](/N=C(/O)CC1CCCCC1)C(O)=Nc1nc(C2CCC2)cs1 328730452 HZHRLIRAEDDPMB-LBPRGKRZSA-N 349.500 5.314 30 20 EKED CC[C@@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 447534450 XJMICEZNNMMZKU-SCLBCKFNSA-N 332.369 5.379 30 20 EKED CCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)oc2ccccc12 453689713 JFDKCCKVXCVNPZ-CQSZACIVSA-N 338.432 5.065 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C)c1ccccc1 466901072 NCEHNANYLPZNFQ-JQVVWYNYSA-N 333.475 5.141 30 20 EKED N#Cc1ccc(C(F)(F)F)nc1SCc1cccc(C(F)F)c1 475887047 IAXATUXWIUMNRM-UHFFFAOYSA-N 344.308 5.202 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1ccc(C)cc1C)c1ccc(F)c(F)c1 479762664 DGJNJZPMYQKKKP-GOSISDBHSA-N 330.378 5.021 30 20 EKED C[C@H](Oc1ccccc1NC(=O)c1ccc(C#N)s1)c1ccccc1 487025795 CPKVLYXZQPISSW-AWEZNQCLSA-N 348.427 5.012 30 20 EKED N#Cc1cccc(CNC2(c3ccc(C(F)(F)F)cc3)CCCC2)c1 503953895 WKJQTIXWZJPTPC-UHFFFAOYSA-N 344.380 5.136 30 20 EKED CC[C@H](CC(=O)Nc1sc2c(c1C#N)CCCC2)c1ccccc1 504473564 KOLJQMSFHKBVJV-CQSZACIVSA-N 338.476 5.021 30 20 EKED Cc1sc(NC(=O)CCCCCc2cccs2)c(C#N)c1C 521842463 DECUXGSANIUULA-UHFFFAOYSA-N 332.494 5.040 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 535373220 OABWRGUGBDJYLU-HNNXBMFYSA-N 334.444 5.109 30 20 EKED N#CCCCOc1cccc(CN2CCCCC[C@H]2c2ccco2)c1 536671436 OGPDQVSWBWWBTP-FQEVSTJZSA-N 338.451 5.079 30 20 EKED C=CCCOCCCCC(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 539404526 UMOYZYJOYSRLSN-SIKLNZKXSA-N 343.511 5.058 30 20 EKED CO[C@@H](CSCc1ccccc1C(C)(C)C#N)c1ccccc1 550006524 HSGOTPSKFSBRQN-IBGZPJMESA-N 325.477 5.109 30 20 EKED N#CCCC[C@H](NC1CC(c2cc(F)cc(F)c2)C1)c1ccccc1 556907165 JXBQQURDYLVOLQ-JITJBCMDSA-N 340.417 5.236 30 20 EKED N#CCCCCCC(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 588153407 MKYUCXGSPQANAM-UHFFFAOYSA-N 334.847 5.074 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc(C(C)C)cc2)c1 727285549 XDPSLDPDEGROPV-UHFFFAOYSA-N 340.492 5.574 30 20 EKED N#Cc1ccc(F)c(CN2CCC[C@H]2c2ccccc2C(F)(F)F)c1 728061360 QZZUVGZFJJOYNK-SFHVURJKSA-N 348.343 5.053 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc(F)c(Cl)c1 731836008 YYKVMROKKJLQEQ-CLFYSBASSA-N 327.742 5.030 30 20 EKED CC(=NNc1cccc2cnccc12)c1cccc(-c2ccncc2)c1 741463607 HPNPCAGROJDIGV-UHFFFAOYSA-N 338.414 5.133 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(O)c(Cl)c1 768757743 QJLMKPIUYFBNQV-DUXPYHPUSA-N 347.848 5.127 30 20 EKED CCc1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)C(C)C)cc1 776154021 KRRLLUJJBRGSKZ-VGSWGCGISA-N 336.479 5.199 30 20 EKED N#Cc1ccc(COc2ccc(C3SCCS3)cc2)c(Cl)c1 783967916 OYSKGIJFBDEXPV-UHFFFAOYSA-N 347.892 5.269 30 20 EKED FC(F)c1ccc(C=NNc2ccc(OCC(F)(F)F)cc2)cc1 794506443 PCMQQHVOAPVNDW-UHFFFAOYSA-N 344.283 5.011 30 20 EKED CC(C)(C#N)c1ccc(CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1 848539892 PNEZXBSGMGZZPG-FQEVSTJZSA-N 346.474 5.024 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1 1776805946 GZZONPJBHMEKKZ-UKVBVZPVSA-N 334.415 5.023 30 20 EKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)s1 76606809 LSLUNDOIEJLMJX-GFCCVEGCSA-N 346.864 5.118 30 20 EKED CC(C)(C#N)c1ccccc1CNc1cccc(CC(F)(F)F)c1 131807849 JRORENHCDPHQAG-UHFFFAOYSA-N 332.369 5.205 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccccc1 191423778 UPIMAGJOWORGMP-OAQYLSRUSA-N 348.490 5.908 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C2(C#N)CC2)cc1 191535553 DTQDJCMCRAGXGI-UHFFFAOYSA-N 346.474 5.570 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C1(c2ccccc2)CCC1 247974477 FFFDMRJYRVIGDI-UHFFFAOYSA-N 345.895 5.038 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)c(F)cc2CC1 328765256 GTILGACWCNXNSO-GZBFAFLISA-N 344.430 5.554 30 20 EKED CCc1nc(C)c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)s1 340436624 RXNYKOVNQOWYRD-YOEHRIQHSA-N 327.497 5.100 30 20 EKED CO[C@@H](CN[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 433028462 ZOFZIVQZSIBNEC-UXHICEINSA-N 342.870 5.052 30 20 EKED COc1cc(CSCCCCC(C)(C)C#N)ccc1OC(F)F 435883244 JREKXYBFDHEPPI-UHFFFAOYSA-N 343.439 5.250 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1ccc(OCc2ccccc2)cc1 442863486 RJFNWOJGFAGQEW-HDYDNRTBSA-N 348.490 5.246 30 20 EKED CC[C@H](N[C@H]1CCCOc2c(Cl)cccc21)c1ccc(C#N)cc1 447580150 NGYJJQSFPDBFCM-OALUTQOASA-N 340.854 5.166 30 20 EKED Cc1c(CSC(C)C)cccc1NCc1ccc(C#N)cc1F 462173891 DVYDPWQGOVAOFC-UHFFFAOYSA-N 328.456 5.260 30 20 EKED N#C[C@@H](C(=O)c1cccc2ccsc12)c1nc2ccccc2s1 467832758 CZGUMHUHFLPGAY-ZDUSSCGKSA-N 334.425 5.001 30 20 EKED CC(C)(C#N)CCCN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 472437759 CCRQTMVALKVCTK-INIZCTEOSA-N 325.283 5.460 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 499724039 HLGLRKUCRRIXGC-INIZCTEOSA-N 347.524 5.340 30 20 EKED CC(C)CN(C(=O)c1cc2sccc2s1)c1ccc(C#N)cc1 518239976 WENMABVDWIAMBP-UHFFFAOYSA-N 340.473 5.137 30 20 EKED Cc1ccc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 542994266 JSTYBZXGSMDSIB-IRXDYDNUSA-N 330.431 5.539 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 590068702 ROIQXOKZUZDKEU-OAQYLSRUSA-N 330.431 5.471 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc2ccccc2o1 603969387 PJXFWWHKNYXOQZ-UHFFFAOYSA-N 344.395 5.285 30 20 EKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H](c1ccc(F)cc1)C1CCC1 609670287 DFSNLRAOCCVPTE-MRXNPFEDSA-N 349.331 5.064 30 20 EKED CCC(C)(C)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 619594611 PPPJNQNZSNDUEV-INIZCTEOSA-N 349.478 5.116 30 20 EKED C=CCCC(=O)N(Cc1cccs1)c1ccc(N(CC)CC)cc1 726501022 YWJJFSCDDKYBMJ-UHFFFAOYSA-N 342.508 5.094 30 20 EKED CC[C@H]1CCCC(=NNc2nc(C(F)(F)F)nc3ccccc23)C1 734978562 MIIVABFIBJMYQJ-NSHDSACASA-N 336.361 5.017 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(SC(F)F)c1 740446754 CWJKSWQYKWUNET-UHFFFAOYSA-N 328.428 5.211 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc2ccccc2c1OC(F)F 742429035 DWGCARXNGLFEDI-CMDGGOBGSA-N 345.370 5.102 30 20 EKED C[C@@H](ON=Cc1cccc(F)c1)c1ncc(-c2ccc(Cl)cc2)o1 752765459 XPORVQJUFQLCNS-GFCCVEGCSA-N 344.773 5.246 30 20 EKED CC(C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)=C1CCCC1 765916172 RMCCDYLZIPKEGJ-KRWDZBQOSA-N 336.460 5.185 30 20 EKED C[C@@H](NCCCCC#N)c1cc(F)ccc1Oc1cncc(Cl)c1 902790419 NWUISMBVLDYKRU-CYBMUJFWSA-N 347.821 5.011 30 20 EKED CC/C=C(/C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 918622130 SORCHIIEZOGKLQ-SPJASCBJSA-N 338.838 5.290 30 20 EKED C=CCOc1cccc(NC(=S)Nc2cccc(C(C)C)c2)c1 920074675 SONVBXFIPXABAI-UHFFFAOYSA-N 326.465 5.184 30 20 EKED CCCCCCCCCCCN(C)Cc1ccccc1CC(=O)O 1776784575 ISDNBGMLBVVDPM-UHFFFAOYSA-N 333.516 5.276 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)CC(C)C)c1 1776787656 HUAVBCRBFUJJSB-LJQANCHMSA-N 349.515 5.015 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccsc3)cc2)cc1 1777671203 SHIJUCDSQKMXRD-XCVCLJGOSA-N 334.396 5.009 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1nc(C(C)(C)C)cs1 121803525 BFRQRPBXTJDKGV-CYBMUJFWSA-N 345.537 5.304 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2cccc3cnccc23)cc1 181552340 HZTFMXNOEIIOOA-UHFFFAOYSA-N 349.437 5.063 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)cc1Cl 191723076 XYDHAOJRTNYXRA-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1ccccc1Oc1ccccc1 237560799 CSLNAHGEGZLWLS-HNNXBMFYSA-N 334.444 5.263 30 20 EKED C[C@H]1C[C@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccsc2S1 417375079 YZLJTHUGSVFIOQ-RZAIGCCYSA-N 340.517 5.212 30 20 EKED C[C@H](NCc1ccc(F)c(C#N)c1)c1ccc(Cl)c2ccccc12 462471019 GPRBHYYHXVAPIY-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED Cc1nc(-c2ccccc2F)sc1[C@H](C)NCC(C)(C)CCC#N 516476712 XHUMCFSLPIVFCM-ZDUSSCGKSA-N 345.487 5.238 30 20 EKED CCCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 517460972 INUVPJWKMPLFQX-UHFFFAOYSA-N 344.402 5.230 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 520137824 UJDAVBSDGKRBRV-INIZCTEOSA-N 349.434 5.004 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 552343082 ZKFWDHJQGMOUKR-FOIQADDNSA-N 338.476 5.418 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H]1CC[C@H](C#N)C1 555425022 WBXVZALMUFRXQK-RBOXIYTFSA-N 345.899 5.115 30 20 EKED CCC1(CC)CCCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 596606771 WDWXRFIFXGUTPJ-IBGZPJMESA-N 341.499 5.033 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc2c(ccc3ccccc32)o1 611438753 IKWQVVCTKHMZJU-CVEARBPZSA-N 340.426 5.869 30 20 EKED Cc1cc(C#N)ccc1CSCc1coc(-c2ccc(F)cc2)n1 614394847 XBGGVAQCVVBQRG-UHFFFAOYSA-N 338.407 5.094 30 20 EKED Cc1ncccc1/C=C\C(=O)c1ccc(OCc2ccc(F)cc2)cc1 728787650 QSPUBFOEGVMKNB-JYRVWZFOSA-N 347.389 5.004 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C/C1CCCCC1 735440037 BXBADYTZQSPLGZ-RUMSDORHSA-N 328.481 5.156 30 20 EKED CC(=NNc1cc(Cl)nc(C)n1)c1ccc(-c2ccccc2)s1 741765740 ILPFCIDPKSZSHS-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CC[C@H](/N=C/c1cc(Cl)ccc1O)c1nc(C(F)(F)F)cs1 745976945 OYPLVDXECNPIIO-PODRTGRWSA-N 348.777 5.091 30 20 EKED CC[C@H](NCc1cc(Cl)ccc1OCC#N)c1cccc(Cl)c1 774874872 NFJIBDFLRQTXHC-KRWDZBQOSA-N 349.261 5.137 30 20 EKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)C1CCC(F)(F)CC1 788715280 UFACXHDPLLZECC-UHFFFAOYSA-N 345.315 5.190 30 20 EKED O=C(/C=C\c1cc(Br)cs1)c1c(F)cccc1Cl 809159296 MPYTXXVCKANYAI-PLNGDYQASA-N 345.620 5.199 30 20 EKED N#CCCC[C@H](NCc1ccc(N2CCCCC2)cc1)c1ccccc1 814304100 FUGZZJBZRXPRKB-QHCPKHFHSA-N 347.506 5.202 30 20 EKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 814482473 COGDQFSZDKBNTN-UHFFFAOYSA-N 335.411 5.115 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1O 815636619 XZAGJJNQYDNDCS-OALUTQOASA-N 342.870 5.521 30 20 EKED Cc1ccc(NC(=O)C(C)C)cc1N=Cc1c(O)ccc2ccccc12 915979336 GLLJEMYIBFKZLN-UHFFFAOYSA-N 346.430 5.199 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCc1ccccc1 66802233 JIIZQPSSKSQGSA-MRXNPFEDSA-N 338.476 5.042 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H]1CCc2ccc(F)cc21 178396726 DVWITRNIEARBBF-DYVFJYSZSA-N 326.440 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(C)cc1F 189912717 LHUHMRHVKHOPKV-UHFFFAOYSA-N 329.390 5.377 30 20 EKED CC(C)COc1ccc(CNc2cccc(OCCCC#N)c2)cc1 236686205 YZGRLBHMBAXYQV-UHFFFAOYSA-N 338.451 5.016 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccs1 276428634 PFKMSUXRVJPKDR-UHFFFAOYSA-N 328.481 5.264 30 20 EKED CCCCN(CCCC1(C#N)CCOCC1)[C@@H](CC)c1ccccc1 410372021 MVIQGOYBJDPGGY-NRFANRHFSA-N 342.527 5.340 30 20 EKED CSc1c(F)cccc1C(=O)Nc1scc(C(C)(C)C)c1C#N 410928198 JECDYHBWJRNZRD-UHFFFAOYSA-N 348.468 5.031 30 20 EKED C=CCC[C@@H](NCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 442902627 WVORNTIHUOVTIC-GOSISDBHSA-N 334.385 5.206 30 20 EKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc4ccccc4s3)csc2c1 483442544 QETNXQLGKDLENK-ZDUSSCGKSA-N 348.452 5.310 30 20 EKED C=CCN(C(=O)c1sc(-c2cccs2)nc1C)c1ccccc1 484229942 GSLJHRTYBLMWLF-UHFFFAOYSA-N 340.473 5.013 30 20 EKED CC(C)c1ccc(-c2ncc(CN3CCC(C)(C#N)CC3)s2)cc1 506040410 BAXUUKFNFHKAHT-UHFFFAOYSA-N 339.508 5.059 30 20 EKED CCCCN(C(=O)c1sccc1C#N)[C@H](CC)c1ccccc1 513283431 BVEBPSDSMSDROG-QGZVFWFLSA-N 326.465 5.013 30 20 EKED C=C(CC)CS[C@@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 540194493 LWOQVGQSZKMOHJ-NSHDSACASA-N 346.477 5.417 30 20 EKED C=CCC[C@@H](NC1CCN([C@H](C)c2ccccc2)CC1)c1ccco1 556867309 GUYKZKIAMMMJNB-WIYYLYMNSA-N 338.495 5.102 30 20 EKED C=CCC1(c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)CCC1 580919471 ULJWRXHSTHKHMY-ZDUSSCGKSA-N 340.320 5.145 30 20 EKED CC[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCCC1 590067687 GJQNALNKDRKRJW-WOJBJXKFSA-N 341.499 5.080 30 20 EKED N#CC1(CC(=O)N(Cc2cccc3ccccc23)c2ccccc2)CC1 590321691 MLVIHVBPLXKERR-UHFFFAOYSA-N 340.426 5.067 30 20 EKED N#CCCC[C@@H](N[C@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 599048376 MOXIWAWABDSZQV-UXHICEINSA-N 342.845 5.491 30 20 EKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccc(C#N)c(Cl)c2)c1 604500828 LLTUTTLZWNUDCD-AWEZNQCLSA-N 341.842 5.053 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccc(C#N)cc1F 608860646 WUALPXOUEVVHGM-UHFFFAOYSA-N 344.436 5.156 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 609535913 OJVBXKWYKQIYOW-VWLOTQADSA-N 348.449 5.591 30 20 EKED C[C@@H](N[C@@H]1CCSc2c(Cl)cccc21)c1cccc(C#N)c1 610830291 KBMYTADKCSGKOL-SJKOYZFVSA-N 328.868 5.099 30 20 EKED C=C(C)[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(F)c1 614160404 UEOFDASXJAQUQK-LEWJYISDSA-N 338.401 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(C)c2ccccc21 682822474 OGMDTKFMDXFIBB-FQEVSTJZSA-N 348.490 5.101 30 20 EKED C#Cc1cccc(NC(=O)Nc2ccccc2COC(C)(C)CC)c1 755601140 DQIFPPQNHPHYRU-UHFFFAOYSA-N 336.435 5.017 30 20 EKED CCCCCCCCCN(C)C(=O)c1cnc(-c2cccnc2)s1 761408463 YZGDDQUMZUOPGU-UHFFFAOYSA-N 345.512 5.028 30 20 EKED C=CCC[C@H](NCc1ccc(F)nc1)c1ccc(C(F)(F)F)cc1 778172186 YCSRLFTUVASCQT-INIZCTEOSA-N 338.348 5.037 30 20 EKED CC(C)[C@H]1/C(=C\c2ncc(C(F)(F)F)s2)C(=O)c2ccccc21 788356226 UEPBYQRXXNBGBE-CUXKMMBLSA-N 337.366 5.181 30 20 EKED Cc1cc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)oc1C 799897912 UDCRBTHKNZTKEN-BQYQJAHWSA-N 327.380 5.055 30 20 EKED C[C@@H](C#N)OCCNc1cccc(-c2ccc(Cl)c(Cl)c2)c1 802740996 KTEYZLJZVBGXOM-LBPRGKRZSA-N 335.234 5.001 30 20 EKED CC[C@@H](NCC(C)(C)CCC#N)c1cc(Cl)cc(Cl)c1O 806177735 IEFNIZIVIHHBBC-CQSZACIVSA-N 329.271 5.070 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3coc(C(C)C)n3)s2)cc1 806559668 DTESBRUZPMDNGZ-HJWRWDBZSA-N 338.432 5.126 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1 1776038050 POLHIFRSLOCQJC-KBXCAEBGSA-N 330.472 5.415 30 20 EKED Cc1cc(/C=C/C(=O)c2cccs2)cc(C)c1OCc1ccccn1 36834842 TUMLPHWNDRCOPB-CMDGGOBGSA-N 349.455 5.235 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2cc3ccccc3o2)c1 102598475 VMKZBXDZTAYQBE-ZHACJKMWSA-N 331.371 5.011 30 20 EKED CCC(CC)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1 236703627 CTSHKGZGGCSZRD-JTSKRJEESA-N 336.479 5.245 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1F 340450307 XBIITHAWBZESPN-RTBURBONSA-N 344.861 5.955 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(C2=CCCC2)cc1)c1ccccc1 352199061 UJJGWBOEPMMXFM-QFIPXVFZSA-N 344.458 5.419 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Cl)cc1F 435903120 RWXVWMUOHMPRJJ-LBPRGKRZSA-N 334.847 5.343 30 20 EKED C[C@@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(C#N)cc1F 482066756 NOYCCQJXNSLXPP-MRUCEZMOSA-N 346.808 5.029 30 20 EKED C[C@H](N[C@H]1CCc2c(Cl)cc(Cl)cc21)c1ccc(C#N)cc1 507841898 PXNUEFNJUXICBS-VOJFVSQTSA-N 331.246 5.203 30 20 EKED N#Cc1nnc2ccccc2c1Oc1ccc(OC2CCCCC2)cc1 525358620 GOHXMXQPOHCVMX-UHFFFAOYSA-N 345.402 5.005 30 20 EKED N#Cc1ccc(CNc2cccc(CSC3CCCCC3)c2)o1 537729732 CZGWGRVCAFQPHW-UHFFFAOYSA-N 326.465 5.329 30 20 EKED Cc1sc([C@H](C)N[C@@H]2CC[C@H](C#N)C2)nc1-c1ccc(Cl)cc1 555424514 HJKVWUAODRWBIP-DETPVDSQSA-N 345.899 5.115 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3oc4ccccc4c3c2)c1 556779109 CMWLJKNFNDTYMU-UHFFFAOYSA-N 346.773 5.363 30 20 EKED CCC[C@@H](NC(=O)CCCCC#N)c1ccc(Cl)c(Cl)c1 593969931 OYEFLNBNZMGJBA-OAHLLOKOSA-N 327.255 5.035 30 20 EKED N#CC1(CCSCc2ncsc2Br)CCCCC1 596423031 WSALYTJRMCFBLD-UHFFFAOYSA-N 345.331 5.003 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1ccc(C#N)cc1F 603442352 DEPAJIIKRSPYRV-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(OC(C)(C)C)cc1 618805632 OTVAYBAMZSYQQD-QVKFZJNVSA-N 334.463 5.074 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)c(Cl)c1 619746683 HROMDGBWNOIQOW-JTQLQIEISA-N 339.653 5.369 30 20 EKED CCCC[C@@H](CC)CNC(=S)Nc1ccccc1SCCC#N 730953354 VVKWKSOQICAJBR-OAHLLOKOSA-N 349.569 5.195 30 20 EKED Cc1scc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 773231746 PYVMLHPPLWPOBJ-IBGZPJMESA-N 346.455 5.273 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1cccc(C2SCCS2)c1 775974224 FWXUWNRCSSEOMS-ZDUSSCGKSA-N 336.526 5.032 30 20 EKED N#CC[C@H](CC(=O)Oc1ccccc1-c1ccccc1)c1ccccc1 796634349 VGQKGZKGVZRNAT-HXUWFJFHSA-N 341.410 5.347 30 20 EKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1cc2ccccc2o1 796891768 USKPATQEDBXTLR-DOTOQJQBSA-N 333.387 5.125 30 20 EKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1c(F)cccc1Cl 809159410 OZBIHLALIKBWKI-MDZDMXLPSA-N 343.810 5.499 30 20 EKED O=C(/C=C/c1ccc(Br)s1)c1c(F)cccc1Cl 809159665 UEAZBFFNYCHAHX-GQCTYLIASA-N 345.620 5.199 30 20 EKED Clc1nc(Oc2ccccc2)sc1C=NNc1ccccc1 915932840 DJASMMXMPHXQHY-UHFFFAOYSA-N 329.812 5.035 30 20 EKED Cc1nn(C)cc1C(=O)/C=C/c1ccc(-c2ccc(Cl)cc2)s1 917520663 WGYJMKADJFQDSR-VQHVLOKHSA-N 342.851 5.007 30 20 EKED N#C[C@@H](C(=O)C=C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 918489772 NMLUOTJKHBWISE-HNNXBMFYSA-N 342.851 5.140 30 20 EKED CC(CCc1cccc(C(F)(F)F)c1)=NNc1ncccc1Cl 920374599 HZBYXSLXSFFPPD-UHFFFAOYSA-N 341.764 5.174 30 20 EKED C=CCN(Cc1csc(-c2ccc(F)cc2)n1)Cc1cccs1 60942783 WBSYEIORYPUBAX-UHFFFAOYSA-N 344.480 5.199 30 20 EKED C=C(C)CN(CC)[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 152517676 ZADBZRBHKYXYLE-NSHDSACASA-N 340.254 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(Cl)c1 189906244 GFRJLEGQBVEDRQ-UHFFFAOYSA-N 327.855 5.373 30 20 EKED C[C@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(OCC#N)cc1 192943491 LOWUYDQBXUGKPK-IRXDYDNUSA-N 330.431 5.154 30 20 EKED C[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(OCC#N)cc1 293905977 ZUPSOFWAZWJMRH-LRDDRELGSA-N 346.883 5.032 30 20 EKED CC1(C)CCC(/N=C(/O)CC2CC(c3ccccc3)C2)(C(=N)O)CC1 329681902 XCUYAGLIUIHGNR-UHFFFAOYSA-N 342.483 5.401 30 20 EKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1 329988328 HACKESMVRTZZKI-VWDMACCTSA-N 348.874 5.283 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1 352179853 CTWLCQDMGCZSAU-RXVVDRJESA-N 334.463 5.040 30 20 EKED C=CC[C@H](CC)NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 439447303 YAOQBEGRETTXNU-AWEZNQCLSA-N 345.830 5.004 30 20 EKED N#CCCCCNCc1ccccc1Oc1ccc(F)cc1Cl 461413882 QDPCLZVSRZPCJK-UHFFFAOYSA-N 332.806 5.055 30 20 EKED Cc1ccc([C@H](C)N(C(=O)CCCC#N)c2cc(C)ccc2F)cc1 464393900 UERJZUXPMPYLRH-KRWDZBQOSA-N 338.426 5.231 30 20 EKED C=CCn1c(SCc2c(C)ccc3ccccc23)nnc1C1CC1 481455635 WJAZXPOKXIGCKA-UHFFFAOYSA-N 335.476 5.095 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(F)C[C@H]1C 529084071 WDLPXYXWNYXISL-CQSZACIVSA-N 336.426 5.190 30 20 EKED COc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1 537012514 USMIHPCWDWIKRK-QGZVFWFLSA-N 342.442 5.085 30 20 EKED CCC[C@@H](NCc1ccc(C#N)s1)c1cccc(C(F)(F)F)c1 539497548 KSIPBKHOSZPPKB-MRXNPFEDSA-N 338.398 5.270 30 20 EKED CC[C@H](C)Oc1cc(C)ccc1CN[C@H](C)c1ccc(C#N)c(F)c1 539609729 JLCHDPXLRCIONM-JKSUJKDBSA-N 340.442 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(C)(C)C(F)(F)F 549283956 CKUZZRZYAADVNT-UHFFFAOYSA-N 342.405 5.249 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 553305230 KIOMBQXVPVVNGU-ORAYPTAESA-N 344.380 5.305 30 20 EKED C=CCC[C@@H](Nc1ccc(NC(=O)c2ccccc2)cn1)c1ccco1 560535667 CTMQRRDXWGCUPF-GOSISDBHSA-N 347.418 5.046 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)CC2 563287262 UBYYMBMSFSLTMZ-PKTZIBPZSA-N 342.417 5.064 30 20 EKED COc1ccc([C@H](C)[C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 563671532 YWNOZGHCXQWQJZ-JBYIUTFZSA-N 336.479 5.212 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 599048378 MOXIWAWABDSZQV-WOJBJXKFSA-N 342.845 5.491 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc2ccccc2c1 609387122 NVOVHJFVCDMXQA-DLBZAZTESA-N 346.499 6.265 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(CC(F)(F)F)cc1 611474750 ISIVWOWNPQVDEP-GOSISDBHSA-N 330.353 5.153 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(-c2ccccc2OCC)c1 620305784 QZAYJEKNFBIZRJ-BGYRXZFFSA-N 347.458 5.076 30 20 EKED C=CC[C@H](OC(=O)[C@](C)(C#N)CC)c1ccc(Cl)c(Cl)c1 808795844 UOUBOGIVSYRMSX-HOCLYGCPSA-N 326.223 5.094 30 20 EKED COc1ccc(/C=C\C(=O)c2c(F)cccc2Cl)cc1Cl 809159206 KILRNVSPTNBYNV-ALCCZGGFSA-N 325.166 5.037 30 20 EKED CCCCCCCCC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813216631 VXVFIIBRQRSORT-CQSZACIVSA-N 326.362 5.027 30 20 EKED COc1c(Cl)cc(Cl)cc1/C=C\C(=O)c1ccc(F)cc1F 921260879 FVQLJHFSFOPPIT-DJWKRKHSSA-N 343.156 5.176 30 20 EKED CCCCCCCCC[C@H](C)CC=NNc1cccc(C(=O)O)c1C 1776087943 GNMJNSZRFJYWPE-KRWDZBQOSA-N 346.515 6.258 30 20 EKED CC(C)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776372483 WFTKLATXPUBUEX-PDGQHHTCSA-N 334.415 5.111 30 20 EKED N#Cc1c(F)cccc1NCc1ccc(-c2nc3ccccc3s2)o1 60856748 ASTCERXFOJAIMU-UHFFFAOYSA-N 349.390 5.179 30 20 EKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccccc2)o1 154156424 ZKUXOSBOWJPOBU-NSHDSACASA-N 341.823 5.115 30 20 EKED CC(C)(C#N)CCCN1CCc2sccc2[C@H]1c1cccs1 174812115 BHGMGXJLLCBPJB-KRWDZBQOSA-N 330.522 5.087 30 20 EKED C=C(C)[C@H](NCc1ncc(-c2cccs2)o1)c1ccc(F)c(F)c1 187761017 VYJHRICADYKWJB-SFHVURJKSA-N 346.402 5.088 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1Cl 191376830 GUZXUGXIDZMTGM-AWEZNQCLSA-N 338.794 5.095 30 20 EKED Cc1[nH]c(S[C@H](C)c2ccc(C#N)cc2)nc1Cc1ccccc1 303734819 WOCMSTMFLNOKCK-OAHLLOKOSA-N 333.460 5.034 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(F)c3ccccc3c2)n1 498063365 WCWGBQBRPSKZOL-OAHLLOKOSA-N 338.407 5.049 30 20 EKED C[C@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)c1ccccc1 499628486 ACJJXJUHSMHCAH-HXUWFJFHSA-N 348.490 5.355 30 20 EKED C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc21 507434524 MYZVPPMRHVPMCX-FOIQADDNSA-N 347.462 5.248 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc3ccccc3c2)cc1 520993599 OJYQRPZQYKWSIX-VWLOTQADSA-N 348.449 5.591 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@@H](C#N)C3CCCCC3)o2)cc1 522333208 KVTLGPAVOHDIFF-KRWDZBQOSA-N 341.480 5.425 30 20 EKED CCc1c(C)sc(NC(=O)c2oc3c(C)cccc3c2C)c1C#N 524105915 SEFKMSRYLINILZ-UHFFFAOYSA-N 338.432 5.106 30 20 EKED Cc1cccc(Oc2ccccc2CNCc2ccc(C#N)s2)c1 537304239 MXAFGNNJPRNDRF-UHFFFAOYSA-N 334.444 5.010 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@@H](C)[C@H](C)C1 543594573 SUQYMSAVIWCKRP-KLHDSHLOSA-N 345.512 5.027 30 20 EKED CCN(CCC1CC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 546923999 BNMFODZJIZRWDC-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCCCCSCCC(=O)Nc1ccccc1C(F)(F)F 571269257 VZJMNLGFUXDGHH-UHFFFAOYSA-N 331.403 5.124 30 20 EKED CSc1cc(Cl)ccc1NCc1ccc(C2(C#N)CC2)cc1 600861211 LOZGBYTVIWBUGX-UHFFFAOYSA-N 328.868 5.229 30 20 EKED N#CC1(C(=O)Nc2cccc(Sc3ccccc3)c2)CCCCC1 609375343 VJOKZTBEFMSDCQ-UHFFFAOYSA-N 336.460 5.250 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccnc3C)s2)cc1 728787966 YILYDCOIXYMESD-ZHACJKMWSA-N 334.444 5.026 30 20 EKED C#CCCOc1ccc(CN[C@H](C)c2csc3ccccc23)cc1 733328472 RVDDZWDEANMGRD-MRXNPFEDSA-N 335.472 5.154 30 20 EKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 735396843 BFKIKJTXSMXZFR-GXTWGEPZSA-N 332.444 5.218 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(OC)c2ccccc12)c1ccccc1 773114816 KCADLMYQHPLIHD-VGSWGCGISA-N 329.443 5.264 30 20 EKED C#CCN(C(=O)Nc1c(C(C)C)cccc1C(C)C)C1CCCC1 776295764 ZQFLVVLTANEZQK-UHFFFAOYSA-N 326.484 5.343 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(C)CCCCC3)n2)cc1 781449563 OPKMHVYZMYCXMN-MRXNPFEDSA-N 338.476 5.265 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 800576134 BEEDYEPRJIRJEY-IBGZPJMESA-N 340.854 5.438 30 20 EKED CC[C@H](NCC1CCC(C#N)CC1)c1cc(Cl)cc(Cl)c1O 806164276 PJCBERTYIFZIAA-PPUFBPAQSA-N 341.282 5.070 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc2c(c1)COC(=O)N2 862781068 AXUUPBGXTIUAMA-CQSZACIVSA-N 332.444 5.074 30 20 EKED C[C@@H](Nc1ccc(OC(F)(F)F)cc1Cl)c1cccc(C#N)c1 864020332 SEDBTOLVSVSKMG-SNVBAGLBSA-N 340.732 5.283 30 20 EKED Cc1cc(C)c(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1C 915983798 AIGCYKGNPJFRPH-FPLPWBNLSA-N 334.444 5.026 30 20 EKED O=C(O)c1ccc(NN=C2CCCCC[C@H]2c2ccccc2)cc1F 1776076166 AAVQICSUPQJFRC-INIZCTEOSA-N 340.398 5.040 30 20 EKED CCc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 7279167 LFFXVKBILGMKTJ-UHFFFAOYSA-N 326.399 5.040 30 20 EKED Cc1ccc(-c2nc(CN[C@@H](CCC#N)c3ccccc3)cs2)cc1 130435413 ULSDGARSTNGDAN-FQEVSTJZSA-N 347.487 5.253 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(F)cc1F 189895488 DRTQPJFLDSALSD-UHFFFAOYSA-N 329.390 5.377 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1Cl 189901549 SJIAUAZMTSHCNR-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1c1ccccc12 276463707 XBRCMLHGNWCUTA-SFTDATJTSA-N 346.474 5.962 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)c1 328801387 ZGBNTSMQQZWYSM-QLFBSQMISA-N 332.419 5.628 30 20 EKED CCC1(CC)CCC(/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CC1 330086961 MVAIVHFILWPOIN-UHFFFAOYSA-N 348.531 5.617 30 20 EKED CC(C)c1ccc(N/C(O)=N/C[C@@H]2CCO[C@H](C)C2)c(C(C)C)c1 330627538 KHPUXECHPDBEEN-HZPDHXFCSA-N 332.488 5.074 30 20 EKED CC[C@@H](NCc1ccc(C#N)s1)c1ccc2cc(OC)ccc2c1 421884010 QOMPHOHECGXQIJ-HXUWFJFHSA-N 336.460 5.022 30 20 EKED C=CCCN(C)C(=O)N[C@H](c1ccc(C(C)C)cc1)c1cccs1 466980065 CTXVHYVGOKDYDN-LJQANCHMSA-N 342.508 5.178 30 20 EKED CC(C)(C#N)CCCSCc1coc(-c2ccc(Cl)cc2)n1 480393470 DZXNUZWFVWCJHE-UHFFFAOYSA-N 334.872 5.558 30 20 EKED C=CCn1c(S[C@H](C)c2cccc(Cl)c2)nnc1-c1ccco1 497661401 RUXKRFPCGDITCX-GFCCVEGCSA-N 345.855 5.231 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 499724078 HLGLRKUCRRIXGC-MRXNPFEDSA-N 347.524 5.340 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc2nc(C3CC3)oc2c1)c1ccccc1 533991076 GYJRTJCWXWSZPN-AWEZNQCLSA-N 332.403 5.004 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(F)cc2C#N)cc1 537101892 GBNZECQCKGVNMZ-CQSZACIVSA-N 328.456 5.049 30 20 EKED C[C@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccsc2S1 551205763 MDNRCZHJYVSMCT-QGTPRVQTSA-N 342.533 5.698 30 20 EKED C=CCSc1ccccc1C(=O)N[C@H]1CCc2sc(Cl)cc21 563488196 JKWZSFCYUPVAAL-ZDUSSCGKSA-N 349.908 5.097 30 20 EKED N#CCCCCCC(=O)N(Cc1cccs1)c1ccc(F)cc1F 588885413 UVYZJXHTRNSIEW-UHFFFAOYSA-N 348.418 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(C#N)c1 616123440 NLJRHGJDZJCBGH-INIZCTEOSA-N 347.462 5.293 30 20 EKED C#CCCOc1ccc(CN[C@@H](CC)c2ccc(Cl)s2)cc1 734003678 SNYDKSUBLOHYAM-INIZCTEOSA-N 333.884 5.045 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@H]1c1cccnc1 735632223 ZCRILHLYEHGICS-ZRGSNEMSSA-N 328.500 5.442 30 20 EKED CC(=NN(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 749806728 GCAAZHMURFNOBK-UHFFFAOYSA-N 337.426 5.797 30 20 EKED C[C@@H](CC(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 773981702 CITGJAQCOLPONZ-DZGCQCFKSA-N 326.465 5.059 30 20 EKED C[C@H](CC(=O)OCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 783859024 RAKQCXGZHZPUHN-CYBMUJFWSA-N 341.373 5.072 30 20 EKED C=CC[C@@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccncc1 788579797 HMQJQLHDWRNHDH-ARLBYUKCSA-N 332.900 5.196 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccoc2C2CC2)cc1 798394366 HLOVBEADRIPJCR-FQEVSTJZSA-N 342.398 5.065 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CSC)CC1 931063624 ZRSCDXPQPMUHST-UHFFFAOYSA-N 346.540 5.145 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)[C@@H](C)c1cc2ccccc2s1 1776013549 FHSISUJBZBLKQB-GFCCVEGCSA-N 338.432 5.191 30 20 EKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)cs1 1776784619 SAZQQLFKCCKKJK-UHFFFAOYSA-N 325.518 5.409 30 20 EKED CCCCCCCCCN(C)c1c(C(=O)O)cnc2c(C)cccc12 1776785406 VHWZKSFDVWJHOP-UHFFFAOYSA-N 342.483 5.428 30 20 EKED N#Cc1ccc(-c2cc[n+](C3c4ccccc4-c4ccccc43)cc2)cc1 1875251726 BGHSLTKPYPQATE-UHFFFAOYSA-N 345.425 5.131 30 20 EKED COc1cc(/C=C/C(=O)c2ccc3ccccc3c2)ccc1SC 63866748 ROHUKCYIAHXMPY-YRNVUSSQSA-N 334.440 5.466 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1oc2c(ccc3ccccc32)c1C 63960761 VRKQULWLWUDLKI-UHFFFAOYSA-N 340.382 5.327 30 20 EKED CC[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177750251 MMZWWMQWHCZHLZ-HOCLYGCPSA-N 344.505 5.014 30 20 EKED Cc1cc(C)c(-c2nnc(SCc3ccc(C#N)cc3C)o2)c(C)c1 186275798 VALINKFRZOCZQD-UHFFFAOYSA-N 349.459 5.134 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cnn(C(C)(C)C)c1C)c1ccc(F)c(F)c1 191507842 DSSNSNVHCFJYCL-DJJJIMSYSA-N 347.453 5.193 30 20 EKED Cc1ccc(-c2cnc(CS[C@H](C)c3ccc(C#N)cc3)o2)cc1 437274363 HQSJKVRTWOQVFW-OAHLLOKOSA-N 334.444 5.516 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H]1CCC2(CCCCC2)O1 466848986 ZTLMHMUSCVJRNL-IRXDYDNUSA-N 344.524 5.375 30 20 EKED N#CC[C@H](CC(=O)N1CCC[C@@H]1CC1CCCCC1)c1ccccc1 475394320 XKKXANZJNKIANX-NHCUHLMSSA-N 338.495 5.035 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](CC)c1ccccc1 476084853 PUFULSODTNPNHP-SFHVURJKSA-N 335.491 6.061 30 20 EKED C=CC[C@@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 488678893 WKWWZZFGFGMRHI-GOSISDBHSA-N 347.380 5.024 30 20 EKED Cc1nc(C)c(C#N)c(S[C@H](c2ccccc2)c2ccccc2C)n1 518381755 BKSZTKMLODWSCG-HXUWFJFHSA-N 345.471 5.155 30 20 EKED C=C[C@@H](CC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 533901678 ONIVVIDXORNCEI-FQEVSTJZSA-N 349.449 5.191 30 20 EKED COc1ccsc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543851779 XDPWGSALOCYPTQ-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 559865967 XEPKPTXFJIRDLX-IFXJQAMLSA-N 347.289 6.079 30 20 EKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nccc4ccccc34)cc2c1 562177194 KSMGMTACCNAOSY-KRWDZBQOSA-N 342.423 5.248 30 20 EKED C=C(C)COc1cccc(NC(=O)N(CC)Cc2ccc(C)cc2)c1 562836297 LFZBNBUZXZVXCD-UHFFFAOYSA-N 338.451 5.004 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H](C)c1cccc(C#N)c1 588954976 QCDMGUJZXSIWCG-QVKFZJNVSA-N 329.447 5.076 30 20 EKED C#Cc1cccc(NC(=S)N[C@@H](c2ccc(Cl)cc2)C(C)C)c1 726452605 XIHWNVJHYWFDMZ-GOSISDBHSA-N 342.895 5.005 30 20 EKED C[C@@H](Nc1ccc(Cl)cc1OC(F)F)c1ccc(C#N)c(F)c1 762785373 FSMNLYPDKDUWJP-SECBINFHSA-N 340.732 5.125 30 20 EKED C=CC[C@@H](N[C@H](C)c1cccc(-c2ccccc2)c1)c1ccncc1 766023392 UMPIOOVQWXDJRM-WZONZLPQSA-N 328.459 5.717 30 20 EKED Cc1ccc(CCC=NN(Cc2ccccc2)c2ccccc2)cn1 774310605 JXEDQCVTTZFLML-UHFFFAOYSA-N 329.447 5.015 30 20 EKED O=C(/C=C/c1scnc1C1CC1)c1nc(-c2ccccc2)cs1 782324623 FPXFGTYKJBSGTB-CMDGGOBGSA-N 338.457 5.040 30 20 EKED CCCC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 800385835 FODZHXNSVBTGJV-WFASDCNBSA-N 346.883 5.466 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)NCC(C)(C)CCC#N 806250490 UBBBWIOIZJAWJS-UHFFFAOYSA-N 347.528 5.337 30 20 EKED CCCCCCCCCC(=O)Nc1cc(-c2nnco2)ccc1C 918587643 XMXDMKWVKBXEIR-UHFFFAOYSA-N 329.444 5.124 30 20 EKED N#CCC[C@H](NCc1ccc(-c2ccncc2)cc1F)c1ccccc1 125778032 PLZYWQIWQRFASD-QFIPXVFZSA-N 345.421 5.022 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)s1 176942268 NVWHFIFGFSHCCG-IBGZPJMESA-N 338.863 5.152 30 20 EKED C[C@H](NCCCC(C)(C)C#N)[C@H](C)c1ccccc1C(F)(F)F 185794062 REICOONCKKDGIN-KBPBESRZSA-N 326.406 5.117 30 20 EKED CCCc1ccc([C@H](NCc2ccc(C#N)o2)c2cccs2)cc1 236966842 BTPWETOURCQYOM-FQEVSTJZSA-N 336.460 5.044 30 20 EKED N#Cc1csc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 237797029 NNXMTVAOIVYNDR-GOSISDBHSA-N 330.884 5.294 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)c(N)c(Cl)c1 271767524 UGDMXEVDXCCQJN-SJCJKPOMSA-N 348.277 5.271 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)N[C@H](CCC#N)c1ccccc1 435193812 PBKDDTIMYFMRCJ-HXUWFJFHSA-N 349.478 5.286 30 20 EKED C=CCOCCCC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 463162861 BWKLSEIGEIHQLP-UHFFFAOYSA-N 345.826 5.054 30 20 EKED CCO[C@@H](C)c1nc(CSc2ccc(C#N)cc2Cl)cs1 465389914 VMLIBZCXLUEAND-JTQLQIEISA-N 338.885 5.058 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)CCCCC(=O)c1ccccc1 473373294 MBPSZEWXOWAKFA-UHFFFAOYSA-N 349.474 5.035 30 20 EKED CCCCN(CCCC)C(=O)Nc1ccccc1SC[C@H](C)C#N 517473711 RIXOMGINOLBRES-MRXNPFEDSA-N 347.528 5.372 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CC1 523620411 WXQAVDCCDAYPDS-UHFFFAOYSA-N 348.874 5.091 30 20 EKED COc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1Cl 536837971 IFLHOIQBSNGGPV-KSSFIOAISA-N 328.843 5.044 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)CCC(C)(C)C#N)s2)cc1 538467408 FBEHJTYOEFGRBD-MRXNPFEDSA-N 341.524 5.360 30 20 EKED N#CCCCCN[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 539970508 VLHKACQGIFEFMQ-WMZOPIPTSA-N 338.417 5.405 30 20 EKED CCCOc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 557508820 UNRMWPKLPKHPIY-KSFYIVLOSA-N 334.463 5.075 30 20 EKED CC[C@@H](NCc1ccc(OC2CCCC2)cc1)c1ccc(C#N)cc1 560268495 DXBSUNGYYCPASM-JOCHJYFZSA-N 334.463 5.121 30 20 EKED C[C@H](CCC#N)Sc1ncnc2scc(-c3ccc(F)cc3)c12 572106541 PEQKWWAIMGZVTG-LLVKDONJSA-N 343.452 5.282 30 20 EKED N#Cc1ccc(CNc2cc(C(F)F)nc3ccc(Cl)cc23)cc1 578670294 REDKEWXZXHVLDI-UHFFFAOYSA-N 343.764 5.310 30 20 EKED N#Cc1cccc(C2(NCc3cc(-c4ccccc4)cs3)CC2)c1 580579523 IIFDEMNGKPADQY-UHFFFAOYSA-N 330.456 5.066 30 20 EKED COc1ccc(C(C)C)cc1CN[C@H](CCCC#N)c1ccccc1 593994709 HHCGWRXTQSSVAE-OAQYLSRUSA-N 336.479 5.343 30 20 EKED N#CC1(c2ccc(CN(Cc3ccco3)Cc3cccs3)cc2)CC1 596978060 SKKLRTAPURUVNN-UHFFFAOYSA-N 348.471 5.099 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C2CC2)cc1 597186827 LTIULSVPWQQXIM-CQSZACIVSA-N 336.460 5.211 30 20 EKED N#CC1(CCCSCc2c(Cl)oc3ccccc23)CCOCC1 598733059 QJLSCJKWKMQJPV-UHFFFAOYSA-N 349.883 5.420 30 20 EKED Cc1c(CSC(C)C)cccc1NCc1cccc(F)c1C#N 600852314 SNIKHSQSZVUQAN-UHFFFAOYSA-N 328.456 5.260 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@H]21 626633604 DMQVBIGSLYEJIK-NJDAHSKKSA-N 331.459 5.063 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cc1 728694919 NEVKGCFTPWAVDW-OXFRDRNISA-N 346.213 5.180 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 733749601 PTKLSFNPXXENOG-FNORWQNLSA-N 339.372 5.121 30 20 EKED Cc1c(C#N)cccc1NC(=S)Nc1ccccc1-c1ccccc1 769796402 YQKCJBDVVUWVSB-UHFFFAOYSA-N 343.455 5.343 30 20 EKED C[C@H](C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc2ccccc2c1 842941094 NKVROLNEOJXGAB-SCLBCKFNSA-N 346.455 5.154 30 20 EKED C=C1CC(c2noc(-c3c(-c4ccccc4Cl)noc3CC)n2)C1 896877584 NPLHUUFNRRRCKL-UHFFFAOYSA-N 341.798 5.041 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(SC2CCCC2)cc1 914703712 XXMHZKKJBVLLCS-VAWYXSNFSA-N 327.449 5.222 30 20 EKED CC(C)C(CCc1ccc(Cl)cc1)=NNc1cccc(C(=O)O)c1 1776036913 QXNHMBGIKJIEMC-UHFFFAOYSA-N 344.842 5.095 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1 1776699940 IZVDEYFZUKKXRK-PLSXKVAHSA-N 336.431 5.411 30 20 EKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 175947490 UZLPBQIJALOVJP-CYBMUJFWSA-N 347.409 5.214 30 20 EKED C=CCC[C@@H](NCc1csc([C@@H](C)OCC)n1)c1ccccc1 180043944 IMRWZQLCYGFCHD-CRAIPNDOSA-N 330.497 5.038 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(SCC)c1 189870379 VNWXPTJTCWUVRF-UHFFFAOYSA-N 340.492 5.298 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 255146108 OQMJHNHYDGUBDS-NZHZHZHDSA-N 344.439 5.090 30 20 EKED CCC[C@H](/N=C(/O)Cc1ccc2c(c1)N=C(O)C2)C1CCCCC1 329625280 GITRTTCDKSRAAV-KRWDZBQOSA-N 328.456 5.079 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 410367308 SXHYWJJTTFCFKM-HXUWFJFHSA-N 337.463 5.300 30 20 EKED C[C@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 439678890 RQBJWOZJUXVMFY-HTAPYJJXSA-N 342.442 5.105 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 449445702 LDMLGYLFSKJSEC-MGHWNKPDSA-N 336.401 5.013 30 20 EKED N#Cc1ccc(Oc2cccc(NCc3ncc(Cl)s3)c2)cc1 478366338 DMQKLOPTFRDLEN-UHFFFAOYSA-N 341.823 5.073 30 20 EKED C=C[C@H](CC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 478542040 LHNAPTGJCHMGLS-XFQXTVEOSA-N 339.866 5.062 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)s1 503362885 ACZUHVMMWTUHSL-RBUKOAKNSA-N 346.455 5.078 30 20 EKED CCc1cc(C#N)c(NC(=O)C[C@@H](CC)c2ccc(C)cc2)s1 523102226 XXJVBOIJRBYVMQ-CQSZACIVSA-N 326.465 5.013 30 20 EKED Cc1ccc2cc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)oc2c1 551214053 ALLUYBQHCZWQPZ-YLJYHZDGSA-N 332.447 5.827 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Cl 559862229 BYIJLYWTTMZEOO-AUUYWEPGSA-N 330.834 5.565 30 20 EKED Cc1ccc(C)c([C@H](NCc2ccc(CC#N)cc2)c2ccccc2)c1 564128349 CYHHOKJAPQVJQA-XMMPIXPASA-N 340.470 5.249 30 20 EKED CC(C)CCOc1ccc([C@H](C)NCc2ccc(CC#N)cc2)cc1 564143298 KMCIHHOLRVWHQW-SFHVURJKSA-N 336.479 5.028 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCc4cc(Cl)cc(Cl)c43)CC2)c1 611475964 CVNHJHJWZANRBV-QGZVFWFLSA-N 343.257 5.131 30 20 EKED C[C@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1cccc(C#N)c1 618984890 KKSDITFAOXVWJB-SHUKQUCYSA-N 330.884 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COCc1ccccc1C 622851634 FTQGTQAEXCKOLP-UHFFFAOYSA-N 337.463 5.002 30 20 EKED C=CCCC[C@@H](C)NC(=O)c1ccccc1SCc1ccco1 678881288 CYWPRTSFIWEOOF-OAHLLOKOSA-N 329.465 5.047 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(-c3ccccc3)cc2F)c1 726456385 IEWPHDQICAQIDI-UHFFFAOYSA-N 346.430 5.283 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1ccc(Cl)s1 727263760 HNDJSPHUWKAQFC-SREVYHEPSA-N 331.849 5.421 30 20 EKED CCC(CC)(NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 731212871 VCKVXMCJFRAAGW-UHFFFAOYSA-N 342.870 5.047 30 20 EKED COc1ccccc1/C=C\C(=O)c1ccc(-c2ccccc2OC)cc1 741468586 FSOALPUQYCWOEE-NXVVXOECSA-N 344.410 5.267 30 20 EKED CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743094828 CMPBYUJFSGKGEE-CSODHUTKSA-N 349.478 5.288 30 20 EKED CCCCCC[C@H](C)NN=C1CCC(C#N)(c2ccccc2)CC1 743450965 VOQJUPLNEDBSTM-YMXDCFFPSA-N 325.500 5.326 30 20 EKED COc1ccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)cc1 750922385 OQPRZXFXNQKCBS-UHFFFAOYSA-N 329.614 5.101 30 20 EKED CC(C)(C)c1ccc(C=NOCc2nc(C(F)(F)F)cs2)cc1 752749595 DTXSKLGVGSRHRF-UHFFFAOYSA-N 342.386 5.010 30 20 EKED N#Cc1ccc(NC(=S)Nc2cccc3ccsc23)cc1Cl 752787458 DGTYEEMISRCADG-UHFFFAOYSA-N 343.864 5.235 30 20 EKED Cc1cc(C)c(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1C 753135501 RISOAEQUIFQICC-SNAWJCMRSA-N 334.444 5.026 30 20 EKED CC(C)n1cc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)cn1 760265798 VTBSAVXGGNSXMG-BJMVGYQFSA-N 341.263 5.045 30 20 EKED C#CCC(C)(C)C(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 767086166 OGXQFBCWQICGCX-KRWDZBQOSA-N 335.447 5.123 30 20 EKED CC(C)(C#N)CCCOC(=O)CCCc1csc2ccccc12 784099818 TZTPZFPJSHAIOR-UHFFFAOYSA-N 329.465 5.097 30 20 EKED C[C@H]1CCC[C@H](OCCCCCC(=O)OC[C@H]2CC[C@@H](C#N)CC2)C1 809090450 MGPKUYSFEGVWFM-HAGHYFMRSA-N 349.515 5.015 30 20 EKED C=C[C@](C)(CCOC)c1nc(-c2ccc(SC(C)(C)C)cc2)no1 809440222 MKKFAVVQCGEFJV-LJQANCHMSA-N 346.496 5.107 30 20 EKED C/C(=C\c1cccc(C(F)(F)F)c1)CNc1cccc(OCC#N)c1 809636046 OFCWXRQNUYGZHC-GXDHUFHOSA-N 346.352 5.123 30 20 EKED C[C@H](Nc1ccc(OC(F)(F)F)cc1Cl)c1cccc(C#N)c1 864020331 SEDBTOLVSVSKMG-JTQLQIEISA-N 340.732 5.283 30 20 EKED CCCCCCOCc1cccc(NC(=O)C2(C#N)CCCCC2)c1 920883579 BVEXZWAVXJWFJO-UHFFFAOYSA-N 342.483 5.196 30 20 EKED CCOc1cccc(C=Nc2ccc(Nc3ccccc3)cc2)c1O 920942641 AIJMXVPZBPAOPD-UHFFFAOYSA-N 332.403 5.285 30 20 EKED CC(CCCCCCC(=O)O)=NNc1cc(C(F)(F)F)ccc1F 1776053828 ZFMGRPYENIFMMX-UHFFFAOYSA-N 348.340 5.058 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1 48715472 DPBQRHQZIZNABW-IBGZPJMESA-N 338.863 5.152 30 20 EKED Cc1ccccc1[C@H](NCc1ccc(O[C@H](C)C#N)cc1)C(C)(C)C 175986942 QZPUJITXCJWBAK-UTKZUKDTSA-N 336.479 5.163 30 20 EKED C#CCCCC(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 192054826 ZHPPKTRNIXQRHF-UHFFFAOYSA-N 348.471 5.327 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2cc[nH]c2c1 194244094 HSHSTZKEBJGILX-UHFFFAOYSA-N 345.855 5.103 30 20 EKED C=CCCS[C@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 339089972 FBXLUAQMYGVIOW-SNVBAGLBSA-N 332.450 5.027 30 20 EKED Cc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)oc2c(C)cccc12 352225894 OYYGXMUUHIIROV-IBGZPJMESA-N 346.430 5.215 30 20 EKED N#CC1(CCCSCc2ccc(Cl)c(Cl)c2)CCOCC1 507504648 BVGGFMMYMCNDAV-UHFFFAOYSA-N 344.307 5.327 30 20 EKED C[C@@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(C#N)cc1F 512296953 UNAXXWSMJLQJBC-SECBINFHSA-N 340.732 5.125 30 20 EKED CC(C)(C)CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 519433780 CPPLUUUFWQAMAX-UHFFFAOYSA-N 344.402 5.086 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 524832552 ZAVRVFOJCQQKHB-QXSJWSMHSA-N 345.512 5.027 30 20 EKED N#CCc1ccc(NCc2cccc(OCc3ccc(F)cc3)c2)cc1 545365436 DRLIPIBCHFVDMX-UHFFFAOYSA-N 346.405 5.083 30 20 EKED CC(C)(CCC#N)CN[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 554363445 MEJSIUZPERGFNW-IBGZPJMESA-N 344.861 5.488 30 20 EKED N#CCCCCCC(=O)NCC1(c2ccc(Cl)cc2)CCCCC1 588337663 CKZRNBMBWWDOHY-UHFFFAOYSA-N 346.902 5.132 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(OCc2ccccc2)cc1C 605035580 QGZLWPPBUKUDBQ-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C[C@@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C#N)cc1 613667628 YJXYWQCAZYLXBC-LLVKDONJSA-N 340.295 5.385 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2ccccc2CCC(F)(F)F)C1 666315763 JWVQGIDNOXIKBG-CQSZACIVSA-N 340.389 5.002 30 20 EKED C#Cc1cccc(N(C(=O)c2cc3ccc(F)cc3s2)C(C)C)c1 728247519 GPRDLMFEHNVHBL-UHFFFAOYSA-N 337.419 5.077 30 20 EKED CC(C)Sc1ccc([C@@H](C)Nc2snc(Cl)c2C#N)cc1 728908843 DZSNBWSWWHBYHS-SNVBAGLBSA-N 337.901 5.342 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2ccccc2s1 734079628 SONVSRZHSXVLPU-CABCVRRESA-N 326.465 5.079 30 20 EKED C=CCCCCCN(C)C(=S)Nc1ccc(Cl)cc1Cl 739457834 LXQIOZCZHHCCIA-UHFFFAOYSA-N 331.312 5.368 30 20 EKED N#C[C@@H](NC(=O)C1CCCCCCC1)c1cccc(Cl)c1Cl 741687570 QMYSXXZACFHTNB-OAHLLOKOSA-N 339.266 5.035 30 20 EKED CCCCCC[C@@H](C)NN=Cc1c(-c2ccccc2)nn(C)c1Cl 743450559 MHXSDHJFSBGRTD-OAHLLOKOSA-N 346.906 5.023 30 20 EKED C[C@H](OC(=O)Cc1ccc(C#N)cc1)c1ccccc1-c1ccccc1 750411419 JBUPNXMMUHTROP-KRWDZBQOSA-N 341.410 5.072 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1nc(Cl)cs1 759083755 KWFFZXADLRSJOF-FPLPWBNLSA-N 346.864 5.125 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(C(C)C)cc2)c1 772985268 VQTOHUGBBYPFGI-LAUBAEHRSA-N 336.479 5.342 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(OC)c2ccccc12)c1ccccc1 773114814 KCADLMYQHPLIHD-JTSKRJEESA-N 329.443 5.264 30 20 EKED CC(/C=C/C(=O)c1ccc(C#N)s1)=C\c1ccccc1OC(F)F 811694238 UMLMTVQCKHXCMV-VTKKNFPDSA-N 345.370 5.064 30 20 EKED CC/C(=C/C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 817318639 FKPUXNDNKQCXAG-RPBSFSNWSA-N 332.447 5.031 30 20 EKED O=C1C(=Cc2ccc(-c3ccccc3F)s2)C(=O)c2ccccc21 912773435 QYFLWRLYDYSUJZ-UHFFFAOYSA-N 334.371 5.017 30 20 EKED CCc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc1C 66800221 MUSDWFZEYPWABV-GFCCVEGCSA-N 344.505 5.266 30 20 EKED C[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 122157626 HDDUKHIZNZHOFK-PXAZEXFGSA-N 328.868 5.099 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccccc1C#N 189892883 GCXZWKBQMKBYMC-BUHFOSPRSA-N 330.431 5.062 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)cc1 208009305 JKGQCEMUBDSEBV-KMGMULKOSA-N 333.431 5.072 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(F)(F)F)n1 296375057 RUGGHGBBWBCSIE-UHFFFAOYSA-N 348.368 5.205 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@@H](C)c1ccccc1 301749625 OOIKCXRNFUGGGP-CQSZACIVSA-N 333.884 5.110 30 20 EKED C=CCOc1cccc(NC(=O)Nc2cc(C(C)C)c(O)cc2C)c1 443573280 WCMXADVWXRPRMH-UHFFFAOYSA-N 340.423 5.033 30 20 EKED C=CCSc1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483232180 OOFZQKDVSZAOSI-SFHVURJKSA-N 344.439 5.003 30 20 EKED CCCN(CCC)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517902937 XFEIYBCUKKDKJJ-UHFFFAOYSA-N 337.423 5.004 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCC2CC2)cc1Cl 523708511 CDPXETPHUCHSGU-GOSISDBHSA-N 338.838 5.124 30 20 EKED C=CCC[C@@H](Nc1cccc(NC(=O)c2cccs2)c1)C1CC1 537397439 WXSIFFHMLOLYQL-QGZVFWFLSA-N 326.465 5.157 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 557272580 BEPWSRRORSKWQV-ACJLOTCBSA-N 333.262 5.689 30 20 EKED Cc1ccc(C)c([C@@H](NCc2ccc(CC#N)cc2)c2ccccc2)c1 564128348 CYHHOKJAPQVJQA-DEOSSOPVSA-N 340.470 5.249 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@H](C)c1ccc(C#N)cc1 583715962 IBILJWSMSAKZRO-VFNWGFHPSA-N 329.447 5.076 30 20 EKED C[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1F 611589180 MFUCETQECWZNJW-CQSZACIVSA-N 326.415 5.186 30 20 EKED Cc1cc(C#N)ccc1CSCc1csc(-c2ccco2)n1 614394807 VPCVCXLSFMMRTG-UHFFFAOYSA-N 326.446 5.017 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1nc2ccccc2o1 744039200 KKFWBUMBZNFTEQ-MGPUTAFESA-N 326.440 5.391 30 20 EKED CC(C)CC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCC1 757304680 LYZFGRDDGARUCQ-CYBMUJFWSA-N 346.883 5.342 30 20 EKED C[C@H](CC(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 773981703 CITGJAQCOLPONZ-HIFRSBDPSA-N 326.465 5.059 30 20 EKED COc1cc(C(=O)/C=C\c2ncc(C(C)(C)C)s2)ccc1SC 790599675 APSDSZJWFGEEHK-CLFYSBASSA-N 347.505 5.067 30 20 EKED CC(C)(C)c1cnc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)s1 790600288 JNQXNBAUSGEOMZ-FPLPWBNLSA-N 348.471 5.399 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)o1)c1ccnc(F)c1 794720362 QDDQZPKEWCXREE-FNORWQNLSA-N 327.742 5.030 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2-c2c(F)cccc2F)cc1C#N 799372045 JUKXMVOXKIRFRU-UHFFFAOYSA-N 348.352 5.064 30 20 EKED CC(/C=C\C(=O)c1cncc(F)c1)=C\c1ccccc1C(F)(F)F 799893924 WSMPHXHGNGEVTO-UGLNBITBSA-N 335.300 5.082 30 20 EKED C=CC[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccncc1 808697122 WIXIIPVHKNJLCT-PZJWPPBQSA-N 331.463 5.156 30 20 EKED C#C[C@H](NCc1cnc(C2CCCC2)s1)c1ccc(Cl)cc1F 809699257 MPHADLSSPKZFKW-KRWDZBQOSA-N 348.874 5.057 30 20 EKED Cc1ccc(N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 847154058 OHPRZAYUQCDZHI-OAHLLOKOSA-N 339.464 5.058 30 20 EKED C#Cc1cccc(NCc2cc3ccc(SC)cc3nc2Cl)c1 897129102 OPJSHLQGKLZNDM-UHFFFAOYSA-N 338.863 5.204 30 20 EKED CCCOc1c(/C=C\C(=O)c2cc(F)ccc2F)cccc1OCC 916135049 ZULUITIIZARWHG-FLIBITNWSA-N 346.373 5.048 30 20 EKED O=C(/C=C/c1ccc(Cl)c(F)c1)c1sccc1Br 921266189 WNZMOPDFEQVTBB-DUXPYHPUSA-N 345.620 5.199 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc2[nH]c(C(=O)O)cc2c1 1776786011 AHSQVTXRYIANCH-CQSZACIVSA-N 344.455 5.191 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 90666017 OMRHZGZUDAXABV-SUMWQHHRSA-N 348.368 5.123 30 20 EKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)Nc1ccc(C(C)C)cc1C(C)C 436314866 YZSDSAZIWNVDGU-XLIONFOSSA-N 344.499 5.036 30 20 EKED Cc1cncc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 467636211 PCJYZEYTEGOKCG-QZTJIDSGSA-N 341.458 5.341 30 20 EKED CCC1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CCCC1 473816956 IXAVQSKRUREYJH-OAHLLOKOSA-N 345.512 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(Cc2ccccc2)CC1 475568196 NGPZEPXTRLVBMW-UHFFFAOYSA-N 348.490 5.435 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(C(C)(C)C)n1 476091868 URSURTMNUTZZNL-UHFFFAOYSA-N 342.508 5.545 30 20 EKED C=CCSc1ccccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483232177 OOFZQKDVSZAOSI-GOSISDBHSA-N 344.439 5.003 30 20 EKED N#Cc1cccc(CSCc2cc(-c3ccc(Cl)cc3)no2)c1 517284707 MNBKDMPOPZPHGK-UHFFFAOYSA-N 340.835 5.300 30 20 EKED CC(C)Sc1ccccc1NCc1cccc(OCCCC#N)c1 532742980 VPHRTXPSRQYYEB-UHFFFAOYSA-N 340.492 5.482 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccccc1 534625528 JCEILCBJRJFYPS-QGZVFWFLSA-N 346.430 5.257 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 554943640 ZKQVTBQYYYNZOC-KRWDZBQOSA-N 349.474 5.386 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1OC1CCCC1 561139610 FDJAXFPGNFSJCA-QFIPXVFZSA-N 346.474 5.047 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2ccccc2)cc1 570136357 QAXZUEYNSZMTIJ-HXUWFJFHSA-N 347.462 5.247 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 609434017 XQEQQOROAQKIQD-MRXNPFEDSA-N 349.434 5.004 30 20 EKED C[C@H](Oc1ccc(-c2ccc(C#N)cc2)cc1)c1nc(C(C)(C)C)no1 609850276 JNQOTYKFABYUDD-AWEZNQCLSA-N 347.418 5.046 30 20 EKED CC(C)c1ccc(SCc2nnc(-c3cccc(C#N)c3)o2)cc1 610217780 DQGCGZBJWANQII-UHFFFAOYSA-N 335.432 5.024 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2ccccc2)s1 612572583 VUBKYKRJDMQIQW-CVEARBPZSA-N 332.472 5.699 30 20 EKED Cc1cc(C#N)ccc1CN[C@@H](C)c1cc(F)c(Cl)cc1Cl 614407712 XJHQXWLYNRAGPW-NSHDSACASA-N 337.225 5.163 30 20 EKED O=C(/C=C\c1ccc(OC(F)F)c(Cl)c1)c1ccc(F)c(F)c1 731489956 OSCZZOHFMRBJEX-KTAJNNJTSA-N 344.691 5.116 30 20 EKED CCN(C[C@H](C)C#N)C(=O)c1sc2cc(C(C)C)ccc2c1Cl 732655311 OUJCFEGMXRRVCX-GFCCVEGCSA-N 348.899 5.300 30 20 EKED FC(F)Oc1cccc(Cl)c1C=NNc1ccccc1Cl 732923442 BIYHICSCXSAFHZ-UHFFFAOYSA-N 331.149 5.041 30 20 EKED C=CCOc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1 741473456 PZLNVPJUDNXJBK-DHZHZOJOSA-N 341.410 5.210 30 20 EKED C/C(=C/C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)C(C)(C)C 742541119 XKROLAOVSVPIOJ-WJDWOHSUSA-N 348.446 5.068 30 20 EKED CCCCCCCCCC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 754564954 HJBJQVLKPZXBPZ-UXHICEINSA-N 349.490 5.303 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccccc1 773104635 FMJBLVHRJMKPBX-JPYJTQIMSA-N 326.443 5.164 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C/c2cccc3cnccc23)cc1Cl 782890446 ZMUPCWXUFJJJDK-SNAWJCMRSA-N 343.213 5.020 30 20 EKED COc1ccc2cc(NCc3ccccc3C(C)(C)C#N)ccc2c1 795287936 YFMDHJQOUDWANN-UHFFFAOYSA-N 330.431 5.262 30 20 EKED C=CCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 796761522 DNLQUEQEECNUMO-AWEZNQCLSA-N 344.867 5.242 30 20 EKED CC(C)CC1(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)CCCC1 797571569 PHDCFVVAYQCFCF-CQSZACIVSA-N 332.513 5.223 30 20 EKED CC/C=C(\C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 918622134 SORCHIIEZOGKLQ-XPUDNMOSSA-N 338.838 5.290 30 20 EKED Cc1ccc(-c2n[nH]cc2/C=C\C(=O)c2cc3ccccc3o2)cc1 920065105 IUYUEQADNSHUCD-KHPPLWFESA-N 328.371 5.027 30 20 EKED Cc1c(NN=C(CC(C)C)c2ccc(Cl)cc2)cccc1C(=O)O 1776086981 BBZOTNPFQBSONL-UHFFFAOYSA-N 344.842 5.209 30 20 EKED C[C@@H]1C(=Nn2c3ccccc3c3ccccc32)CC[C@@H](C(=O)O)C1(C)C 1776113013 SRZLIOSLFWFPRL-PBHICJAKSA-N 348.446 5.156 30 20 EKED CCC(CC)n1ccc(CNc2ccccc2S[C@H](C)CC#N)n1 269348256 RAYJNJCBJHAAGV-OAHLLOKOSA-N 342.512 5.251 30 20 EKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(C)cc3)cs2)c1 301493097 VWBMQJCKUHFPTQ-ZHACJKMWSA-N 335.428 5.023 30 20 EKED C=CCCc1ccccc1NCc1ncc(-c2ccc(OC)cc2)o1 409843087 GRCLLGLGAFYXNW-UHFFFAOYSA-N 334.419 5.081 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(F)cc1Cl)c1ccccc1 432486490 WHDJFJRMGFPHOD-INIZCTEOSA-N 345.805 5.036 30 20 EKED C=CCC[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 438850569 HVHHULSGPHYCEL-LEWJYISDSA-N 347.462 5.038 30 20 EKED C[C@H](SCc1coc(-c2ccc(F)cc2)n1)c1cccc(C#N)c1 443140194 BBGKWRUTUYTSLD-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cc(Cl)ccc1OC 531695219 BCSJMWDBPNDCNQ-SCLBCKFNSA-N 328.843 5.022 30 20 EKED CCCOc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 557508822 UNRMWPKLPKHPIY-ZHRRBRCNSA-N 334.463 5.075 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)CC2 563287260 UBYYMBMSFSLTMZ-GOTSBHOMSA-N 342.417 5.064 30 20 EKED Cc1cccc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c1C 566592931 OWIFECPFZLGFTK-AWEZNQCLSA-N 332.369 5.045 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCSc3ccc(Cl)cc31)CC2 569413806 XOJPXPDOWKMINF-ROUUACIJSA-N 340.879 5.026 30 20 EKED N#CC[C@H](Cc1nc(-c2cccc3ccccc23)no1)c1ccccc1 584197354 IDJOZTAAXMXRLD-GOSISDBHSA-N 339.398 5.130 30 20 EKED N#C[C@H](Cc1ccccc1)Sc1ccc(Cl)c(C(F)(F)F)c1 603451645 UVAGTHGQYBOBLN-ZDUSSCGKSA-N 341.785 5.586 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 606816645 HWAAGLPEQBXWMR-DLBZAZTESA-N 339.401 5.014 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1nc(-c2ccccc2)cs1 618807177 VEABSVSSIXQZIM-KUHUBIRLSA-N 345.471 5.020 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1cccc(Br)c1 834675873 LTIOLOJSLVMIQE-XQRVVYSFSA-N 327.630 5.060 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2CCCCC2)cc1 915353576 PCFGGXFHSAYRFE-NRFANRHFSA-N 347.462 5.044 30 20 EKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 917509889 GWVISVQKMGBPFS-QFSNBGPKSA-N 344.414 5.015 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)cc1 1776013453 ATXSDKQDSPHJNH-RDTXWAMCSA-N 330.472 5.415 30 20 EKED N#Cc1ccccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 20501745 MTIXNASHANSDCT-UHFFFAOYSA-N 347.226 5.332 30 20 EKED N#CCCCOc1cccc(N[C@H]2CC3(CCC3)Oc3ccccc32)c1 179818651 IWVXXACWJILQMC-FQEVSTJZSA-N 348.446 5.228 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1 303814156 VXLLQPBMDGHROO-ZHACJKMWSA-N 329.465 5.124 30 20 EKED N#CC1(CCSc2nnc(-c3cccc(Cl)c3)o2)CCCCC1 412988426 LTBVMPPXRDDAIY-UHFFFAOYSA-N 347.871 5.346 30 20 EKED CCc1ccc(CC)c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 438767363 QTWDVBVIVMPQFX-UHFFFAOYSA-N 349.478 5.126 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 446827414 OAWZJKSOBAYDDJ-RNJTYBCJSA-N 336.401 5.013 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 464486208 WQYMWLSDJZFKJR-INIZCTEOSA-N 332.447 5.152 30 20 EKED C=CCC1(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)CCC1 477706750 WKQBYNJPFWCIEP-UHFFFAOYSA-N 349.396 5.068 30 20 EKED C=CCC[C@@H](C(=O)Nc1cc(OC)ccc1Cl)c1ccccc1 488711475 OJGAKKJUZGPUDG-MRXNPFEDSA-N 329.827 5.037 30 20 EKED CC(C)C[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499609114 XEAQCAVTKLZJMX-LJQANCHMSA-N 348.918 5.117 30 20 EKED C=CCOc1ccc(CN[C@@H](CC(C)C)c2cccs2)cc1OC 520946887 SCFZLQHQTQZGQE-KRWDZBQOSA-N 345.508 5.199 30 20 EKED CC(C)c1ccc(NCCCC2(C#N)CCOCC2)c(C(C)C)c1 538610508 BWGAQXPMYYIGSE-UHFFFAOYSA-N 328.500 5.446 30 20 EKED N#C[C@@H]1CC[C@@H](N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 559149869 OYZBJNSFSJASAI-CKUKBARFSA-N 342.792 5.092 30 20 EKED C=CCC[C@H](N[C@H](C)c1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 560546345 ZTEQWRPLKJGQOT-QAPCUYQASA-N 348.412 5.767 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)F)cc1 609376778 JRROCXAJNGHMAK-LBPRGKRZSA-N 346.402 5.128 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2o1 614439794 KHUWCQGDJWVHJO-GOSISDBHSA-N 344.414 5.366 30 20 EKED C#Cc1cccc(N(C(=O)c2cc3c(F)cccc3s2)C(C)C)c1 728247811 HRJJRPHCQVBYQF-UHFFFAOYSA-N 337.419 5.077 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cccc(Cl)c1Cl 754725283 SJASUPGEUVNXMF-UHFFFAOYSA-N 334.124 5.425 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1CC#N 788483874 XPKCCDNUZNXBQY-UHFFFAOYSA-N 334.463 5.010 30 20 EKED Cc1nn(C(C)C)cc1/C=C\C(=O)c1cc(Cl)sc1Cl 798369880 UXRINJJEPDLPDH-PLNGDYQASA-N 329.252 5.037 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815636224 RDQZILVSJRNSOR-MOPGFXCFSA-N 342.870 5.521 30 20 EKED C#CCCCS[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 842178920 RNHSSMACTVTQBE-SNVBAGLBSA-N 341.263 5.251 30 20 EKED CC(C)(C)c1csc(NC(=O)c2ccsc2C(F)F)c1C#N 905774191 WMOQCLKPGRPARI-UHFFFAOYSA-N 340.420 5.169 30 20 EKED CC(=NNc1nccc2sccc12)c1ccc(Cl)cc1Cl 915980628 WSCBFJXAHDGHAV-UHFFFAOYSA-N 336.247 5.439 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccccc3)s2)cc1 1776113921 BYRVZODERJDTLC-BENRWUELSA-N 334.396 5.009 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)CC(C)C)cc1 1776786970 FXZRCRWLBNWEEW-LJQANCHMSA-N 349.515 5.015 30 20 EKED Cc1ccsc1C(=O)/C=C/c1c(F)ccc2sc(C(=O)O)cc12 1777477207 JKFDHPQWLQVZIN-DUXPYHPUSA-N 346.404 5.005 30 20 EKED N#Cc1cccc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)c1 47840328 CUYSUFIISIDOSW-LJQANCHMSA-N 338.863 5.152 30 20 EKED CCC(CC)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccs1 236682307 DPELSCDOUJZQRR-FOIQADDNSA-N 342.508 5.306 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(C)(C)C)cc1 327067551 CCZHXPDMNAZKCC-DLBZAZTESA-N 336.479 5.298 30 20 EKED C=CCC[C@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 435617434 NKDAGXHVYKHPTO-KRWDZBQOSA-N 330.378 5.453 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)cc1Cl 447556963 IHSOTMYCCZNDKK-WDEREUQCSA-N 337.225 5.416 30 20 EKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CCCC#N)c1ccccc1 464026918 AVDFMRSIQDIENC-HNNXBMFYSA-N 326.827 5.128 30 20 EKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474695488 CPUNBUPXLCPSHG-WMZOPIPTSA-N 346.430 5.040 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CCC)C1 475582214 JJEXKXYKDWHFAR-QGZVFWFLSA-N 328.500 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](CC)c1ccccc1 476084852 PUFULSODTNPNHP-GOSISDBHSA-N 335.491 6.061 30 20 EKED CC[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccccc1 504401279 LXIOSJVFVBIJHW-NRFANRHFSA-N 348.490 5.127 30 20 EKED N#Cc1ccc(SCc2ncc(-c3cccc(Cl)c3)o2)c(F)c1 524987682 XVBRSSHNSDWVFE-UHFFFAOYSA-N 344.798 5.298 30 20 EKED COc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)c2ccccc12 531696468 BIQRQIIRUPCYKV-JKSUJKDBSA-N 330.431 5.132 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1cccc(C#N)c1 537293829 INZOCWGZZURMPH-ORAYPTAESA-N 328.406 5.274 30 20 EKED N#Cc1ccc(CNCc2ccc(Sc3ccccc3)cc2)s1 538594245 XKXSXPDAJBNLCN-UHFFFAOYSA-N 336.485 5.061 30 20 EKED N#CCc1ccc(NC2CC(c3ccc(C(F)(F)F)cc3)C2)cc1 546962472 ZCZHJQIXNPPRDI-UHFFFAOYSA-N 330.353 5.130 30 20 EKED COc1cccc2cc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)oc12 550832273 DGRGCKIHFBKGNO-APWZRJJASA-N 348.446 5.527 30 20 EKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1Cl 561143626 DJBLHNNBSYZMIA-ZDUSSCGKSA-N 341.842 5.024 30 20 EKED N#CCCC[C@H](N[C@H]1CCCc2ccc(Cl)cc21)c1ccccc1 580175144 LFTUTJDNRWICRR-SFTDATJTSA-N 338.882 5.742 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 588148323 JOYSBWKWRAZHGC-UHFFFAOYSA-N 342.826 5.545 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC1(CC1)C2 626534554 RCVGOJQAVKDEAL-ROUUACIJSA-N 338.495 5.477 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(OC(F)F)c(Cl)c1 733748554 CCEWRVVTSIVIBU-DUXPYHPUSA-N 328.767 5.207 30 20 EKED Cc1ccc(-c2ncc(/C=C3/CCc4cc(O)ccc4C3=O)s2)cc1 734304274 GPDOEDWWWMYCHL-WJDWOHSUSA-N 347.439 5.037 30 20 EKED C=C(C)CNC(=S)Nc1cccc(CSC2CCCCC2)c1 734985115 BMWAQOVKLCRNIT-UHFFFAOYSA-N 334.554 5.115 30 20 EKED N#Cc1ccc(-c2cccc(CNc3nccc4occc34)c2)s1 742409111 RFAANBWXAZMPSO-UHFFFAOYSA-N 331.400 5.040 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)COC3)o1 742437624 VYRVMCRLOQBEID-VQHVLOKHSA-N 348.373 5.320 30 20 EKED CCCCN(C(=S)Nc1ccccc1C#N)[C@@H](C)c1ccccc1 745689250 WOWWRKUEYWLZDU-INIZCTEOSA-N 337.492 5.118 30 20 EKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 746416551 NNNMZEBPBZFWAE-QGZVFWFLSA-N 348.471 5.194 30 20 EKED C[C@@H]1CCC[C@H](CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C1 750667161 CHBBSXHSHUADHC-VYDXJSESSA-N 338.476 5.203 30 20 EKED C#Cc1cccc(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c1 770129315 OGTCZMYQFWLBIB-LJQANCHMSA-N 338.838 5.080 30 20 EKED O=C1/C(=C/c2scnc2C2CC2)CCSc2ccc(Cl)cc21 782340787 GFODOOMCPGFEBU-YRNVUSSQSA-N 347.892 5.436 30 20 EKED C[C@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1ccc(C#N)cc1 782783917 QUGCMCYSHQXZQS-LBPRGKRZSA-N 330.378 5.187 30 20 EKED C#CC[C@@H](NC(=O)Nc1c(CC=C)cccc1C(C)C)c1ccccc1 789457823 XIWVFEBKWZUTPG-OAQYLSRUSA-N 346.474 5.425 30 20 EKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(C(C)(C)C)cc1 793151557 WHVNYUVWTXNRDK-UHFFFAOYSA-N 334.463 5.062 30 20 EKED CC(=NOCc1cc(C)sc1C)c1nc2ccccc2n1C(F)F 920400124 AGNPCJVOHJDIBR-UHFFFAOYSA-N 349.406 5.051 30 20 EKED CC(CCCCCCC(=O)O)=NOCc1ccc(C(F)(F)F)cc1 1776112157 AVVNVEPWMAVXQR-UHFFFAOYSA-N 345.361 5.023 30 20 EKED C=CCN(Cc1cccs1)C(=O)c1cc(F)c(Cl)cc1Cl 61075053 FSGWMOBLBGORFD-UHFFFAOYSA-N 344.238 5.022 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CC[C@H](C)c2ccccc2)n1 161085099 MNMZGAKEFCANGF-GOEBONIOSA-N 326.465 5.027 30 20 EKED CCN(C(=O)c1cccc(SCC#N)c1)c1cccc2ccccc12 175599647 VCKXFDXCMXCKQZ-UHFFFAOYSA-N 346.455 5.122 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1sc(-c2ccccc2)nc1C 185845390 RWCDAZSFXSDGOP-ZBFHGGJFSA-N 342.508 5.240 30 20 EKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1ccc(Cl)cc1Cl 235216499 LDLAILPZDSVOLI-ZCFIWIBFSA-N 332.643 5.148 30 20 EKED CC(C)COc1cccc(NCc2cccc(OCCCC#N)c2)c1 236703832 SABRGLHVQQTNPQ-UHFFFAOYSA-N 338.451 5.016 30 20 EKED CC[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 447573957 JYBXYYRSXWLAAT-GOTSBHOMSA-N 344.433 5.528 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1Cc2ccccc2C1 475571436 MOAUTFINHUXODE-UHFFFAOYSA-N 348.490 5.170 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(C)(C)C)C1 475574090 VKDHZVWXYFUDKA-KRWDZBQOSA-N 328.500 5.438 30 20 EKED C=CC[C@@H](C(=O)Nc1cnn(C(CC)CC)c1CC)c1ccccc1 482692459 SIIBPOMCNDQQMO-GOSISDBHSA-N 339.483 5.105 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1ccccc1C)C(C)C 483571221 BHOANFLHNBDIPU-LJQANCHMSA-N 342.508 5.151 30 20 EKED CC(C)CCN(CCC#N)C(=O)c1ccc(-c2ccccc2Cl)o1 505192763 BSZFNPYFSDBNRO-UHFFFAOYSA-N 344.842 5.002 30 20 EKED C[C@H](Nc1cccc(F)c1C#N)c1ccc(Oc2cccnc2)cc1 519657727 GZOSSOYKTQVISC-AWEZNQCLSA-N 333.366 5.058 30 20 EKED Cc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542018118 RHZAEPMYIWSJIF-INIZCTEOSA-N 332.472 5.446 30 20 EKED C=CC[C@H](C(=O)N(CC)c1nc2ccccc2s1)c1ccccc1 548607574 VHBRKKIJLQBMLA-INIZCTEOSA-N 336.460 5.009 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 563643133 UBLPEWKZOPIDAL-XMSQKQJNSA-N 336.479 5.560 30 20 EKED C[C@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1cccc(C#N)c1 611438756 IKWQVVCTKHMZJU-JKSUJKDBSA-N 340.426 5.869 30 20 EKED Cc1cc(C)cc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)c1 730437576 SNHOWQMWAODFQN-YVMONPNESA-N 343.426 5.174 30 20 EKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2Cl)C(C)C)c1 734309169 OTSQKQOHOIJODI-GOSISDBHSA-N 342.895 5.005 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cccc(-c2ccncc2)c1 741471921 CYGIIDQQOMSXSY-CLFYSBASSA-N 336.394 5.193 30 20 EKED O=C(/C=C\c1csc2ccccc12)c1c(Cl)nc2sccn12 741843874 IXAWCVRSLWGNRD-WAYWQWQTSA-N 344.848 5.160 30 20 EKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3ccc(C(C)C)cc3)o2)cc1 748097949 UJORFBDYIVRXIP-INIZCTEOSA-N 349.434 5.280 30 20 EKED N#Cc1cccc(NC(=S)Nc2ccccc2-c2ccccc2)c1 750973888 LJOUJZYHXKKGNS-UHFFFAOYSA-N 329.428 5.034 30 20 EKED CC(C)(C#N)c1ccccc1CSC[C@H]1OCCc2ccccc21 767825772 YEEKHQOMABULNN-HXUWFJFHSA-N 337.488 5.035 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cc(Cl)ccc1O)c1ccc(F)c(F)c1 775557794 KLMFEQZBHKEKPW-ZMZPIMSZSA-N 337.797 5.292 30 20 EKED C=C(C)[C@@H](NCc1nc(Cl)ccc1Cl)c1ccc(F)c(F)c1 775725677 WYLRVWFQDRGGCO-MRXNPFEDSA-N 343.204 5.074 30 20 EKED CC(C)CCOc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1 777109264 QRCOVCYFPKXDRK-KRWDZBQOSA-N 338.451 5.187 30 20 EKED COc1cc2c(cc1NC(=O)CCCCCC#N)oc1ccccc12 807926475 SSWKNAVTXQKLHA-UHFFFAOYSA-N 336.391 5.007 30 20 EKED C=CCCC[C@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccccc1 883325037 MXLSYAMMNNTIAE-OALUTQOASA-N 342.508 5.182 30 20 EKED CC(C)c1ccc(SCC(=O)Nc2cc(Cl)ccc2C#N)cc1 71843184 UDTHLQMJOWIZRH-UHFFFAOYSA-N 344.867 5.066 30 20 EKED N#Cc1ccccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 110162431 GITWEDPGNIEEIW-UHFFFAOYSA-N 332.790 5.131 30 20 EKED CC(C)(C#N)CCCC[S@](=O)C(c1ccccc1)c1ccccc1 277794463 HLZYBSFAJSYMLO-DEOSSOPVSA-N 339.504 5.245 30 20 EKED N#CCCC[C@H](NC(=O)c1cc(Cl)ccc1Cl)c1ccccc1 352224826 CVJSPSMSKXSYKP-KRWDZBQOSA-N 347.245 5.158 30 20 EKED C[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 429760971 AAEDZOCVJMUKAQ-MAUKXSAKSA-N 349.434 5.003 30 20 EKED CC[C@H]1CC[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 433144560 MZAJTIMOGRUYCB-JYJNAYRXSA-N 345.512 5.171 30 20 EKED C=CCCCCCNc1cccc(CS(=O)(=O)C2CCCCC2)c1 447409040 TTYOZNDHIAMTII-UHFFFAOYSA-N 349.540 5.092 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccccc2)C1 475572305 IOGAOYBACQZVIJ-UHFFFAOYSA-N 346.474 5.470 30 20 EKED CC(C)c1ccccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 479656933 HESKTOAOHHWHTL-CTNGQTDRSA-N 347.462 5.114 30 20 EKED Cc1nc(-c2ccccc2)sc1CNc1ccc(C#N)c(Cl)c1 518895612 AUUXRJJDIPOGNW-UHFFFAOYSA-N 339.851 5.256 30 20 EKED C=CCOc1cccc(NC(=O)N(CC)[C@@H](CC)c2ccccc2)c1 519913241 ODUDYDUXTWOVSL-FQEVSTJZSA-N 338.451 5.257 30 20 EKED C[C@H](NCCCC#N)c1ccc(-c2ccccc2Br)s1 543428094 JMJRVHRPHTXLMA-LBPRGKRZSA-N 349.297 5.132 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C1CCC1)C1CCC1 571718008 JAUSUJFXCCQXEP-CQSZACIVSA-N 342.508 5.093 30 20 EKED C=C(C)[C@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccc(F)c(F)c1 575158127 WPUROFXWUJFFAF-XLIONFOSSA-N 347.380 5.007 30 20 EKED C=CCCC(=O)N(Cc1ccc(-c2ccccc2F)s1)C(C)C 588033957 JFIAXJBDDRZJBR-UHFFFAOYSA-N 331.456 5.257 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(-c2ccncc2)c1 619755192 BXKOOQUOTPISPK-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1 656688291 JDGHWLRIFGLYQC-JTQLQIEISA-N 345.302 5.530 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cc1 728695576 ZLXYXBRWTFCELK-KFRNIWOLSA-N 346.213 5.180 30 20 EKED O=C(/C=C/c1ccccc1-c1ccccc1)c1ccc2c(c1)COC2 742435178 QUKUYWIAWDBZTA-OUKQBFOZSA-N 326.395 5.280 30 20 EKED O=C(/C(=C/c1cncs1)c1ccccc1)c1nc2ccccc2s1 767718030 ISQMUQLYSWJPQR-XNTDXEJSSA-N 348.452 5.176 30 20 EKED C[C@@H](N[C@H](c1ccccc1)C1CCCCC1)c1ccc(OCC#N)cc1 776159141 IDBPJOLJWOUIPO-WZONZLPQSA-N 348.490 5.561 30 20 EKED COc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1OC1CCCC1 777639506 VWRZNBFVHAUHRL-OAHLLOKOSA-N 336.435 5.061 30 20 EKED Cc1cc(C(F)(F)F)ccc1C=NOc1ccccc1C(F)(F)F 785457406 LTPADSMYRLFRRR-UHFFFAOYSA-N 347.258 5.446 30 20 EKED C[C@H](CCC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797568955 YSBGMLSKXFNNTN-ZBFHGGJFSA-N 340.492 5.201 30 20 EKED CCc1cccc(CC)c1NC(=S)Nc1ccc(CCC#N)cc1 905644699 LTQHKWXRGKKLKC-UHFFFAOYSA-N 337.492 5.076 30 20 EKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(CCC#N)cc1 932582170 YTKQCIREYOHSRN-AWEZNQCLSA-N 341.842 5.021 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)n1 80449280 SSUFZYLGFBAXLY-SNVBAGLBSA-N 339.247 5.063 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 90665547 OBJWDESEPBQLPD-KSSFIOAISA-N 332.369 5.401 30 20 EKED N#C[C@H](C(=O)c1coc2ccccc12)c1nc(-c2ccccc2)cs1 113653827 HXUBOPXHBGKPOK-OAHLLOKOSA-N 344.395 5.046 30 20 EKED N#Cc1c(Cl)nsc1N1CCC[C@H]1c1cccc2ccccc12 301933035 QBBNHKYYYANOTR-INIZCTEOSA-N 339.851 5.163 30 20 EKED Cc1ccnc(Oc2cc(N[C@H](C)c3ccc(C#N)cc3)ccc2C)c1 439622552 ZHLYJYTWBPICRK-QGZVFWFLSA-N 343.430 5.536 30 20 EKED N#Cc1cccc(COc2cccc(NCCCCC(F)(F)F)c2)c1 443469739 SIYKZOQMRVWYAW-UHFFFAOYSA-N 348.368 5.282 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC(C)(C)C1 443595049 SVMUZKRSAADREA-LSDHHAIUSA-N 345.512 5.171 30 20 EKED C=CCC[C@H](C(=O)Nc1cc(-c2ncc[nH]2)ccc1C)c1ccccc1 477981531 HBODBSHDQNEGMH-IBGZPJMESA-N 345.446 5.074 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 489065473 ALJUQEHMOXMNAN-FQEVSTJZSA-N 344.414 5.172 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccccc1 535353030 CDDPJGJCTNYIEE-OXJNMPFZSA-N 339.866 5.363 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)sc1Cl 536840774 VVICJAWPKYIICW-BXUZGUMPSA-N 339.291 5.751 30 20 EKED N#CCCCCN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl 541390637 JJHABGBSOFQOTN-SFHVURJKSA-N 333.262 5.366 30 20 EKED COc1cccc2cc([C@H](C)N[C@H](CCCC#N)c3ccccc3)oc12 550832275 DGRGCKIHFBKGNO-QFBILLFUSA-N 348.446 5.527 30 20 EKED C=CCC[C@@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccco1 584366856 QKNBGAAAYNROTR-QGZVFWFLSA-N 340.467 5.692 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OCC)cc2)cc1Cl 589639071 KLKVPPBXAWBWGC-HNNXBMFYSA-N 345.870 5.154 30 20 EKED C[C@@H](Nc1ccccc1NC(=O)CCCCCC#N)c1ccccc1 594355982 XTGZMEQNPBSWGE-QGZVFWFLSA-N 335.451 5.272 30 20 EKED CCC(C)(C)OCc1cccc(NCc2cccc(F)c2C#N)c1C 600851998 YCJFHAJUQDQYPO-UHFFFAOYSA-N 340.442 5.323 30 20 EKED C[C@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccc(C#N)cc1 611166999 NQYXGDBCKRNGIV-APPDUMDISA-N 331.246 5.203 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1c(F)cccc1Cl 614178698 AVWBGXYYNJMQGE-CYBMUJFWSA-N 330.834 5.131 30 20 EKED N#CCCCNC(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 752525873 DGXUWHJRDJSPEW-UHFFFAOYSA-N 348.233 5.086 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccc(Br)cc1)c1ccncc1 766020948 RPSJFHOZOASQDU-ROUUACIJSA-N 345.284 5.202 30 20 EKED CC(C)[C@@H]1/C(=C/c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 766505490 JCICBZDKIHKZGE-LOHYDARVSA-N 346.455 5.225 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccccc1 773118073 YKNSGMPIYQKMHP-CVDCTZTESA-N 332.491 5.092 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2cc(Cl)c(N)c(Cl)c2)s1 773163871 ZYHGESPFDHXWTD-ONEGZZNKSA-N 341.263 5.052 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2cc3ccccc3o2)c(C(F)(F)F)c1 811685614 XQNXGFGYEWUFJS-BQYQJAHWSA-N 341.288 5.219 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)o1 818235733 UUAQTNMNDZLCGW-VQHVLOKHSA-N 339.372 5.121 30 20 EKED CC(CC1(C(=O)O)CCC1)=NNc1c(Cl)cc(Cl)cc1Cl 1776014579 NGJNPSMQUDGXGH-UHFFFAOYSA-N 349.645 5.080 30 20 EKED Cc1cccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 65680124 IWWCAVMVBNNNKQ-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H](CCC#N)c3ccccc3)oc12 182052457 VNXNFFBDINLCHS-QFBILLFUSA-N 348.446 5.527 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1ccc(C(F)(F)F)cc1 182241798 WQAWPKPODIBANB-STQMWFEESA-N 334.341 5.169 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 195656631 SLIMJTVMBARDSX-AWEZNQCLSA-N 348.368 5.561 30 20 EKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1cc(C#N)cs1 237165104 DOVRFEZQPMVEQB-KRWDZBQOSA-N 348.899 5.159 30 20 EKED Cc1cccc([C@H]2CCCCCN2CCCC2(C#N)CCOCC2)c1 410381895 YAKZHQYDFCATEM-OAQYLSRUSA-N 340.511 5.013 30 20 EKED C[C@H]1CC[C@H](N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 429748839 CADUTCQGGIMVDR-YJBOKZPZSA-N 349.434 5.003 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@H](C)c2ccc3ccccc3c2)s1 439795323 RLUHWEMLFLDPQV-CYBMUJFWSA-N 334.444 5.078 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(C)cccc1Cl 470636934 OMTWHBCLBIGHSP-UHFFFAOYSA-N 328.843 5.259 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C1CC1 475559781 QJCBRWFWPWMFQX-UHFFFAOYSA-N 348.490 5.735 30 20 EKED Cc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)oc2c(C)cccc12 483200750 LZJHGWSTTUXDRE-GOSISDBHSA-N 340.382 5.088 30 20 EKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)cc1Cl 483713316 RWLREOFTURIVIZ-ZDUSSCGKSA-N 332.856 5.027 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2ccc(C)cc2[nH]1 497476467 ZERABHTUMIPPPP-UHFFFAOYSA-N 344.867 5.020 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CC1CCCCC1 510881503 WLFVXBQEMHEULX-HOTGVXAUSA-N 344.524 5.626 30 20 EKED CCC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 521420123 AXFLZDANMNHVJJ-NRFANRHFSA-N 349.478 5.020 30 20 EKED N#Cc1ccc(CNC2(c3ccccc3)CCCC2)c(C(F)(F)F)c1 562206072 LNUZJQXRFFKUDV-UHFFFAOYSA-N 344.380 5.136 30 20 EKED CC(C)c1nc2ccc(NCc3cccc(F)c3C#N)cc2s1 600850515 ZCKXTWOZKVRWFL-UHFFFAOYSA-N 325.412 5.043 30 20 EKED N#Cc1cccc(CNCc2ccc(-c3cccc(Cl)c3)s2)c1 608982474 SYBKHZKPVUCLQH-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1c(F)cccc1Cl 609384701 JFKQWCZATGSNKM-GFCCVEGCSA-N 334.847 5.343 30 20 EKED C[C@@H](Sc1ccc(Cl)cc1C#N)c1nnc(-c2ccccc2)o1 610655279 XZBGPZJHDWKRKB-LLVKDONJSA-N 341.823 5.115 30 20 EKED C[C@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1cccc(C#N)c1 610829839 OIDZZKALPYQGEI-UWVGGRQHSA-N 325.264 5.338 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1cccc(C#N)c1 610829992 WBLGCHSDMVOOHA-CVEARBPZSA-N 332.472 5.699 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2nccc3ccccc23)cc1 611346150 CJGKWQCTQNJBRE-UHFFFAOYSA-N 349.437 5.063 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3c(Cl)cccc32)cc1Cl 619755385 GYIATHMQWSEZRS-SFHVURJKSA-N 331.246 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc2[nH]ccc2c1 789719385 OVZTXLHGXFEHMW-ZRDIBKRKSA-N 344.458 5.672 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCCCCC1 836389093 YAXDLLURAYOIFX-INIZCTEOSA-N 345.512 5.269 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2cc(OC)ccc21 861269186 NWBDRRUSMYPJJG-OAQYLSRUSA-N 349.474 5.216 30 20 EKED C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352221 IWIYRNBDBIJFNF-MAODMQOUSA-N 347.462 5.042 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1cc2ccccc2o1 96403333 IWIZAJHBJCJCRM-KHPPLWFESA-N 331.396 5.452 30 20 EKED C[C@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1cccc(C#N)c1 153736098 UEEVSRMFAPCUKI-LSDHHAIUSA-N 333.460 5.094 30 20 EKED N#CCSCCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 466626105 NXSCKATXSBAMFB-GOSISDBHSA-N 347.936 5.809 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 466656976 XWZVAVTVWYANFG-CHWSQXEVSA-N 346.471 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC(C)(C)OC1(C)C 475548423 QNNOUYVCSLIFDU-QGZVFWFLSA-N 344.499 5.006 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C#N)s2)cc1)c1ccccc1 487707116 ZGVVQQMFXPFRSV-CQSZACIVSA-N 347.443 5.045 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(C)cc1 505030823 ZWEWREXCUWCXIM-NRFANRHFSA-N 334.463 5.483 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)cc1 537103017 FYCIFPMXXRQGTM-MRXNPFEDSA-N 338.520 5.451 30 20 EKED C=C(C)C[C@@H](C)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 577560619 DIZOLPDOCDZXAM-MFKMUULPSA-N 328.309 5.217 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610089497 YQUFBIHHMINYAK-INIZCTEOSA-N 346.861 5.729 30 20 EKED C[C@@H](N[C@H](C)c1cc(Cl)sc1Cl)c1cccc(C#N)c1 610829838 OIDZZKALPYQGEI-NXEZZACHSA-N 325.264 5.338 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc2cc(OC)ccc2c1 610829872 QCYQYAYRSDGRMV-WAIKUNEKSA-N 344.458 5.522 30 20 EKED CCC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 614179320 OBWXBRJGEWOUQC-FQEVSTJZSA-N 342.433 5.397 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N(C)[C@@H](C)CC#N)sc2c1 732656867 FVXBCOOZPQUOPA-NSHDSACASA-N 334.872 5.052 30 20 EKED CC[C@@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 738415485 DYVOOTNVZMEOFW-XZOQPEGZSA-N 344.433 6.044 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(N2CCCCC2)cc1 740764388 UIQRTRIGWYHXSF-OUKQBFOZSA-N 342.442 5.121 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)(C)C 744034901 FXENSNLSZSUYPH-OFFHKIPUSA-N 332.856 5.118 30 20 EKED C=CC[C@@H](NC(=O)C/C=C/c1ccc(C(C)C)cc1)c1ccncc1 764242392 HCQHODBDYWTCHT-GZNAHNRGSA-N 334.463 5.042 30 20 EKED CC(C)[C@@H]1CCc2ccccc2[C@@H]1NCc1ccc(O[C@H](C)C#N)cc1 764977288 NBTNNGIQRZMRRY-FRGLQRNOSA-N 348.490 5.027 30 20 EKED C=CCC[C@@H](N[C@@H]1COCc2cccc(Cl)c21)c1ccccc1 788668485 BEETZKNOYOSAPH-RTBURBONSA-N 327.855 5.208 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(SC(F)F)cc1 800154912 ZQFIGWCADXAFDI-UHFFFAOYSA-N 333.403 5.372 30 20 EKED CC(C)CC(=NNc1ccc(C(F)(F)F)cn1)c1cccs1 917534066 NYJHXZQFDJKIBX-UHFFFAOYSA-N 327.375 5.024 30 20 EKED COc1cc(C(=O)/C=C/C(C)=C/c2ccccc2)ccc1OC(F)F 60058960 HBWICEDXRRCBIJ-SHQVAAIUSA-N 344.357 5.139 30 20 EKED C=CCN(C(=O)c1ccc(Sc2ccccn2)cc1)c1ccccc1 60291310 FJPOUIYAZUPYNO-UHFFFAOYSA-N 346.455 5.066 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(O[C@@H](C)CC)c1 63164417 JYPJXPVPXOTXGH-KRWDZBQOSA-N 338.451 5.084 30 20 EKED CC(C)CCc1nc(CNc2cccc(OCCCC#N)c2)cs1 83135461 PPVNQDNVZKGMKC-UHFFFAOYSA-N 343.496 5.026 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 90664942 HUUTWZVLPTVYKW-RDTXWAMCSA-N 332.369 5.401 30 20 EKED N#CCCCOc1cccc(NCc2csc(-c3ccccc3)n2)c1 122830939 KQBPYDVDUJHZNC-UHFFFAOYSA-N 349.459 5.105 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2nc(C)ccc2o1 189900989 PYZWGTBNFKSUJJ-UHFFFAOYSA-N 334.419 5.240 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccn(C2CCCC2)n1 268628459 PKWLXVGKPHUHEH-HNNXBMFYSA-N 340.496 5.005 30 20 EKED C[C@H](N[C@@H](C)c1nccs1)c1ccc(-c2cccc(C#N)c2)cc1 367805493 XFBYVZFXGNXIIH-GJZGRUSLSA-N 333.460 5.094 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(F)cc1)c1ccccc1 435100129 CAHWOXUVSZMYAA-OXJNMPFZSA-N 340.442 5.236 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1 470243577 ZXPAHTTUKRXQHX-UHFFFAOYSA-N 344.405 5.409 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)Nc2csc3ccccc23)cc1 490776240 ZPVNBNHXGIZLTR-UHFFFAOYSA-N 335.432 5.346 30 20 EKED CC[C@H](SCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 507692219 BNHFWZUYNFXVJR-KRWDZBQOSA-N 337.916 5.625 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)c(Cl)c1 517461642 ZERIBAOGCLCTGO-OLZOCXBDSA-N 348.874 5.904 30 20 EKED Cc1cc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc(C)c1F 537427949 ZOSYUNWWTQDLJN-MRXNPFEDSA-N 326.415 5.298 30 20 EKED Cc1cc2cc([C@H](C)N[C@H](CCC#N)c3ccccc3)oc2cc1C 540149553 VTPRHHTZRDXLPQ-FXAWDEMLSA-N 332.447 5.745 30 20 EKED C=C(C)C[C@H](C)C(=O)N(c1ccccc1)c1nc2ccccc2s1 546629820 JMEASZOLEUICPU-HNNXBMFYSA-N 336.460 5.563 30 20 EKED N#CCCCOc1cccc(CN[C@@H]2CCCC[C@H]2c2ccccc2)c1 559072233 YQCGKTGHJNXEMI-XZOQPEGZSA-N 348.490 5.185 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(Cl)c1Cl 561129781 BCXGBEYYFCXZKZ-KRWDZBQOSA-N 331.246 5.032 30 20 EKED CN(C(=O)CCCCCC#N)[C@H](c1ccc(Cl)cc1)C1CCCC1 588760251 YGHXQBWLARJTNE-FQEVSTJZSA-N 346.902 5.504 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2cccc(F)c2)s1 618742791 SJIDTKGENPKSRQ-HXUWFJFHSA-N 348.446 5.203 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(OC(C)C)cc1 732625973 WQYCIMZLHRUUCV-UHFFFAOYSA-N 346.540 5.239 30 20 EKED O=C(/C=C\c1cccc(F)c1F)c1ccc(SC(F)F)cc1 734980015 GLWOADFVOOPQTJ-TWGQIWQCSA-N 326.314 5.176 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](CC(C)C)c2ccccc2)c1 749129384 QRAAZEQZXVWHMA-IRLDBZIGSA-N 336.479 5.245 30 20 EKED CC/C(C)=C(/C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 779853539 QMEZVKIJVFFJCJ-MSUUIHNZSA-N 348.446 5.017 30 20 EKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 795992921 RXOAYELKSLHWQD-WMLDXEAASA-N 327.811 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sccc1C(F)F 822365061 PETGVWQWGWLAQS-UHFFFAOYSA-N 335.419 5.790 30 20 EKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1nc(C)sc1C 916543599 URHICRSUUSFCJB-UHFFFAOYSA-N 338.480 5.070 30 20 EKED C=CCN(C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)C(C)C 918058282 HEKPNGSZBRBZDT-IBGZPJMESA-N 342.870 5.035 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(C#N)c1 43171135 HAZOXQVBNAVBSM-UHFFFAOYSA-N 349.478 5.469 30 20 EKED C[C@H]1C[C@H](N[C@H](CCC#N)c2ccccc2)c2ccsc2S1 90665811 DELGUWZUKWGUOZ-XKQJLSEDSA-N 328.506 5.308 30 20 EKED C=C(C)[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(F)c(F)c1 187372860 FMLLNNPZSWKGAN-QGZVFWFLSA-N 346.402 5.088 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ncccc1CSC 292373642 QPZCNHYGZYVAHM-UHFFFAOYSA-N 340.492 5.049 30 20 EKED CCCCN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@@H](CC)c1ccccc1 455271775 JJJBZVUXQPOAMF-IHPCNDPISA-N 341.499 5.032 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)s2)c(C)c1 487738599 KPHIRPLSMKDTTF-LBPRGKRZSA-N 330.478 5.071 30 20 EKED N#Cc1ccccc1CSCc1csc(-c2ccc(F)cc2)n1 498119278 HTFUUGHAODQYAQ-UHFFFAOYSA-N 340.448 5.254 30 20 EKED C[C@H](NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 503350054 VHFQBRRLFCZJGP-JXFKEZNVSA-N 349.478 5.096 30 20 EKED Cc1cc(-c2ccccc2)ccc1NCCCC1(C#N)CCOCC1 537508388 LRYCDBSUFKAOJP-UHFFFAOYSA-N 334.463 5.175 30 20 EKED COc1cccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c1 540314485 PNBOBPMDFPWWDU-QGZVFWFLSA-N 342.442 5.085 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(C#N)c1 540469683 ZEPWTCYXDZLMJE-UHFFFAOYSA-N 340.854 5.711 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2cc(Cl)ccc2o1 540607337 PTTXCOZRECHLGW-KSSFIOAISA-N 338.838 5.782 30 20 EKED C[C@H]1CCC[C@H](OCc2cccc(NCc3ccc(C#N)s3)c2)C1 552554255 BFTWLKZPXMXLBF-YJBOKZPZSA-N 340.492 5.327 30 20 EKED Cc1ccc2c(c1)[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)CCC2 574085315 ZAYNUYWROXKYCR-IBGZPJMESA-N 344.380 5.053 30 20 EKED N#CC[C@H](Cc1nc(-c2ccc3sccc3c2)no1)c1ccccc1 589128349 CVBATPFVIKNPDQ-OAHLLOKOSA-N 345.427 5.191 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@H]1Cc1ccccc1Cl 590507195 YTHGMHKKOIRTTM-SFHVURJKSA-N 346.902 5.128 30 20 EKED CCC(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603759065 SQCHGLOUYZEIPQ-SFHVURJKSA-N 340.854 5.370 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 604629663 RUUIYHLHPCSQNK-QGZVFWFLSA-N 338.451 5.257 30 20 EKED C[C@H](CC#N)OC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 733710584 CUJAZCZWZNHMFR-CXAGYDPISA-N 345.851 5.019 30 20 EKED CCCCCCCCCC(=O)N1CCCC[C@H]1c1noc(C2CC2)n1 737626281 HMFMEXUFTZAKAI-KRWDZBQOSA-N 347.503 5.141 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 746015093 NWAKEWRWLHKNRF-VQHVLOKHSA-N 339.372 5.121 30 20 EKED CC1(CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)CCCCC1 753541315 QXWHXEDJMRAHQV-MRXNPFEDSA-N 338.476 5.347 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)s1 758424259 TXYBQMJLXCXAQC-SREVYHEPSA-N 325.355 5.181 30 20 EKED COc1cccc2cc(C(=O)/C=C\c3cnc(C4CCC4)s3)oc12 760264910 SNSVQZRYIBYQLH-HJWRWDBZSA-N 339.416 5.062 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1cnc(-c2ccco2)s1 789141105 AFTCDEQOCPQMOI-SZUMLMDFSA-N 345.470 5.225 30 20 EKED COc1ccc(C(=O)/C=C\c2ccc3ncccc3c2)c2ccccc12 916547050 ZLACLBQDRWNZNH-XFXZXTDPSA-N 339.394 5.293 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cccs3)cc2)cc1 1777671108 DMEWEHHIXJTHBJ-LFYBBSHMSA-N 334.396 5.009 30 20 EKED CCC1CCC(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)CC1 5819535 OYZITXKNUGHHKV-UHFFFAOYSA-N 333.431 5.347 30 20 EKED N#CCCSc1ccccc1NC(=O)c1csc2ccccc12 108201205 LITLGTFLDSCUEW-UHFFFAOYSA-N 338.457 5.159 30 20 EKED COc1c(Cl)cc(Cl)cc1CN[C@H](CCC#N)c1ccccc1 130472196 NIKMNFBOXJMZKL-QGZVFWFLSA-N 349.261 5.137 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Cl)s1 130661696 IKJHJMIGCRQYHJ-UPHRSURJSA-N 337.878 5.483 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1C 192893511 DSKKTKVIYFULAU-UHFFFAOYSA-N 327.855 5.753 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c(C)c1 454643688 TWBDNRRXNHDBJF-PMPSAXMXSA-N 345.512 5.090 30 20 EKED N#CC[C@@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 474083432 VVXUEWXWNRFYHH-ZDUSSCGKSA-N 333.218 5.019 30 20 EKED C=CCN(Cc1coc(-c2cccc(Cl)c2)n1)Cc1cccs1 502537997 NTBZXBMHBJWKRG-UHFFFAOYSA-N 344.867 5.245 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 519426021 DDTPJVFSKHFZNW-OAHLLOKOSA-N 338.476 5.314 30 20 EKED N#C[C@H](Sc1nnc(-c2ccc3ccccc3c2)o1)C1CCCCC1 522332846 QKILRJITVJKRCW-SFHVURJKSA-N 349.459 5.454 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@H](C#N)C3CCCCC3)o2)cc1 522333209 KVTLGPAVOHDIFF-QGZVFWFLSA-N 341.480 5.425 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccc4occc4c3)cc2)ccn1 570640421 NERKJGUYIGCXDY-UHFFFAOYSA-N 341.370 5.104 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@@H](CCCC#N)c1ccccc1 572065018 MMCRLBHSCFDHPO-VXKWHMMOSA-N 348.490 5.442 30 20 EKED C=CC1CCN(C(=O)Nc2ccccc2SC2CCCC2)CC1 601110849 IHDUFIXGOHOFIA-UHFFFAOYSA-N 330.497 5.151 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)Oc2ccc(Cl)cc21 729150999 MGPHVDHYGZVPST-NSIKDUERSA-N 345.832 5.141 30 20 EKED CCCCC[C@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 742654357 UYIQLCXWORMCEV-JKSUJKDBSA-N 332.513 5.626 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1nc2ccccc2n1C 744010284 FTLAGOSNTNAQAU-KKSFZXQISA-N 339.483 5.136 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1ccc(-c2ccncc2)cc1 745192278 CSHSISCMPOYNHJ-UHFFFAOYSA-N 338.414 5.133 30 20 EKED N#Cc1cccc(CNc2ccccc2SCc2ccccc2)c1 780659370 OCSZSUKIOLUCGA-UHFFFAOYSA-N 330.456 5.463 30 20 EKED CCC[C@@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccsc1 785566553 GJKKCTWTHMTUCO-IEBWSBKVSA-N 328.481 5.060 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1sc(C(C)(C)C)nc1C 915110011 LLTHPESWYUAGRF-UHFFFAOYSA-N 338.480 5.133 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1Cl 915917840 QMQOCPZNYATFOC-UHFFFAOYSA-N 348.155 5.243 30 20 EKED N#CCOc1ccc(C(=O)/C=C/c2ccccc2-c2ccccc2)cc1 917516921 IGLYYRJWMDHAIE-NTCAYCPXSA-N 339.394 5.152 30 20 EKED CC[C@@H](C)c1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776698233 IYRALTQGGBLMPN-PILJQMSFSA-N 338.403 5.012 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\c2nc3cc(Cl)ccc3s2)cc1 208265946 QRNQLIGIZCMJSL-REPPVQDKSA-N 340.835 5.411 30 20 EKED CC(C)C[C@H](NCc1cccc(OCCCC#N)c1)c1cccs1 236649615 BKVUZQHELJNVES-IBGZPJMESA-N 342.508 5.308 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)ccc2SC1 329025207 VCCFBYJSPQFLHV-VHDGCEQUSA-N 344.480 5.575 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2cccc(Cl)c2)o1 436135751 YKTQZGYISVJCFP-UHFFFAOYSA-N 335.860 5.202 30 20 EKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1cc2ccccc2o1 467112571 XGGRZFKQRQPRCJ-AWEZNQCLSA-N 337.444 5.202 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc2ccsc12 501248294 XAHRVKFXTYMMRL-UHFFFAOYSA-N 349.459 5.217 30 20 EKED C=CCCc1ccccc1NC(=O)CCCC(=O)c1ccc(C)cc1 504265136 MIFSTFRMVVSGLF-UHFFFAOYSA-N 335.447 5.105 30 20 EKED CC(C)(C#N)CCCN1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 511079364 FNMDYQXLJWKIQG-MRXNPFEDSA-N 338.417 5.215 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(Cl)c(F)cc1Cl 512778151 COERZENKCBGHRD-UHFFFAOYSA-N 338.209 5.503 30 20 EKED C=CCCC(=O)N(Cc1cccs1)C12CC3CC(CC(C3)C1)C2 516681536 NXOAPBMZXNHVIL-UHFFFAOYSA-N 329.509 5.012 30 20 EKED C[C@@H](Nc1ccc(C#N)cc1F)c1ccc(Oc2cccnc2)cc1 517051034 RYJTVGGBCNIPFI-CQSZACIVSA-N 333.366 5.058 30 20 EKED C=CCCCCCN(C)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 532968985 SGNCVASEFPDTMH-AWEZNQCLSA-N 333.863 5.129 30 20 EKED CC(C)[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1 533693378 NXVPAIIVRINKDY-IBGZPJMESA-N 338.426 5.005 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(Cl)cc1Cl 561136851 GLHGSEXGJPHPNP-SFHVURJKSA-N 331.246 5.032 30 20 EKED Cc1cccc2cc(C(=O)N(C)c3cc(Cl)ccc3C#N)sc12 568556366 RBEIUCJDUZKKHW-UHFFFAOYSA-N 340.835 5.011 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@H](CC)c1ccc(C)cc1 606163298 QVEAMSDFRKDZLC-KRWDZBQOSA-N 327.493 5.155 30 20 EKED O=C1/C(=C/c2ccc(OC(F)F)c(Cl)c2)CCc2sccc21 731489545 HPMKPIBEYBIHGZ-JXMROGBWSA-N 340.778 5.215 30 20 EKED O=C(/C=C\c1ccc(F)c(F)c1)c1ccc(SC(F)F)cc1 734982192 YSZNSHMPCUMYJV-WAPJZHGLSA-N 326.314 5.176 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3ccccc3)n2)cc1 773982927 NEUWHQRNXFYFFR-CRAIPNDOSA-N 346.455 5.099 30 20 EKED O=C(/C=C/c1ccc(F)nc1)c1ccc(Cl)c(Cl)c1Cl 777464504 XDTOAGLPFBBOHH-ORCRQEGFSA-N 330.573 5.077 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(-c2ccncc2)cc1 782343136 VCJKRTGTZRLUJH-KRXBUXKQSA-N 336.394 5.193 30 20 EKED Cc1ccc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)o1 789126457 FGZKBZNOCBSKMP-FPLPWBNLSA-N 329.808 5.261 30 20 EKED C=CCCCCCCNC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 806004035 YHJNPUMZXXFGIA-HNNXBMFYSA-N 345.512 5.135 30 20 EKED N#C[C@@H](C(=O)C1(C2CCC2)CCC1)c1nc2cc(Cl)ccc2s1 835074557 STHWGALCOOCJKU-ZDUSSCGKSA-N 344.867 5.096 30 20 EKED Oc1ccc(Cl)cc1C=Nc1ccc(OC(F)F)c(Cl)c1 920942828 FYIQMOKVCXOURO-UHFFFAOYSA-N 332.133 5.051 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(F)c(C(=O)O)c(F)c2)cc1 1776700022 PBTPUBUMCOTWBB-REPPVQDKSA-N 344.357 5.073 30 20 EKED O=C(/C=C/c1ccc2oc(C(=O)O)cc2c1)c1ccc(C2CCC2)cc1 1777569921 FRRKUMLERIBEAO-ONNFQVAWSA-N 346.382 5.295 30 20 EKED CCC[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 59281309 ULHNSKXFKVWCHV-KSSFIOAISA-N 340.854 5.370 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 90664894 LWTVLGXPBXNPOU-RDTXWAMCSA-N 348.368 5.281 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C(C)(F)F)c1 187022948 FBMBFSWTJYDCDX-UHFFFAOYSA-N 336.407 5.080 30 20 EKED CC(=C/c1ccccc1)/C=C/C(=O)c1ccc(NC(=O)NC(C)C)cc1 208021177 DGIUAJWHMMQHBA-TWDLCZSNSA-N 348.446 5.059 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cc(C)oc1C 475584978 UJZPFTQMHBDCIP-OAHLLOKOSA-N 340.467 5.631 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 476976056 VBPZIVUWGVJIOA-UHFFFAOYSA-N 348.490 5.816 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2cccc(C#N)c2F)cc1 538203488 NLIYPVMMHWZGPI-AWEZNQCLSA-N 328.456 5.049 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)c(F)c1 553770832 WAZWHYIRQQBTTL-NYHFZMIOSA-N 348.396 5.277 30 20 EKED Cc1cc2cc([C@H](C)N[C@H]3CCc4cc(C#N)ccc43)oc2cc1C 618803029 GMSPYKQPGTXYHY-YWZLYKJASA-N 330.431 5.259 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(F)c1F 632750579 KQWUUNVGDJWFAX-UHFFFAOYSA-N 329.390 5.377 30 20 EKED CCOc1cc(/C=C2\CCc3sccc3C2=O)cc(Cl)c1OC 726894400 YMNOPSZDGFBMQG-XYOKQWHBSA-N 348.851 5.021 30 20 EKED CCCCC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400534 QNJLPOHUDBTSJU-LSDHHAIUSA-N 333.501 5.171 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cccc(Cl)c1Cl 734979277 AQCPZGHSXXLNNL-VQHVLOKHSA-N 328.198 5.438 30 20 EKED O=C(/C=C/c1nccs1)c1ccc(-c2ccc(Cl)cc2)s1 735228869 JRYBYVQKRMKIHY-VMPITWQZSA-N 331.849 5.421 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C/C1CCCCC1 735440033 BXBADYTZQSPLGZ-AYJWMTRPSA-N 328.481 5.156 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1 739141836 FHJRPBXPKSHOLC-CRAIPNDOSA-N 345.446 5.056 30 20 EKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCCC1 749346432 JJUBBLSDKBHOKW-HRAATJIYSA-N 332.447 5.107 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(C)c(C)cc2C)c1 772981737 ABBJOYQHGJZUPV-QUCCMNQESA-N 336.479 5.144 30 20 EKED C[C@@H](Nc1cccc(Oc2ccccc2)c1)c1ccc(OCC#N)cc1 777709280 MJWLYYOIZOWXJQ-QGZVFWFLSA-N 344.414 5.554 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2ccc3cnccc3c2)c1 782302737 IHWSHNKBUVKWMP-GQCTYLIASA-N 339.341 5.041 30 20 EKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(-c2ccccc2)o1 788354730 ITPRZZHRSVDTCM-RMKNXTFCSA-N 349.333 5.318 30 20 EKED CC1(C)CCCC[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 789404830 FVUGFJGRVOSXBI-HOTGVXAUSA-N 338.476 5.203 30 20 EKED O=C(O)c1cccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c1 1776126344 JNPUWRUUSPHCQN-ZROIWOOFSA-N 344.366 5.073 30 20 EKED CCSc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1 1776950923 OIKUGHLBODGSHP-YFHOEESVSA-N 340.444 5.010 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)n1 80452277 RETYFQBUNMKTGD-GFCCVEGCSA-N 339.247 5.063 30 20 EKED CC(C)c1ccccc1NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 118445252 SJUNHMKPJFJJGU-HNNXBMFYSA-N 338.476 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(OC)c1 189900272 INBCMSXIYKQGMH-INIZCTEOSA-N 337.463 5.289 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccco1 191500556 GOVHHJFELSCDEP-OAHLLOKOSA-N 326.440 5.356 30 20 EKED CC[C@@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccc(C#N)cc1 278804230 RMEJGWNHRJWGIL-LJQANCHMSA-N 349.478 5.415 30 20 EKED Cc1nc(C)c(C/N=C(/O)CC2CCC(c3ccccc3)CC2)o1 329195482 UFWVWFYQHWCDLM-UHFFFAOYSA-N 326.440 5.112 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C)nc2onc(C(C)C)c12 410345388 ARKQLFYGIGHKBZ-UHFFFAOYSA-N 349.434 5.026 30 20 EKED N#CCCC[C@@H](NCc1ccc(Cl)c2cccnc12)c1ccccc1 433015313 WJCUZESHBWVCAT-HXUWFJFHSA-N 349.865 5.413 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc(F)ccc2-c2ccoc2)cc1 470790556 ZZJHVQKOTKRQGU-UHFFFAOYSA-N 348.377 5.139 30 20 EKED CC(C)(C)c1cc(NC(=O)c2coc3cc(F)ccc23)c(C#N)s1 483803752 FNPMMMBTOHBVSZ-UHFFFAOYSA-N 342.395 5.055 30 20 EKED Cc1ccccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 502591671 BHOVWYVRKUXIJQ-UHFFFAOYSA-N 343.386 5.303 30 20 EKED Cc1nc(-c2ccc([C@H](C)Nc3cccc(F)c3C#N)cc2)cs1 506825230 PHGNNVUPKUPEAE-LBPRGKRZSA-N 337.423 5.302 30 20 EKED C[C@@H](Nc1cccc(F)c1C#N)c1ccc(Oc2cccnc2)cc1 519657764 GZOSSOYKTQVISC-CQSZACIVSA-N 333.366 5.058 30 20 EKED N#Cc1ccc(SCc2cc(Cl)cc3cccnc23)c(F)c1 525629432 DGDMTIHTEZMMKY-UHFFFAOYSA-N 328.799 5.191 30 20 EKED C[C@H](N[C@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541133938 MGJBLDCUACVEDB-JKSUJKDBSA-N 332.472 5.699 30 20 EKED N#CCCCCC(=O)Nc1cccc(CSC2CCCCC2)c1 593981843 UXKTZPNZDAPVPK-UHFFFAOYSA-N 330.497 5.275 30 20 EKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1 614179148 FSYPQCDKXKHZEW-LJQANCHMSA-N 326.871 5.382 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(C(F)(F)F)c1 614179863 PKWWRZAYUQJFCR-CQSZACIVSA-N 346.396 5.357 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CCC(F)(F)CC1 626634026 UWNGWSAVWPSFDA-UHFFFAOYSA-N 335.438 5.693 30 20 EKED CSc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cc1 727974344 JWJMJMHALYUXON-VAWYXSNFSA-N 337.469 5.428 30 20 EKED O=C(/C=C/c1ccnc2ccccc12)c1ccc(C(F)(F)F)cc1 731835817 RLWKVLDBZRDVCN-JXMROGBWSA-N 327.305 5.150 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1ccc(Cl)c(Cl)c1 741735159 HXQSPPUGAVAFML-VQHVLOKHSA-N 343.213 5.280 30 20 EKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1ccsc1 749101716 IKUZDXZAOFTLOZ-FNORWQNLSA-N 337.425 5.514 30 20 EKED CCCCCCCCCC(=O)N1CCC(c2ncc(C)s2)CC1 762725676 JWTMKYQEFRKFBE-UHFFFAOYSA-N 336.545 5.298 30 20 EKED N#Cc1ccc(CNc2ccccc2SCc2ccccc2)s1 770512376 JSHIAILFOPVMEK-UHFFFAOYSA-N 336.485 5.524 30 20 EKED O=C(/C=C/c1sccc1Cl)c1sccc1Br 782330611 QWYRCOSXSNMVBC-OWOJBTEDSA-N 333.659 5.122 30 20 EKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(C)cc3)cs2)cc1 796968780 LSHMAQUSDFQAJH-XFXZXTDPSA-N 335.428 5.023 30 20 EKED C=CCC[C@H](NCc1cn(C2CC2)cn1)c1ccc(C(F)(F)F)cc1 865509093 ONFQJAIJKNALHN-SFHVURJKSA-N 349.400 5.034 30 20 EKED CCCCCCCC(=O)O[C@@H](C)c1nnc(-c2cccc(C)c2)o1 919223052 NINBQOAZPBJEHB-HNNXBMFYSA-N 330.428 5.010 30 20 EKED N#CCCCOc1cccc(NCc2cnc(-c3ccccc3)s2)c1 114764166 QCJWKHHKCIOUKZ-UHFFFAOYSA-N 349.459 5.105 30 20 EKED CC(C)Oc1c(Cl)cccc1NCc1ccc(O[C@@H](C)C#N)cc1 118452290 KPPDBWVHJOCHKV-AWEZNQCLSA-N 344.842 5.030 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H](C)c1cccc(C#N)c1 153724407 CBGZXKLROXHIIX-GJZGRUSLSA-N 347.487 5.402 30 20 EKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 177773304 VIWSIDUQEATVKY-OAHLLOKOSA-N 344.505 5.257 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)nc1C 189901967 ZFEWSMJQCAINEK-UHFFFAOYSA-N 328.843 5.148 30 20 EKED C[C@@H](NCCCCC(C)(C)C#N)c1nc(-c2ccccc2)cs1 278885303 UCLIATKBENBTQU-OAHLLOKOSA-N 327.497 5.181 30 20 EKED Cc1c(Cl)cccc1N=C(O)CC/N=C(/O)[C@H]1CC12CCCC2 329953455 JIVKIEJJWLBIIZ-CYBMUJFWSA-N 334.847 5.163 30 20 EKED CC(C)O[C@@H](CN[C@H](CCCC#N)c1ccccc1)c1ccccc1 433025268 JGWUBMJHDGRHPR-YADHBBJMSA-N 336.479 5.177 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1 438855113 ILUYQIPQHKBYJD-GHTZIAJQSA-N 349.478 5.051 30 20 EKED Cc1c(C(=O)N(C)c2ccc(C#N)cc2)oc2c1ccc1ccccc12 439927960 BGWHQHGJRUWTRP-UHFFFAOYSA-N 340.382 5.043 30 20 EKED CC[C@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1ccc(C#N)cc1 447596089 PLQCYKQRZLRRIJ-SFHVURJKSA-N 338.451 5.262 30 20 EKED Cc1cccc(Oc2cc(CNC3CCC(C)(C#N)CC3)ccn2)c1C 449177710 SVLDGGUCCLWHBU-UHFFFAOYSA-N 349.478 5.053 30 20 EKED CCC(CC)[C@@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)c1cccs1 463454548 AUQONLOXHQUMCQ-IFXJQAMLSA-N 340.492 5.017 30 20 EKED CCCCC[C@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 494269365 XOJARQMOHQQPAW-SFHVURJKSA-N 327.472 5.064 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2F)nnc1-c1ccccc1 501575470 OSVCVRHHTPYREE-AWEZNQCLSA-N 339.439 5.124 30 20 EKED N#C[C@@H](C(=O)c1occc1-c1ccccc1)c1nc2ccccc2s1 513682424 VGKOXNLQZZWNGW-HNNXBMFYSA-N 344.395 5.046 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(Cl)ccc1C 515772490 YHPPNAPGHJRNKH-UHFFFAOYSA-N 332.806 5.008 30 20 EKED CCC[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 518150527 DFPWBCCKBFVTSG-NSHDSACASA-N 344.402 5.086 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccccc1 538256606 ABVDEDNFFNJDGB-LJQANCHMSA-N 336.410 5.278 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 539052278 TWDRPIKUKLONIF-SCLBCKFNSA-N 333.262 5.689 30 20 EKED CC[C@H](C)n1ncc(N[C@H]2CCCc3cc(C#N)ccc32)c1C1CC1 611477231 ABDGWFKYYCJNTD-LIRRHRJNSA-N 334.467 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1nc(C)cs1 613900156 AIFSNVWRUFGYSI-CQSZACIVSA-N 328.481 5.046 30 20 EKED CCC(CC)N(C(=O)c1cccc(CC#N)c1)c1ccc(C)c(C)c1 728469130 GYATWCRGAWQRDJ-UHFFFAOYSA-N 334.463 5.205 30 20 EKED CCOc1cccc(C=Nc2ccc3nc(C4CC4)sc3c2)c1O 746340404 ICRZXQWEJWCGNZ-UHFFFAOYSA-N 338.432 5.029 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc2cc(OC)ccc2c1)c1ccncc1 766018924 JRQAUOVRQFNZQY-KSFYIVLOSA-N 332.447 5.211 30 20 EKED C[C@@H](N[C@@H](CC1CCCC1)c1ccccc1)c1ccc(OCC#N)cc1 776170315 OVEBFPSMJAEJNH-JPYJTQIMSA-N 348.490 5.561 30 20 EKED C=C(CNC(=O)c1c(Cl)ccc(Cl)c1Cl)c1ccccc1 809242965 FKRABTVFZOFGCU-UHFFFAOYSA-N 340.637 5.090 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCCc3cc(SC(F)F)ccc32)C1 834880307 SLQSZZYNJMWUQX-RVSPLBMKSA-N 336.451 5.051 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776120198 YAGYWWNYPLVWPR-XFFZJAGNSA-N 347.414 5.060 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(CC2CCC2)cc1 1776783922 AROKCQJHHUWGKB-NRFANRHFSA-N 345.527 5.323 30 20 EKED CC(C)c1ccc(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 329983297 BAISTSKETHPTAJ-UHFFFAOYSA-N 342.483 5.192 30 20 EKED CCc1occc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 430408735 QRMXOUDZPDSSNT-UHFFFAOYSA-N 346.386 5.067 30 20 EKED C[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1-c1cccc2ccccc12 447631166 XZQAHCQWOUJVSP-ZDUSSCGKSA-N 334.806 5.258 30 20 EKED N#CCC[C@@H](NCc1cc(Cl)sc1Cl)c1ccccc1 449205560 NROSJWZGZPGYSU-CYBMUJFWSA-N 325.264 5.190 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 479687223 LCCTVQWKCHRUFQ-UHFFFAOYSA-N 328.799 5.011 30 20 EKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480809732 YUCRTINFKKFMFE-KXBFYZLASA-N 349.434 5.003 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 488827908 BBVHTWNHPUDUFN-HXUWFJFHSA-N 344.414 5.172 30 20 EKED CCN(Cc1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 497619940 WFISOWIDBNMEPZ-AWEZNQCLSA-N 332.369 5.160 30 20 EKED N#Cc1cccnc1N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1 515923837 JVIXTZJQKWRSKY-IBGZPJMESA-N 333.822 5.003 30 20 EKED N#Cc1cccc(CSCc2coc(-c3ccc(Cl)cc3)n2)c1 517976186 ZULXODBBODMHGG-UHFFFAOYSA-N 340.835 5.300 30 20 EKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1ccc(C#N)cc1 523391286 IPQAREIWMIJZTL-IBGZPJMESA-N 342.870 5.097 30 20 EKED CC1CCC(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 523714035 ZXLUBIQTRFYETO-PCKAHOCUSA-N 330.497 5.236 30 20 EKED Cc1ccccc1-c1cnc(CSCc2ccc(F)cc2C#N)o1 534527714 UBDAUYVJGRKTSL-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C=CCCC(=O)N(Cc1ccc(-c2cccc(F)c2)s1)C(C)C 588034611 WLEFJSWDDOSFPI-UHFFFAOYSA-N 331.456 5.257 30 20 EKED C=C[C@@](C)(CC)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 685383479 FYAOPQRZQZTVPP-DOMZBBRYSA-N 328.309 5.001 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cnc(-c2ccccc2)s1 727264024 LXLBKJVPLVYBGV-VAWYXSNFSA-N 344.439 5.496 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 755610360 NIVCRYKRHLDJQU-STQMWFEESA-N 347.409 5.070 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCC(F)(F)F)cc1 770644815 LOWFOODPQBHPIT-QGZVFWFLSA-N 346.352 5.013 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc2c(ccc3ccccc32)o1)c1ccncc1 776158226 SXXHKZGDOKPJGU-HRAATJIYSA-N 342.442 5.949 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 839436124 SNKJODORCDZTJQ-GOEBONIOSA-N 346.352 5.019 30 20 EKED N#CC1(CCCC[S@@](=O)Cc2ccc(Cl)cc2Cl)CCC1 899381935 ULUNJLQUQMURRL-OAQYLSRUSA-N 344.307 5.106 30 20 EKED CSc1ccc(C(=O)/C=C/c2ccc(Br)s2)cc1 916133496 SSRYBWYARYBZSM-SOFGYWHQSA-N 339.279 5.129 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1ccccc1C(=O)O 1776031374 CPWKLHMGVYALMK-YOEHRIQHSA-N 330.472 5.415 30 20 EKED Cc1c(NN=C2CCCC[C@H](c3ccccc3)C2)cccc1C(=O)O 1776087617 MJNDRCCAAAHPGO-KRWDZBQOSA-N 336.435 5.209 30 20 EKED O=C(O)c1ccc(F)c(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c1 1776131007 DIFJLOHDVKTTKI-QBFSEMIESA-N 346.357 5.087 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)ccc1Cl 1776783004 QNGKMYYNAIAMDC-HNNXBMFYSA-N 346.298 5.287 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 11048925 POASVFGQQBIBGP-NRFANRHFSA-N 332.834 5.091 30 20 EKED C=CCN(CCc1ccccc1)C(=O)c1ccccc1SC(C)C 65775104 DRIDKOIZCUAQMX-UHFFFAOYSA-N 339.504 5.058 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(OC(F)(F)F)cc1 111170580 DVTNOPXBNAXYCL-ONNFQVAWSA-N 343.304 5.030 30 20 EKED C[C@H]1CCC[C@@H](C)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 246732934 NGSPGTATYDWYTO-OWCLPIDISA-N 345.512 5.123 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/[C@@H](CC2CCC2)c2ccccc2)CC(O)=N1 329749802 HRRKCVWZLCDNJO-KSZLIROESA-N 328.456 5.020 30 20 EKED C=CCC[C@@H](NCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 342218104 GSDDEBLDMGLPRG-OAHLLOKOSA-N 340.414 5.267 30 20 EKED C[C@H](NCc1ccc(C#N)c(F)c1)c1ccc(-c2ccccc2)cc1 404577961 UANXSNFYGROZJP-INIZCTEOSA-N 330.406 5.215 30 20 EKED N#CCC1(CNCc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 430047844 UGNRNQKTHGICBU-UHFFFAOYSA-N 335.234 5.037 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)cc1Cl 447573642 SPMXFIDNLQRJHN-MNOVXSKESA-N 337.225 5.416 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)CC3CCC3)cc2Cl)cc1 463171337 KAMZYDJCMLCITJ-UHFFFAOYSA-N 340.810 5.133 30 20 EKED CCCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(C#N)cc1 467771367 MULVQDWMFPXFHU-OAQYLSRUSA-N 336.479 5.224 30 20 EKED C[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 480584567 GKGJCDLOWLAADK-MRXNPFEDSA-N 349.434 5.004 30 20 EKED Cc1csc(-c2cccc(N[C@@H](C)c3ccc(C#N)cc3F)c2)n1 512282896 XYALXGGIKFSHSO-ZDUSSCGKSA-N 337.423 5.302 30 20 EKED C=CCOc1ccc(CN[C@@H](CC)c2ccc(OC)cc2)cc1Cl 520208340 KAOWSONJKUVGGW-IBGZPJMESA-N 345.870 5.154 30 20 EKED C=CC[C@H](C)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 523959738 IVMDYDKSVMURBG-ZETCQYMHSA-N 348.682 5.556 30 20 EKED Cc1ccccc1-c1cnc(CS[C@@H](C)c2cccc(C#N)c2)o1 525955550 HXTGSECCNBGKJV-HNNXBMFYSA-N 334.444 5.516 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 534474160 YHAQUAKMFOIVQJ-YESZJQIVSA-N 342.508 5.237 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1)c1ccccc1 536171045 ZZUKHYOIGJWUPL-YVHKJVDXSA-N 337.438 5.095 30 20 EKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 536814132 FEWSVWBIIRDJOQ-QAPCUYQASA-N 349.434 5.145 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccccc2C#N)cc1 539362152 MVMKBVMRNWHEMY-QGZVFWFLSA-N 342.442 5.085 30 20 EKED N#Cc1ccc2c(c1)[C@H](NCc1ccc(OC3CCCCC3)cc1)CC2 554997350 MIRNESNSJYUHMH-HSZRJFAPSA-N 346.474 5.047 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCCc2nc(-c3ccccc3)sc21 558235418 JKDKOXWBVPMZEL-MRXNPFEDSA-N 339.508 5.107 30 20 EKED CC[C@@H](NCc1ccc(C#N)c(OC)c1)c1ccc(Cl)c(Cl)c1 566648534 ADSLBZHFIBNYEC-QGZVFWFLSA-N 349.261 5.115 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H]1CCc2sc(Cl)cc21 573352949 NYMKOLFIWXOQBA-IAGOWNOFSA-N 342.895 5.318 30 20 EKED C=C[C@](C)(CC)C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 573825933 WQBVFTZHAGCQGL-CRAIPNDOSA-N 339.401 5.014 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)CCC(C)(C)C 609929966 QVJSNLGKEZZVRK-GJZGRUSLSA-N 347.528 5.275 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccccc2N2C[C@H]3CC[C@H]2C3)cc1 619166868 DRGHFYDETQSFKW-ICSRJNTNSA-N 345.490 5.089 30 20 EKED C=CC[C@H](NC(=O)N1CCCCC[C@@H]1c1ccccc1)c1ccncc1 734681807 ZMQWUVVBQIPMQK-LEWJYISDSA-N 349.478 5.026 30 20 EKED O=C(/C=C/c1cc(Cl)ccc1Br)c1cccs1 742429066 GCRPFNKOEURLJR-ZZXKWVIFSA-N 327.630 5.060 30 20 EKED CC(=NN[C@@H](C)c1ccc(C(C)C)cc1)c1c(C)nn(C(C)C)c1C 746489598 DWELDYDMTXZMJK-HNNXBMFYSA-N 340.515 5.279 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(F)c(Cl)c1 788096952 DHPHJCVAVGXASZ-GQCTYLIASA-N 333.771 5.092 30 20 EKED CC(C)[C@@H]1/C(=C\c2ncc(C(F)(F)F)s2)C(=O)c2ccccc21 788356225 UEPBYQRXXNBGBE-BLMSOEDDSA-N 337.366 5.181 30 20 EKED Cc1nn(-c2ccccc2)c(Cl)c1CSCCC(C)(C)C#N 790562507 UKRAIWIOZHUMHX-UHFFFAOYSA-N 333.888 5.007 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568367 QWNVSNQOCJSJPX-GOEBONIOSA-N 340.492 5.119 30 20 EKED Cc1nn(C)cc1C(=O)/C=C\c1ccc(-c2cccc(Cl)c2)s1 917519834 GIZCUOYRRSECEV-VURMDHGXSA-N 342.851 5.007 30 20 EKED CCCCCCCC(=O)O[C@H](C)c1nnc(-c2cccc(C)c2)o1 919223053 NINBQOAZPBJEHB-OAHLLOKOSA-N 330.428 5.010 30 20 EKED CCc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919713990 OVIWHXAGNXEICS-IBGZPJMESA-N 346.455 5.218 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1cc(C)c(C(=O)O)c(F)c1 1776786078 IXLCTLOZIXLWGV-CYBMUJFWSA-N 337.435 5.158 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc2cccnc12 25732917 PALDXOVGDNNRDV-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C[C@H](NCCCCF)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 319760398 YGDKQYUVBNWUNG-VIFPVBQESA-N 331.275 5.125 30 20 EKED CCc1ccc2c(c1)[C@@H](CC/N=C(/O)C(C)(C)C1CCCC1)C(O)=N2 328857426 KPXOOXAKEGZALW-MRXNPFEDSA-N 342.483 5.497 30 20 EKED Cc1ccc(-c2cc(CN[C@H](CCCC#N)c3ccccc3)on2)cc1 433012721 LNVGEZDFOODZKF-OAQYLSRUSA-N 345.446 5.175 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC(C)(C)C1 443595047 SVMUZKRSAADREA-GJZGRUSLSA-N 345.512 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(CC)cc1 476121020 FOYMJGCVBOQOSV-KRWDZBQOSA-N 335.491 5.843 30 20 EKED Cc1c(N[C@H]2CCCCc3cc(C#N)ccc32)cnn1C1CCCC1 481992446 OFVCEESKVGIXCY-FQEVSTJZSA-N 334.467 5.058 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(Oc2ccccn2)cc1 486577803 TXWJLEKQAIDSSH-UHFFFAOYSA-N 343.430 5.287 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1)c1ccccc1 536157181 GXXKVEOLGZSOTB-DENIHFKCSA-N 333.475 5.327 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1 540146813 MOKCEECWFOCUIW-YLJYHZDGSA-N 339.479 5.370 30 20 EKED CCSc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 551211854 YJWVUDDGYLERRZ-DYESRHJHSA-N 338.520 5.884 30 20 EKED CC[C@@H](C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 609378025 OTGDYZGDFKZROI-DOTOQJQBSA-N 338.476 5.071 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(-c2ccccc2OC)c1 666047343 PPKHMUPXCIVHRR-KDURUIRLSA-N 348.446 5.077 30 20 EKED CCc1cccc(CC)c1NC(=S)Nc1ccc(C#N)c(Cl)c1 726438122 MLVLTCFAIJLPEG-UHFFFAOYSA-N 343.883 5.145 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 729068176 XIDCFZKZQQLSAT-GDBMZVCRSA-N 334.444 5.056 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2)o1)c1c(Cl)nc2ccccn12 737446563 WAJIMEMZVINGRT-LUAWRHEFSA-N 348.789 5.144 30 20 EKED O=C(/C=C\c1cccc(OC(F)F)c1)c1cc(Cl)sc1Cl 747064612 YWVNTBLDKHGUIY-PLNGDYQASA-N 349.185 5.552 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)C3CCCC3)n2)cc1 750687798 OSPVDZMGFTUVIL-WMLDXEAASA-N 338.476 5.121 30 20 EKED CC(C)c1nccnc1NN=Cc1c(Cl)ccc(Cl)c1Cl 773079047 SJSNXROMBUGCPX-UHFFFAOYSA-N 343.645 5.006 30 20 EKED CC(C)C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1 774816076 UWXADPITJUJYIW-IBGZPJMESA-N 342.870 5.119 30 20 EKED N#C[C@@H](C(=O)/C(F)=C/C1CCCCC1)c1nc2cc(F)ccc2s1 815941692 KVMBISYJCSRXFO-IAOKNECISA-N 346.402 5.045 30 20 EKED CCCCOc1cc(/C=C\C(=O)c2cc(F)ccc2F)ccc1OC 916134162 FQFYEJSDWVRCNX-UITAMQMPSA-N 346.373 5.048 30 20 EKED N#CCOc1ccc(C(=O)/C=C\c2ccccc2-c2ccccc2)cc1 917516923 IGLYYRJWMDHAIE-QINSGFPZSA-N 339.394 5.152 30 20 EKED O=C(O)c1cc(NN=C(CC2CCCC2)CC2CCCC2)ccc1F 1776064351 JVRXKLFYZCXWLU-UHFFFAOYSA-N 346.446 5.452 30 20 EKED C=CCn1c(S[C@@H](C)c2ccc3ccccc3c2)nnc1C1CC1 59832552 XJAGIVMFOQKRLB-AWEZNQCLSA-N 335.476 5.348 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCCCCC#N 178644894 PTDBOQNEDGYNBF-LBPRGKRZSA-N 333.888 5.116 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccccc1Cl 189903309 CWKUUAPDKSSTHJ-UHFFFAOYSA-N 343.854 5.209 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2ccc3oc(CC(C)(C)C)nc3c2)CCC1=O 328960636 PNYABZBSRJMQOB-OLZOCXBDSA-N 342.439 5.010 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cc2ccccc2s1 439455154 TYPYYWWTGSVGSD-GFCCVEGCSA-N 326.852 5.277 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)cc2)cs1 538152141 ZJMOQPICTQVRHW-HUUCEWRRSA-N 347.487 5.402 30 20 EKED C[C@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 539506495 JGLFFEVKPVQALG-APPDUMDISA-N 331.246 5.203 30 20 EKED CC[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C1CCOCC1 543034303 IAWXYBDMXKTZFS-HXOBKFHXSA-N 348.490 5.081 30 20 EKED C[C@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccsc2S1 551205760 MDNRCZHJYVSMCT-JCGIZDLHSA-N 342.533 5.698 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1ccc(F)cc1)c1cccs1)CC2 580803897 XKUCQJWMIMCORV-PZJWPPBQSA-N 348.446 5.125 30 20 EKED CCc1ccc(N(C(=O)[C@H](C)CC#N)c2nc3ccccc3s2)cc1 598801482 ZIIHUOSYESKSEW-CQSZACIVSA-N 349.459 5.073 30 20 EKED CC1CCC(C)(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 609436814 VEZFIHASAUWTLQ-HVEKOLDVSA-N 345.512 5.171 30 20 EKED CC[C@@H](C)Oc1cc(/C=C2/CCc3sccc3C2=O)ccc1OC 726892076 LCXNRRWBMAELKN-LKKYZFDUSA-N 342.460 5.147 30 20 EKED CCc1c(C)sc(NC(=O)c2cc3ccc(F)cc3s2)c1C#N 727790606 MDUSMWWJIXPTON-UHFFFAOYSA-N 344.436 5.097 30 20 EKED N#CCOc1cccc(/C=C/c2nc3cc(Cl)ccc3s2)c1 730151696 PLNPMTYSOPVYTF-QPJJXVBHSA-N 326.808 5.022 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(OCc2ccc(C)cc2)c1 732436845 XOCXLFHHFWQSPW-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccc(F)c1 743474139 IMMULTLLXVUYQN-MRXNPFEDSA-N 346.405 5.449 30 20 EKED Cc1ccc(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)c(C)c1 745686489 BVJFEMUEZGXEJH-UHFFFAOYSA-N 337.492 5.035 30 20 EKED CCc1ccc(C(=O)/C=C/c2cccc(OC)c2OC(C)C)s1 747200779 JLXWDJKRGAQYTH-PKNBQFBNSA-N 330.449 5.002 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(Cl)c(F)c2)ccc1SC 747614885 OCWRMOPMPLWKJH-DAXSKMNVSA-N 336.815 5.106 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCCC1 749346433 JJUBBLSDKBHOKW-IERDGZPVSA-N 332.447 5.107 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2C[C@H](C(C)C)c3ccccc32)c1 774243392 KJZBLQLPGQALEN-SXSPYAJSSA-N 348.490 5.342 30 20 EKED COc1ccccc1CON=C[C@@H](C)c1ccc(C(F)(F)F)cc1 789054329 JWBSMYFGXQBSSJ-CYBMUJFWSA-N 337.341 5.020 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(N2CCCCCC2)cc1 806177787 JTNXXLNIJXJVKP-GOSISDBHSA-N 327.516 5.048 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1csc(C(F)(F)F)c1 926148780 TUQAVVXCTRKBCH-NXEZZACHSA-N 342.361 5.189 30 20 EKED C=CCC1(C(=O)O)CCN([C@H](CC(C)C)c2ccc(CC)cc2)CC1 1776158169 VRCQZJROPFYYSM-HXUWFJFHSA-N 343.511 5.079 30 20 EKED C=CCn1c(S[C@H](CC)c2ccccc2)nnc1-c1ccoc1C 64367873 NXWXPJZRVMVGNI-QGZVFWFLSA-N 339.464 5.276 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc(F)cc1F 83535637 VGRSZJQWFXMNSA-GQCTYLIASA-N 333.384 5.046 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1cc(Cl)sc1Cl 195713836 ZPTVWSOPVQQIIT-HNQUOIGGSA-N 333.623 5.310 30 20 EKED Cc1cc(C(=O)/C=C\c2ccccc2OCc2cccnc2)c(C)s1 222099601 LBUMWIAEYPNJLJ-KTKRTIGZSA-N 349.455 5.235 30 20 EKED CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@@H]2CCCCC23CCCC3)c1 329639163 WKZKIGLVNXUPNW-QGZVFWFLSA-N 348.874 5.756 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccccc1 433281627 KBQMTKMVVMTHAY-KRWDZBQOSA-N 345.805 5.036 30 20 EKED CN(C(=O)c1ccc(-c2ccccc2)cc1)c1cc(Cl)ccc1C#N 436007956 CORXSZSTLWMICV-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C1CCCCC1 438041568 MXAWBUNZNOHEKK-LSDHHAIUSA-N 345.512 5.029 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCC[C@@H](C)CC1 443608789 XOLQXDYOFSWAQS-OAGGEKHMSA-N 345.512 5.029 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@H](Nc2cccc(OCCCC#N)c2)C1 467330023 FPEPFEOTSNDLJF-MOPGFXCFSA-N 349.478 5.211 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](c2cccc(C)c2)C1 505035199 KXFSXAOGQANEOS-HXUWFJFHSA-N 334.463 5.135 30 20 EKED Cc1cc(Cl)cc2nc(SCc3ccc(C#N)cc3F)oc12 522688596 WJLFFGXONJWIMF-UHFFFAOYSA-N 332.787 5.093 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCc2cc(C#N)cs2)cc1 530879471 PYIUDENBPZKIGK-HNNXBMFYSA-N 348.471 5.146 30 20 EKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 536814134 FEWSVWBIIRDJOQ-YJBOKZPZSA-N 349.434 5.145 30 20 EKED CCSc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 538508950 OYGKZRKDAPCAFR-UONOGXRCSA-N 328.456 5.221 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccc(-c2cccc(C#N)c2)cc1 542018594 VGVCLHBUXAVMQZ-OAHLLOKOSA-N 343.455 5.009 30 20 EKED C=CCC[C@H](NC[C@H]1CCCN(C)[C@H]1c1cccs1)c1ccco1 552047204 DANJAMHZJXRDPF-FUHIMQAGSA-N 344.524 5.021 30 20 EKED CC(C)[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 555095345 VYCHTRBWGYOCAI-GOSISDBHSA-N 332.369 5.064 30 20 EKED C=C(C)COc1cccc(NC(=O)Cc2csc3ccccc23)c1 589382368 AXWYODSBERCLAG-UHFFFAOYSA-N 337.444 5.037 30 20 EKED N#Cc1ccc(Cl)cc1NCc1ccc(Oc2ccccc2)nc1 609891962 UGYPAJBZKKQRNR-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C[C@H](N[C@@H](C)c1cc2c(ccc3ccccc32)o1)c1cccc(C#N)c1 611438754 IKWQVVCTKHMZJU-HOTGVXAUSA-N 340.426 5.869 30 20 EKED Cc1cc2c(cc1C)[C@@H](NCc1ccc(C#N)c(Cl)c1)CCS2 619754724 IZLKAVCJYNZQTR-SFHVURJKSA-N 342.895 5.155 30 20 EKED Cn1cc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)c2ccccc21 727973965 CQIBOYOAXKWKFG-QXMHVHEDSA-N 344.439 5.198 30 20 EKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccccc2C2CC2)S1 750817720 IVRFRJRKLBYYIJ-PDGQHHTCSA-N 348.471 5.072 30 20 EKED CC(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)=C1CCCC1 753578325 CUDIIGBKGVUVMU-OAQYLSRUSA-N 330.431 5.171 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3cnc(-c4ccccn4)s3)oc2c1 754823913 GMODEVCLTFPVIE-FPLPWBNLSA-N 346.411 5.156 30 20 EKED C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)c(F)c1 777588038 DEWXILIZMLVULC-GFCCVEGCSA-N 336.332 5.365 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(C#N)cc3F)cs2)cc1 781111861 QSWBAIYHHPCGLX-VQHVLOKHSA-N 348.402 5.025 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1cnc2ccccc2n1 792109041 FKUXIHUQRZULTO-IERDGZPVSA-N 337.467 5.193 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccc(C#N)o1 794261769 PSRREBSWBVDQIS-UHFFFAOYSA-N 340.448 5.137 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2c(Cl)nccc2o1 866309181 MHGSPIRVXYDABU-CJNGLKHVSA-N 339.826 5.177 30 20 EKED N#CC1(CCCC[S@@](=O)Cc2c(Cl)cccc2Cl)CCC1 899278476 SXKYZZSYOVTBBQ-OAQYLSRUSA-N 344.307 5.106 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1csc(C(F)(F)F)c1 925601015 JGDRKXQVKUPEIM-WFASDCNBSA-N 338.398 5.463 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccsc3)s2)cc1 1777671216 UIMXTKBSFJPSEA-ALCCZGGFSA-N 340.425 5.071 30 20 EKED CCCCCC[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 78572889 OCHDTZAYKCULIT-HOTGVXAUSA-N 347.528 5.419 30 20 EKED COc1ccc(CNc2ccccc2SC[C@H](C)C#N)cc1Cl 179211006 RDEAHODGGZWXDC-CYBMUJFWSA-N 346.883 5.212 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]2CCC[C@@H]21 191504176 VOZSHBVDAZHLPA-APWZRJJASA-N 326.484 5.335 30 20 EKED Cc1cc(N[C@@H](C)c2cccc(C#N)c2)cc(C)c1Br 232022485 KJONHMIJYYUECH-ZDUSSCGKSA-N 329.241 5.111 30 20 EKED CC(C)(C#N)CCCCSCc1nnc(-c2ccccc2)s1 277821346 JISUNAKKYKMLPG-UHFFFAOYSA-N 331.510 5.158 30 20 EKED C[C@H](Nc1ccc(C#N)cc1C(F)(F)F)c1c(F)cccc1F 320139267 VNTQAWFVOZETEM-VIFPVBQESA-N 326.268 5.028 30 20 EKED CCCOc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1Cl 324387040 OYFAWUWFTANXAT-AWEZNQCLSA-N 344.842 5.204 30 20 EKED O/C(=N/[C@H]1CCOC2(CCCCC2)C1)Nc1cccc2ccsc12 328689259 BIERUQZAPDTUEH-HNNXBMFYSA-N 344.480 5.109 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC1CCC1)CC1CC1 432588031 NUSNAMWNTZOWNM-UHFFFAOYSA-N 340.511 5.583 30 20 EKED Cc1ccc(-c2nc(CSCCCCC(C)(C)C#N)cs2)o1 435888008 FXAMXNQXWLJGAA-UHFFFAOYSA-N 334.510 5.665 30 20 EKED CCCCC[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458799765 KDLIHNJRJILQKT-PMACEKPBSA-N 341.499 5.176 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458805193 UFPQCOQZWLBXGF-WIYYLYMNSA-N 349.478 5.133 30 20 EKED C=CCCC(=O)N(CC)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496500192 WUGAWLPPOWZYIF-JOCHJYFZSA-N 336.479 5.109 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 512530179 YLDJWYXILMWTRH-INIZCTEOSA-N 349.434 5.147 30 20 EKED C=CCN(C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1)C1CC1 536818354 WDRUCRXUAYIPGJ-INIZCTEOSA-N 336.435 5.009 30 20 EKED Cc1cc([C@H](NCc2ccccc2C(C)(C)C#N)C2CC2)ccc1F 537218643 FELLSPBCVOOENG-OAQYLSRUSA-N 336.454 5.176 30 20 EKED N#Cc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)s1 539423953 INQJFSRXACVUNA-NRFANRHFSA-N 332.472 5.083 30 20 EKED N#CCCC[C@H](NC/C=C/c1ccc(F)c(F)c1)c1ccccc1 560561532 JJRPXPWXZKICMX-YJJPMGAVSA-N 326.390 5.003 30 20 EKED C/C(=C\c1cccc(C(F)(F)F)c1)CNCC1CCC(C#N)CC1 563747845 QTOVFOVAJAXIEY-NTEUORMPSA-N 336.401 5.028 30 20 EKED Cc1csc(NC(=O)c2ccc(-c3ccccc3Cl)o2)c1C#N 573244871 WMBWIUGNAMWBKV-UHFFFAOYSA-N 342.807 5.094 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2ccc(C#N)c(C(F)(F)F)c2)cc1 574835030 DRXUPBQZDRJKOW-INIZCTEOSA-N 346.377 5.112 30 20 EKED Cc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1Cl 577254763 KCWGGTDRGBUPCS-UHFFFAOYSA-N 346.817 5.439 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(C2CC2)c1 593974602 JSDFKPOAOWMPBK-CQSZACIVSA-N 336.460 5.068 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@H]1CCc2ccccc21 604273217 KKPKNJYBUKPUFC-OAHLLOKOSA-N 345.895 5.036 30 20 EKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2Cl)C(C)C)c1 734309172 OTSQKQOHOIJODI-SFHVURJKSA-N 342.895 5.005 30 20 EKED CC(=NNc1oc(C(C)C)nc1C#N)c1cccc(-c2ccccc2)c1 746494721 RAEBJPOLVORFHW-UHFFFAOYSA-N 344.418 5.173 30 20 EKED C[C@H]1CCC[C@@H](OCCCCCC(=O)OCC2CCC(C#N)CC2)C1 755974877 MGPKUYSFEGVWFM-DCCYDQLOSA-N 349.515 5.015 30 20 EKED C=C1CCC(c2nc(-c3ccc(Oc4ccccc4)nc3)no2)CC1 904451926 XLQQQDFEITZRPH-UHFFFAOYSA-N 333.391 5.138 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)[C@@H](C)c1ccc(CC(C)C)cc1 1776037496 LEQIYVYAJIRCPQ-OAHLLOKOSA-N 338.451 5.175 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1Cl 195656670 HZDNJSLMTCNUBP-CYBMUJFWSA-N 332.806 5.335 30 20 EKED C[C@@H](Nc1ccc2cc(C#N)ccc2n1)c1nc(C(C)(C)C)cs1 301957598 ARXFKIPYMFFIKC-GFCCVEGCSA-N 336.464 5.034 30 20 EKED Cc1nc(S[C@@H](C)c2ccc(C#N)cc2)c2c(C)c(C)sc2n1 303646552 ABWWGAWYBHJIGD-LBPRGKRZSA-N 339.489 5.342 30 20 EKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/[C@H]2CCCCC23CCCC3)C1 329799186 IBPGFRCYAVPUNI-WBVHZDCISA-N 344.430 5.361 30 20 EKED Cc1ccc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1C 329977719 ZYXUQTVXOVVHAR-DMKPSLHHSA-N 342.483 5.246 30 20 EKED C[C@@H](CCC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 352173787 GIAREYFKLDMNMU-GHTZIAJQSA-N 334.463 5.122 30 20 EKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426147286 FOUNVUUFADZXQR-LLVKDONJSA-N 348.233 5.090 30 20 EKED CC1(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 428175760 JPSFDNCGLJSRAR-KRWDZBQOSA-N 338.838 5.124 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)C(C)(C)C 433132291 FVGYDMFZHZCYBZ-AWEZNQCLSA-N 347.528 5.132 30 20 EKED CCN(C(=O)c1cccc2ccsc12)c1ccc(C#N)c(Cl)c1 466240259 CXRNSEUTJUUSJY-UHFFFAOYSA-N 340.835 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC(F)(F)F 475554686 JEIPCKSCHBGNNR-GFCCVEGCSA-N 328.378 5.001 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCCC(C)(C)C#N 488808966 VWVHKYKVRYLWQL-WAIKUNEKSA-N 333.541 5.514 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 510810006 CHASSPCOHKHQKM-KKSFZXQISA-N 336.435 5.013 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(-c2cccnc2)cc1 512614417 VQPBEEZQMLACPC-HZPDHXFCSA-N 345.421 5.171 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2cccc3ccccc23)c1 726739572 CXHHTVYPEVKGLD-YPKPFQOOSA-N 341.410 5.418 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(-c2ccccc2F)s1 728698466 JZHIPMVRCCMJGH-FPLPWBNLSA-N 343.810 5.499 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](CC(C)(C)C)c2ccccc2)cc1 728712092 ZMQXQIOFVCGIKS-UWJYYQICSA-N 336.479 5.245 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(Oc2ccccc2)c(F)c1 742432737 GGVVNMFCHJJKFK-CSKARUKUSA-N 339.391 5.279 30 20 EKED CC(=NNc1nc(-c2c[nH]c3ccccc23)cs1)c1ccccc1 749262427 MGZDOVUBKMHREL-UHFFFAOYSA-N 332.432 5.128 30 20 EKED C[C@H]1C/C(=C/c2cccc(OCCCC#N)c2)C(=O)c2ccccc21 751537720 ZJFNPSZZWOQDAV-IYWFSZBXSA-N 331.415 5.143 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C)[C@@H]1CCC[C@@H]1C#N 878545846 OPDKSUIATNKDEX-RHSMWYFYSA-N 345.512 5.042 30 20 EKED CCOc1cc(/C=C\C(=O)c2cc(C)sc2C)cc(Cl)c1O 916155903 LNPVLBWHWQOGHR-WAYWQWQTSA-N 336.840 5.019 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1OCC(C)C 1776786940 CBCRBNRHNVTDAO-LJQANCHMSA-N 349.515 5.015 30 20 EKED CCCC(CCC)S[C@H](C)C(=O)N(CCC#N)c1ccccc1 64048208 VBPBKADEDXAPKU-MRXNPFEDSA-N 332.513 5.024 30 20 EKED C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccsc1 78080761 KWLGWIAQROGPQN-LBPRGKRZSA-N 338.457 5.090 30 20 EKED COc1ccccc1[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccccc1 181942942 OVPKIXJBCYGOMQ-UZUQRXQVSA-N 342.442 5.007 30 20 EKED Cc1ccc(CCCCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303014893 RWTQZJIVMBXITC-UHFFFAOYSA-N 334.463 5.148 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 303752683 IJXFMACAGYUSLQ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED N#C[C@@H]1CC[C@H](Nc2ccccc2OCc2cccc(Cl)c2)C1 442857956 HDOPMOMWGHPSNC-PBHICJAKSA-N 326.827 5.023 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 445988391 NQSMRACMXBXXBA-SJORKVTESA-N 338.417 5.261 30 20 EKED C[C@H](C#N)CSc1ccccc1NC[C@@H]1CCC2(CCCCC2)O1 466847468 SMVSAHKULRURRR-SJORKVTESA-N 344.524 5.232 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](OCC)C1=CCCC1 476091585 PUOIYVFEYLIMSB-HXUWFJFHSA-N 341.495 5.383 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc2cccnc12 476810595 ZAQFRUOHRXJEOI-UHFFFAOYSA-N 344.458 5.268 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c2ccccc2c1 506052209 WQQJXPHXIMDZTB-UHFFFAOYSA-N 347.433 6.083 30 20 EKED C=C(CC)CSCc1nnc(-c2ccc(Cl)cc2Cl)o1 536881232 MDRNXNOEVPGFIF-UHFFFAOYSA-N 329.252 5.243 30 20 EKED Cc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1F 537314915 HSXCRIJSNJUJSY-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2o1 543862517 WUDHOEBWHMCFQM-JTQLQIEISA-N 348.349 5.572 30 20 EKED CCCCOc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 551532858 HHMSKCFNYKCFAO-PGRDOPGGSA-N 336.479 5.561 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1Cl 552956748 OJSNTHDVCSIGPP-CWTRNNRKSA-N 328.818 5.079 30 20 EKED Cc1sc(NC(=O)CCCCCC#N)nc1-c1cccc(Cl)c1 588819081 ODVWHJVFBGIAQD-UHFFFAOYSA-N 347.871 5.185 30 20 EKED C=CCN(C(=O)c1cccc(C)c1C)c1nc(-c2ccccc2)cs1 641902398 ZPKPMABGLOWXQN-UHFFFAOYSA-N 348.471 5.260 30 20 EKED N#CCOc1cccc(/C=C\c2nc3c(ccc4ccccc43)s2)c1 727744844 MWNLEVJQLQDDHK-FLIBITNWSA-N 342.423 5.522 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1nc(-c2ccccc2)cs1 727974326 JTJCFVQAJHZSRL-QXMHVHEDSA-N 344.439 5.496 30 20 EKED N#Cc1ccc(N2CCC(c3cc4ccccc4[nH]3)CC2)cc1Cl 731996431 JNGRDWSQFMBUPP-UHFFFAOYSA-N 335.838 5.077 30 20 EKED COc1cc(C(=O)/C=C/c2sccc2C)ccc1SC(F)F 746345245 BPQNNSVGZQCTFG-GQCTYLIASA-N 340.416 5.276 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C#N)c(Cl)n1 752972570 BSIWFTOLGDXWHO-UHFFFAOYSA-N 341.842 5.106 30 20 EKED CSc1ccc(C(=O)/C=C\c2cnc(C3CCC3)s2)cc1F 760266725 ZHAWHCDBTNQVKI-SREVYHEPSA-N 333.453 5.168 30 20 EKED Clc1ccnc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 777905124 BFZVMVWJLKQKEQ-UHFFFAOYSA-N 335.021 5.141 30 20 EKED C=CCC[C@@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792099856 ANBOIDDEGGYYOO-NHCUHLMSSA-N 340.426 5.161 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(C)c(NC(=O)N(C)C)c1 794423357 WFBFJICOBHURSV-UHFFFAOYSA-N 347.503 5.168 30 20 EKED N#CC[C@H](CC(=O)OCc1cc2ccccc2s1)c1ccccc1 795986740 RGOIGVVUJKSYEF-MRXNPFEDSA-N 335.428 5.032 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1cc(F)ccc1F 797156133 ANACOANLHZOMNO-VURMDHGXSA-N 345.345 5.124 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cn1 903001655 WRWJGBGBYVMBFI-KBXCAEBGSA-N 347.384 5.186 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)cc(C)c3)n2)cc1 57526909 HKYZHZPDRSXHTG-SFHVURJKSA-N 346.455 5.225 30 20 EKED CSc1ccsc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800092 OHKNESJWHKBWKN-NSHDSACASA-N 348.518 5.117 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1c(F)cc(C#N)cc1F 151850960 MKTKDFGXDAUBMW-UHFFFAOYSA-N 342.389 5.336 30 20 EKED C#CCCCCC(=O)Nc1ccccc1-c1nc2ccccc2s1 179688190 NLVOSBBRIHQCOR-UHFFFAOYSA-N 334.444 5.095 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 237587423 ZOVMIENFGHASCS-INIZCTEOSA-N 346.405 5.340 30 20 EKED CC(C)(C#N)CCCCNC1(c2ccc(Br)cc2)CCC1 444651422 QXQGQKGHTCEQRQ-UHFFFAOYSA-N 349.316 5.138 30 20 EKED CC[C@@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1ccc(C#N)cc1 447596088 PLQCYKQRZLRRIJ-GOSISDBHSA-N 338.451 5.262 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCC[C@@H](SC)C1 475552181 BSOMDRFNDSWGFF-DLBZAZTESA-N 346.540 5.334 30 20 EKED COc1ccc([C@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C2CC2)cc1 481636254 ATFSUXACGAPQMR-DHIUTWEWSA-N 346.474 5.075 30 20 EKED C=CCCC(=O)N(CC)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496500193 WUGAWLPPOWZYIF-QFIPXVFZSA-N 336.479 5.109 30 20 EKED CC1CCN(c2cccc(N[C@@H](C)c3ccc(C#N)cc3F)c2)CC1 512275662 ARRODDDXCXUJHC-INIZCTEOSA-N 337.442 5.107 30 20 EKED CC(C)C[C@@](C)(C#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl 534596819 SYZKDMRQLPKMGN-FQEVSTJZSA-N 340.854 5.065 30 20 EKED C=CCC(C)(C)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 550738419 YFWRIEDOBNJUOG-CYBMUJFWSA-N 346.471 5.037 30 20 EKED N#Cc1ccc(SCc2nc(-c3ccc4ccccc4c3)no2)cc1 574796323 UQQIKRCOTWFHCI-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C=C(C)C[C@@H](C)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 577560620 DIZOLPDOCDZXAM-ZWNOBZJWSA-N 328.309 5.217 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCc2sccc21 726890584 GMGDQCKYQXBJIM-YFHOEESVSA-N 329.471 5.146 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCCC[C@H]1c1ncc[nH]1 737821306 AHUPVSZGVBICJW-MDNBWPLSSA-N 331.504 5.160 30 20 EKED CC(C)c1ccc(-c2ncc(CON=C3CCCOCC3)s2)cc1 778601380 YMVPRHWCSSKAIW-UHFFFAOYSA-N 344.480 5.007 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1nccc2ccccc12 811697654 DNDUTGFHHOJRRP-AATRIKPKSA-N 348.452 5.316 30 20 EKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 854174103 VCKKVOIUGPBVID-INIZCTEOSA-N 347.422 5.260 30 20 EKED C=C[C@@H](CC)CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 904083543 LMNNIMYZZOPDKW-NSHDSACASA-N 338.835 5.203 30 20 EKED C=CC[C@H](N[C@@H](C)c1csc(C(F)(F)F)c1)c1ccncc1 925075311 NSZDTDBNEKUERA-FZMZJTMJSA-N 326.387 5.130 30 20 EKED C=CCN(C(=O)c1oc2c(Cl)cccc2c1C)c1ccccc1 71846275 LFDOHBZXHHEQMO-UHFFFAOYSA-N 325.795 5.227 30 20 EKED C=CCC[C@H](N[C@H](C)c1cnn(C(C)(C)C)c1C)c1ccccc1 191386114 YSJYTUGTSCIMFT-UZLBHIALSA-N 325.500 5.305 30 20 EKED N#Cc1ccc(CNc2cccc(COC3CCCCC3)c2)c(F)c1 195712483 JJZFFTVXROURGO-UHFFFAOYSA-N 338.426 5.159 30 20 EKED N#Cc1ccc(NC(=O)c2csc3ccccc23)cc1C(F)(F)F 325170685 SBPJVKYZWNINHY-UHFFFAOYSA-N 346.333 5.044 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 392288717 MAQBYKQMTROODY-FDDCHVKYSA-N 326.443 5.193 30 20 EKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Cl)cc1-c1ccccc1 437183744 WPCRTXJUNSBQKD-UHFFFAOYSA-N 336.778 5.032 30 20 EKED Cc1ccc(-c2cnc(CS[C@@H](C)c3ccc(C#N)cc3)o2)cc1 437274352 HQSJKVRTWOQVFW-HNNXBMFYSA-N 334.444 5.516 30 20 EKED Cc1ccc([C@H]2CCCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1 476120969 MXOWWLZEJWAZJA-FGZHOGPDSA-N 346.474 5.136 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccccc1C 476123667 WPJKUNXPZGRRBW-GOSISDBHSA-N 335.491 5.979 30 20 EKED C=CCOc1ccccc1CN[C@H](C)c1ccc(-c2ccncc2)cc1 482887882 LPBAGZMJDOTLOC-GOSISDBHSA-N 344.458 5.164 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1ccc(CC#N)cc1 488865088 SPLAHPJTPMPVIF-GYCJOSAFSA-N 339.504 5.060 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1C 509703393 BKNGYDOPONFUMU-HZPDHXFCSA-N 349.434 5.003 30 20 EKED C[C@H]1CC[C@@H](C)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 510048760 IHFFJFWSAZVSIR-CVEARBPZSA-N 349.434 5.003 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2cccc(Cl)c2)c1 510995082 HZSFNEQGTPVNIO-CQSZACIVSA-N 344.842 5.130 30 20 EKED N#Cc1cccc(CSCc2csc(-c3ccsc3)n2)c1 517937697 MGMUFDXGODKMDM-UHFFFAOYSA-N 328.487 5.177 30 20 EKED Cc1sc([C@H](C)N[C@H]2CC[C@@H](C#N)C2)nc1-c1ccc(Cl)cc1 555424515 HJKVWUAODRWBIP-GHJWDPDVSA-N 345.899 5.115 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(Br)cn1)c1ccccc1 568702099 PWJYYPHPOBORKP-KBXCAEBGSA-N 345.284 5.202 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NC1c2ccccc2-c2ccccc21 580765641 BBYZOEOCAXOUHB-QHCPKHFHSA-N 336.438 5.295 30 20 EKED C=CCCCCCN(C)[C@@H](C)c1nnc(-c2ccccc2F)s1 582619628 QUMPWWSMWMBDRN-AWEZNQCLSA-N 333.476 5.083 30 20 EKED CCC[C@H](C(=O)Nc1sc(C)c(CC)c1C#N)c1ccccc1 609033075 LFOMFFBOVBWKEM-INIZCTEOSA-N 326.465 5.013 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(OC2CCCC2)cc1 611394068 CPGFHAAKOWLPBJ-HSZRJFAPSA-N 346.474 5.047 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(F)c(Cl)cc1Cl 618801417 AUUZEYDVTVLJOU-MGNBDDOMSA-N 349.236 5.342 30 20 EKED COc1cccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)c1OC 728441842 RMUMQQVGBQYZJY-RAXLEYEMSA-N 342.460 5.100 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCCC[C@H]1c1noc(C)n1 737617305 YRSGJUFVFGHLGY-OTMARIDSSA-N 347.503 5.129 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1ccc(SC(C)(C)C)cc1C)OCC 755838568 KYRKRSMFWQBPFE-QGZVFWFLSA-N 335.513 5.195 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCCCOc1ccc2ccccc2c1 779743783 UXLWOZWRIPHQQX-KRWDZBQOSA-N 346.430 5.012 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(C(F)(F)F)s2)c(Cl)c1 788359760 DQWFVZHIBLJSKI-GORDUTHDSA-N 341.741 5.188 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1nc2ccccc2s1 796752806 JHFHWNUCUTZCBB-QKPAOTATSA-N 338.476 5.079 30 20 EKED CC(C)(CCC#N)COC(=O)c1sc2cc(F)ccc2c1Cl 798878252 MYGABHKDUSQAFT-UHFFFAOYSA-N 339.819 5.181 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C/c1ccnc2ccccc12 800158007 LOFZHJICHYNATH-BUHFOSPRSA-N 328.415 5.005 30 20 EKED Cc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)c1 1776127473 UIOZVLIGDCECNC-KAMYIIQDSA-N 342.394 5.256 30 20 EKED CCCCCCCCCCC(CO)CCCCCCCCCC 59111164 MAOPEQCDMWTHQL-UHFFFAOYSA-N 326.609 7.657 30 20 EKED CCCCN(CC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 195708782 UXEUFGUHGQECAW-UHFFFAOYSA-N 337.423 5.004 30 20 EKED CCn1c2ccccc2c2cc(N=C(O)[C@@H]3CCC(=O)[C@@H](C)C3)ccc21 328925680 WABNMBDXFTTZIV-LSDHHAIUSA-N 348.446 5.408 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@@H](N[C@@H](CCC#N)c2ccccc2)C1 343435415 BHRXMMCEIBJVCZ-NJYVYQBISA-N 333.479 5.051 30 20 EKED Cc1cc2cc(C(=O)N[C@@H](CCCC#N)c3ccccc3)oc2cc1C 352179747 BMSRJLZOVHZPHG-IBGZPJMESA-N 346.430 5.215 30 20 EKED N#CCCC[C@H](NCc1cccc(-c2ccccn2)c1)c1ccccc1 353894905 BHFIOCYHSBEWAQ-QFIPXVFZSA-N 341.458 5.273 30 20 EKED CO[C@H](CN[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 433028530 ZOFZIVQZSIBNEC-WOJBJXKFSA-N 342.870 5.052 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1cccc(C#N)c1 435041302 IPWVUQZMNRCEDP-HUUCEWRRSA-N 338.476 5.191 30 20 EKED Cc1c(CNCc2cc(C#N)cs2)sc2ccc(Cl)cc12 441353622 GWILPSKZMZNKRS-UHFFFAOYSA-N 332.881 5.086 30 20 EKED C[C@H](S[C@H](C)c1nc(-c2cccs2)no1)c1cccc(C#N)c1 443156966 PVZUANCSQDRXQW-NWDGAFQWSA-N 341.461 5.225 30 20 EKED N#Cc1cccc(Cl)c1N[C@@H]1CCCc2cn(C3CCCC3)nc21 445601208 POXFJUDQSQITKY-QGZVFWFLSA-N 340.858 5.013 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(O)c(Cl)c1 446349142 NUNASEKWNYIBBS-UHFFFAOYSA-N 347.817 5.289 30 20 EKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455917889 KGBJUDUTHTZZAC-DYESRHJHSA-N 347.462 5.066 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1 467606187 SVFFXYFYEFTPQZ-PMACEKPBSA-N 337.438 5.420 30 20 EKED C=CCCCC(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 477693835 MXZJEOZARUCJSD-UHFFFAOYSA-N 340.370 5.124 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cnc2ccsc2c1)c1ccc(F)c(F)c1 480678147 SHZIDDSVKSEWPO-CWTRNNRKSA-N 344.430 5.543 30 20 EKED C=CCC[C@H](C(=O)Nc1ccccc1Br)c1ccccc1 487605381 HQKDKFIHQSWJOR-HNNXBMFYSA-N 344.252 5.138 30 20 EKED Cc1c(C(=O)N(CCC#N)CCC(C)C)oc2c1ccc1ccccc12 505196381 HWCGJASXNSUORF-UHFFFAOYSA-N 348.446 5.296 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 512561682 XNJFWNAQWOFWGS-MRXNPFEDSA-N 349.434 5.147 30 20 EKED CC(C)(CCC#N)CNc1ccc(SCc2ccccc2)cn1 514073889 FFXDKUWZWOFHMV-UHFFFAOYSA-N 325.481 5.116 30 20 EKED C=C[C@H](CC(=O)N1CCCCC[C@@H]1c1ccc(C)o1)c1ccccc1 533946004 GXVMJNZHPJGFEM-UYAOXDASSA-N 337.463 5.392 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1cccc(C#N)c1 539495388 OKSSTNQLSLACPO-JPYJTQIMSA-N 326.443 5.193 30 20 EKED N#Cc1c(F)cccc1NCc1ccccc1COCc1ccccc1 603856135 KFBKIJYMTZZGJX-UHFFFAOYSA-N 346.405 5.026 30 20 EKED Cc1ccccc1[C@H](Nc1nc(C(F)(F)F)ccc1C#N)C(C)C 609670137 OFFBMHYVLLGCNO-MRXNPFEDSA-N 333.357 5.090 30 20 EKED Cc1nc(-c2ccc([C@H](C)N[C@H](C#N)C3CCCCC3)cc2)cs1 609676984 JMUOKLKVERDYAP-IFXJQAMLSA-N 339.508 5.242 30 20 EKED Cc1ccc(-c2cc(CS[C@H](C)c3ccc(C#N)cc3)on2)cc1 609825348 SECJTDMUHFMFGQ-OAHLLOKOSA-N 334.444 5.516 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1oc(C(F)F)cc1C 623492162 OEUZIXOGBYPLSD-UHFFFAOYSA-N 345.798 5.069 30 20 EKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1cccc(C)c1C 726477239 RMFCHTYQIHOTAA-UHFFFAOYSA-N 343.883 5.052 30 20 EKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)(C)C 734706672 QXQSQFNBARFOON-RISCZKNCSA-N 346.883 5.322 30 20 EKED C=C(Cl)CNC(=O)c1sc2cc(C(C)C)ccc2c1Cl 736242611 PEAVLLUGNBHOGH-UHFFFAOYSA-N 328.264 5.160 30 20 EKED C[C@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)c(F)c1 777061139 XBRSLPWEDCBTHQ-HNNXBMFYSA-N 338.426 5.330 30 20 EKED C[C@@H](Nc1ccc(-c2ccco2)cc1F)c1ccc(OCC#N)cc1 787002144 SDRKYXVMFKKQKU-CQSZACIVSA-N 336.366 5.161 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C#N)[C@@H]1C[C@H]1c1ccc(Cl)s1 788595550 KTJYEACJQODLLC-ZOBORPQBSA-N 346.883 5.296 30 20 EKED CSc1ccc(C(=O)/C=C\c2cnc(-c3ccco3)s2)cc1 789131419 XWGHBMFHRHNSEO-HJWRWDBZSA-N 327.430 5.021 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCCCCC3)cc2)cc1 921119548 PYNLWEOAUGBELW-UHFFFAOYSA-N 349.434 5.149 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1 1776699941 IZVDEYFZUKKXRK-VNDWYCCKSA-N 336.431 5.411 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(CC(C)C)cc1 1776783925 ARSAOVXIVXXMLN-HXUWFJFHSA-N 333.516 5.179 30 20 EKED CC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46706823 RWUIIPLQHUXTRG-ZDUSSCGKSA-N 332.856 5.076 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(F)cc1F 63277375 KWENEKVDTRVOLO-DUXPYHPUSA-N 333.384 5.046 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 90664892 LWTVLGXPBXNPOU-KDOFPFPSSA-N 348.368 5.281 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 90666016 OMRHZGZUDAXABV-DYVFJYSZSA-N 348.368 5.123 30 20 EKED N#CCc1ccc(NC(=O)c2ccccc2Sc2ccccc2)cc1 172697330 VGUDONDFCGKXJK-UHFFFAOYSA-N 344.439 5.156 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(Cl)c1 187911149 KQVZFSPPPNRSLU-JTQLQIEISA-N 336.869 5.048 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)CCCCCc2cccs2)cc1 303395665 NWQUNWBKDJYLFM-UHFFFAOYSA-N 340.492 5.291 30 20 EKED CC(C)c1ccc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc1 303960251 ZDKNYNCWILRLBN-VMPITWQZSA-N 330.840 5.069 30 20 EKED OC1=N[C@@H](/C(O)=N/CC2(c3ccccc3Cl)CCCCC2)CCC1 328787315 JKZQVPSYAVRMAI-MRXNPFEDSA-N 348.874 5.007 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 417361602 JDGVUFJCVSBHQR-FZKQIMNGSA-N 339.508 5.175 30 20 EKED C[C@@H](NC1CCC(C)(C#N)CC1)c1ccc(-c2cccc(C#N)c2)cc1 449231074 CHBOPRMGMSDQJI-UIFUMHDPSA-N 343.474 5.348 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccc(F)c(F)c1 502431818 PNVQEYGTPDZHPL-VBKZILBWSA-N 345.437 5.244 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2C)C1 505036129 SXDOEWYBPXOHRM-LJQANCHMSA-N 334.463 5.135 30 20 EKED CC1(C#N)CCN(Cc2cccc(SCc3ccccc3)c2)CC1 518546712 NNZQTMHAUKLNRH-UHFFFAOYSA-N 336.504 5.105 30 20 EKED Cc1ccnc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 519559029 KVBUQAFNMXLTIH-QZTJIDSGSA-N 341.458 5.341 30 20 EKED CC[C@H](NCc1ccc(OC2CCCC2)cc1)c1ccc(C#N)cc1 560268496 DXBSUNGYYCPASM-QFIPXVFZSA-N 334.463 5.121 30 20 EKED CC(C)OCc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 582091626 BTDWVRFATYCCDC-UHFFFAOYSA-N 348.368 5.114 30 20 EKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)sc12 647379782 NIYDDDGSBXGUKZ-ZDUSSCGKSA-N 338.457 5.034 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccccc1SCc1ccccc1 729549625 OFUNBMOIWJVJNO-UHFFFAOYSA-N 340.492 5.409 30 20 EKED C=CCOc1ccccc1CNCc1ccccc1-c1ccccc1 732230138 DALWRDVVZCKFFH-UHFFFAOYSA-N 329.443 5.208 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 755665844 RKNMHYXJSRWRHW-WCQYABFASA-N 332.444 5.074 30 20 EKED FC(F)(F)C1CCC(C=NNc2nccc3sccc23)CC1 767370463 IBYACQJZXXTSPC-UHFFFAOYSA-N 327.375 5.063 30 20 EKED CCCCCCC[C@H](N[C@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1 773153663 WDNGSXKCEJWSTP-FKBYEOEOSA-N 345.527 5.016 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3nccc4ccccc34)co2)cc1 811698448 JZNHBRHQAWWODC-KHPPLWFESA-N 340.382 5.094 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)c1cccc2ccccc12 915051334 PUNLGXHNIAKYJZ-UHFFFAOYSA-N 329.325 5.090 30 20 EKED Cc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cc1C(=O)O 1776131214 LAYFHGNVWXCLFY-ZROIWOOFSA-N 342.394 5.256 30 20 EKED N#CCCSc1ccccc1NCc1ccccc1C(F)(F)F 108353064 YFFAGPKDQWWMLQ-UHFFFAOYSA-N 336.382 5.323 30 20 EKED N#Cc1ccsc1C(=O)Nc1ccc(Cl)cc1-c1ccccc1 189743181 QMBMLKHQRWCFTH-UHFFFAOYSA-N 338.819 5.192 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cccc(Cl)c1 214012987 FAKWDKOVQULEFX-PLNGDYQASA-N 331.849 5.421 30 20 EKED Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 298848099 KVGSCERHCSCPAH-MRXNPFEDSA-N 335.451 5.021 30 20 EKED CC[C@H](NCc1nc2cc(Cl)ccc2s1)c1ccc(C#N)cc1 447561166 GSNMHTHJHMAUAE-HNNXBMFYSA-N 341.867 5.062 30 20 EKED C=CCC(CC=C)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 448190918 RIHSXWDBCWHHAZ-UHFFFAOYSA-N 349.927 5.192 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 463071070 QIQPAYWLYRIJSV-INIZCTEOSA-N 334.463 5.547 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@]12CCc1ccccc12 476151428 NZXDFDZHQUAIKV-ZJSXRUAMSA-N 345.486 5.381 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Oc2cccnc2)cc1)c1ccc(C#N)cc1 487935561 NFKLUGIAYDUXDX-IRXDYDNUSA-N 343.430 5.157 30 20 EKED CC(C)CN(C(=O)c1csc2ccccc12)c1ccc(C#N)cc1 499316274 KUGSINVDOSDIDE-UHFFFAOYSA-N 334.444 5.076 30 20 EKED C[C@@H](NC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccc(C#N)c1 537448922 FLQYJSLBIWDFPV-CQSZACIVSA-N 344.380 5.307 30 20 EKED CC(C)(C#N)CCN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 540713360 SSSIIQGZSZZUAU-OAHLLOKOSA-N 344.808 5.339 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H]1CCc2ccc(Cl)cc21 544046177 PEXCSKMDXCZGBW-DYVFJYSZSA-N 342.895 5.691 30 20 EKED C=CCCO[C@H](C)c1nc(C(C)(C)c2cccc3ccccc23)no1 551121189 ZVYXLIUPZWJCNP-OAHLLOKOSA-N 336.435 5.202 30 20 EKED N#CCCC[C@@H](NC1CCC(c2ccc(O)cc2)CC1)c1ccccc1 552083417 DAERAGVDXCMVJK-PSGUAHCZSA-N 348.490 5.443 30 20 EKED C=C(C)COc1cccc(NC(=O)N(C)[C@H](C)c2ccc(C)cc2)c1 589738827 AGLLAOMUCWEMGZ-QGZVFWFLSA-N 338.451 5.175 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1cccc(Cl)c1 609387371 ZDWNUNCADAQVAD-KBPBESRZSA-N 330.884 5.765 30 20 EKED C=CCC[C@H](NC(=O)CCC(C)(F)F)c1ccc(C(F)(F)F)cc1 676730189 BSILJVOBHKHVQE-AWEZNQCLSA-N 349.343 5.264 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCCC2)cc1)c1nccc2ccccc12 685797244 PZKGOBLJAHDBOA-OAQYLSRUSA-N 340.426 5.382 30 20 EKED N#Cc1cc(F)ccc1CN1CCC[C@@H]1c1ccccc1C(F)(F)F 728570842 QIIDNNNAXNGXFG-GOSISDBHSA-N 348.343 5.053 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccccc1OC(F)F 741840009 ASJWLOZBFVROHY-SREVYHEPSA-N 332.277 5.069 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1ccc(-c2ccncc2)cc1 745990731 XEOVOGIVUFUYKQ-FNORWQNLSA-N 325.820 5.360 30 20 EKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1c(C)n[nH]c1C 765321491 ZYIITJHOWCOQRO-SFHVURJKSA-N 333.520 5.221 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCCCOc1cccc2ccccc12 779745720 GGJMEMVPRYJAGU-KRWDZBQOSA-N 346.430 5.012 30 20 EKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(C2CCCCC2)cc1 780153033 HLGPORNCOXFAMZ-INIZCTEOSA-N 348.446 5.277 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(Br)cc1F)c1ccccc1 783258118 APBLQESWVRPSTN-FZKQIMNGSA-N 346.243 5.003 30 20 EKED C[C@H](CC(=O)OCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 783742669 FKEVWDQIYRZTKX-CYBMUJFWSA-N 341.373 5.072 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)cn1 806567790 LSZZJYFLQIAGIM-GQCTYLIASA-N 340.810 5.070 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCCC2(CC2)C1)c1nc2cc(Cl)ccc2s1 850770972 GVAFVESUOQATNJ-DGCLKSJQSA-N 344.867 5.096 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Br)cc1 36991679 GMXWBLLOLOSAKX-ACJLOTCBSA-N 343.268 5.123 30 20 EKED N#Cc1cccnc1N[C@H](Cc1ccccc1Cl)c1ccccc1 63282308 MTZXQYFNQNCDAN-LJQANCHMSA-N 333.822 5.003 30 20 EKED N#CCC[C@@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 90666019 JPZGUJJRZSAEGW-WOJBJXKFSA-N 332.447 5.068 30 20 EKED Cc1c([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)oc2ccccc12 180539908 VFUXCPMOTHCMCB-JKSUJKDBSA-N 334.419 5.055 30 20 EKED Cc1cc2occ(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2cc1C 187522539 ILFVVIKNNOGRDN-CQSZACIVSA-N 338.432 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nc(C)cs1 191458399 GJKAAPQOULKKDD-CQSZACIVSA-N 343.496 5.186 30 20 EKED C=CCCCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 303859075 ORBNQIHDQQVUSS-UHFFFAOYSA-N 348.421 5.079 30 20 EKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2/N=C(/O)C/N=C(/O)C1CCCCC1 328799653 XTQWANLHDHDGSM-INIZCTEOSA-N 346.471 5.095 30 20 EKED CC(C)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H](C)c1ccsc1 421694162 UJPFASSSLZMHNW-SJLPKXTDSA-N 340.492 5.134 30 20 EKED CCCc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432694604 WOZGCYAEOIGJPK-FQEVSTJZSA-N 335.451 5.196 30 20 EKED C=CC[C@H]1N(C(=O)Nc2ccc3[nH]c(C)cc3c2)CCCC1(C)C 444909756 ZOUYXSJQPQKLEN-GOSISDBHSA-N 325.456 5.075 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(Br)cc1)c1ccc(C#N)cc1 447541256 FYLXMAFKSDVPOY-FZKQIMNGSA-N 343.268 5.123 30 20 EKED C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1cccc(C#N)c1 507215411 RRLCGLIQEZRUDA-JTQLQIEISA-N 329.375 5.279 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@@H](C)c1ccc(CC)cc1 523103005 LNPCWSCOBXEUCS-MRXNPFEDSA-N 327.493 5.019 30 20 EKED COc1ccccc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541090338 QQVKKTDPTSKGJO-KRWDZBQOSA-N 342.442 5.085 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C12CCC(CC1)C2 544048743 RMFAZFBSEZRGJE-UHFFFAOYSA-N 346.430 5.178 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2sc(C(C)(C)C)nc2C)cc1 552087493 JOQNMDQXCFANGQ-AWEZNQCLSA-N 344.524 5.165 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 552607074 MQRLVOLWFAISCG-GDBMZVCRSA-N 339.401 5.014 30 20 EKED CC[C@@H](Nc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1 571746715 REURBTALDDHOCB-JOCHJYFZSA-N 346.430 5.431 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)C1CCCCC1 609378152 SLMCKQPUJIVINK-JKSUJKDBSA-N 344.524 5.483 30 20 EKED Cc1cc(/C=C\C(=O)c2cccc(F)c2)ccc1Oc1cccnc1 732714345 XYMBWGMMPRVWEE-CLFYSBASSA-N 333.362 5.218 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(Cl)c1SC(F)F 736968573 GEYFWSXBEHNLEJ-UHFFFAOYSA-N 334.819 5.085 30 20 EKED O=C(/C=C\c1c(OC(F)F)ccc2ccccc12)c1cccs1 916137042 IYYMEVYRHWNONT-HJWRWDBZSA-N 330.355 5.399 30 20 EKED Cc1ccccc1[C@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 932392991 SSKCRCLJNNIOMF-HOTGVXAUSA-N 338.476 5.132 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 60477148 VFFMEWNSMQRFTC-HNNXBMFYSA-N 334.444 5.084 30 20 EKED CC(C)c1noc([C@@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 105402571 KUJUGBXIMJIDJZ-CQSZACIVSA-N 348.406 5.030 30 20 EKED CC[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 193341912 LGFCVVPOMBKIBK-WBVHZDCISA-N 338.476 5.213 30 20 EKED CC(C)c1cccc(NCc2cn(CCC#N)nc2-c2ccccc2)c1 236864794 LKKJQMGCOMFNFM-UHFFFAOYSA-N 344.462 5.199 30 20 EKED N#CC1(CCCN2CCC[C@H]2c2cccc3ccccc23)CCOCC1 281138779 ALOSPPHKGJTXBY-QFIPXVFZSA-N 348.490 5.077 30 20 EKED CC1(C)CCCC[C@H]1CC(O)=Nc1cccc([C@H]2CN=C(O)C2)c1 328643403 FHXXVSFFMCZPAM-CVEARBPZSA-N 328.456 5.325 30 20 EKED N#CCCC[C@@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccccc1 352207353 WQKIUSWWUPOSLF-OAQYLSRUSA-N 344.414 5.112 30 20 EKED Cc1ccc(-c2cnc(CSCc3ccc(F)cc3C#N)o2)cc1 437272622 WQNRFSIACSHCKU-UHFFFAOYSA-N 338.407 5.094 30 20 EKED Cc1sc(NC(=O)C2CCC(c3ccccc3)CC2)c(C#N)c1C 443827878 WNCZULQKOKOFPC-UHFFFAOYSA-N 338.476 5.149 30 20 EKED N#Cc1ccc(CNC2(c3c(Cl)cccc3Cl)CCC2)cc1 447071459 YWXOZYVPGPAQTL-UHFFFAOYSA-N 331.246 5.034 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C#N)c(Cl)c1 521191544 WFKDXVGKYHDQCK-GOSISDBHSA-N 341.842 5.217 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Br)cc1C(C)C 534072858 KNGSJVFRSIADSB-UHFFFAOYSA-N 339.277 5.002 30 20 EKED CC(C)C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccs1 542555379 FRQSRWRMERUFLQ-SFHVURJKSA-N 326.509 5.426 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)NCC(C)(C)CCC#N 565673902 LNWXCWWUPXWPKD-UHFFFAOYSA-N 347.528 5.088 30 20 EKED N#Cc1cc(Oc2ccc(NCc3cscc3Cl)cc2)ccn1 589324635 ZNESTEJDKVZPOW-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CCc1cc(C#N)c(NC(=O)c2sc3cccc(F)c3c2C)s1 604030335 QWMDJLUHVGOKKW-UHFFFAOYSA-N 344.436 5.097 30 20 EKED N#Cc1cc(Cl)c(C(=O)Nc2csc3ccccc23)c(Cl)c1 611518605 OYWCNTHOYNQCLU-UHFFFAOYSA-N 347.226 5.332 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 613290330 CHHDWEISSHOGCY-SFHVURJKSA-N 328.415 5.022 30 20 EKED CC(=NNc1cccc(C#N)c1)c1sc(-c2ccc(C)cc2)nc1C 727651377 WBPDJLYATMVQCY-UHFFFAOYSA-N 346.459 5.135 30 20 EKED COCc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1 741849341 WQSWQWXOPRQKLX-SREVYHEPSA-N 327.232 5.097 30 20 EKED CC(C)C(=NNc1nc2cc(C(F)(F)F)ccc2s1)C1CC1 743444837 XPIFUUIPHSFKEX-UHFFFAOYSA-N 327.375 5.149 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(C(F)(F)F)cc1 788096349 AWUXCZRZXDANBF-FPLPWBNLSA-N 349.333 5.318 30 20 EKED Clc1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)n1 793163945 ODJGJPCQGIRDAS-UHFFFAOYSA-N 335.021 5.141 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)CCC(F)(F)CC1 850873655 NRYMIBIGEOIFCL-LBPRGKRZSA-N 340.439 5.048 30 20 EKED CCCC[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)C(C)C 857010645 STMMMGWTVRPBET-ZIAGYGMSSA-N 347.409 5.070 30 20 EKED C[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 915350536 XTCRLDAMGQEQSD-HBGVWJBISA-N 347.462 5.042 30 20 EKED CCCCCCCOc1cccc(/C=C\c2ncc(C(=O)O)s2)c1 1776789019 KQJLTVDFUFNWDX-KHPPLWFESA-N 345.464 5.361 30 20 EKED N#CCC[C@H](NCc1cc(Cl)cc2cccnc12)c1ccccc1 130576557 FDMPUXHFEPNHJD-IBGZPJMESA-N 335.838 5.023 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(COc2ccccc2)c1C 174999227 GPWCXSLCRPJOHG-UHFFFAOYSA-N 338.451 5.004 30 20 EKED N#CCCSc1ccccc1NCc1ccc(C(F)(F)F)cc1 178385949 IBIAJRHVWUKVKZ-UHFFFAOYSA-N 336.382 5.323 30 20 EKED COc1ccsc1[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 186238359 FWYBCZDCDXEZPC-HNNXBMFYSA-N 348.471 5.146 30 20 EKED C[C@H](SCc1nc(C(F)(F)F)cs1)c1cccc(C#N)c1 190817212 JUMIVSJYMARJSJ-VIFPVBQESA-N 328.384 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CC1)[C@H](C)C1CC1 191453671 SCQQWEMTFCDAGU-OAHLLOKOSA-N 326.484 5.333 30 20 EKED CC(C)Oc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1Cl 193008155 ZYDYDUZFFANWSZ-CQSZACIVSA-N 344.842 5.203 30 20 EKED CC(C)[C@@H](C)N1Cc2cccc(N[C@H](C)c3ccc(C#N)cc3)c2C1 246440647 UNDSPCAIVBIGSD-IAGOWNOFSA-N 333.479 5.091 30 20 EKED Cc1ccc2ccccc2c1C[S@](=O)CCCCC(C)(C)C#N 278061493 YZPAQYIQFNIVEO-HSZRJFAPSA-N 327.493 5.117 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@H](C)c1ccccc1 301749624 OOIKCXRNFUGGGP-AWEZNQCLSA-N 333.884 5.110 30 20 EKED C[C@H](SCc1coc(-c2cccc(F)c2)n1)c1cccc(C#N)c1 443159206 SNRLXELWAXEZTR-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED COc1ccc(CN(CCCC(C)(C)C#N)Cc2ccccc2)cc1 472437164 BCGNXYXZZBVNFO-UHFFFAOYSA-N 336.479 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C(C)C)C1 475542833 ADXBJZAGPHOTRW-GOSISDBHSA-N 328.500 5.438 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccccc1 505028581 GQEXTQJMCNUKPA-HXUWFJFHSA-N 334.463 5.044 30 20 EKED Cc1cccc([C@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 523509702 QWRWZOZVCGINSN-HNNXBMFYSA-N 346.455 5.337 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1 532206867 KZOFWNMQIYMRTK-KGLIPLIRSA-N 328.843 5.022 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(Cl)cc1)c1ccccc1 533883805 COMGLYREVIOASQ-UZLBHIALSA-N 339.866 5.363 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1ccc(F)c(C#N)c1 542728954 VPWSJGMUTWBFEH-UHFFFAOYSA-N 326.415 5.015 30 20 EKED N#Cc1ccc(Oc2nc(C(F)F)nc3ccccc23)c2ccccc12 549698712 HHAVXJYVKBIERF-UHFFFAOYSA-N 347.324 5.385 30 20 EKED COc1ccc2cc([C@H](C)NC3(c4cccc(C#N)c4)CC3)ccc2c1 551805663 CCZSKOYXDYVLDV-INIZCTEOSA-N 342.442 5.060 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 557272590 BEPWSRRORSKWQV-UGSOOPFHSA-N 333.262 5.689 30 20 EKED Cc1ccc(C)c(Sc2ccc(NC(=O)CC3(C#N)CC3)cc2)c1 590127243 HYBKMDFLYPNISB-UHFFFAOYSA-N 336.460 5.087 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)CC2(C#N)CC2)cc1 590295526 QHWGAYUSIXRSAK-HNNXBMFYSA-N 336.460 5.172 30 20 EKED Cc1sc(NC(=O)c2ccccc2Cc2ccccc2)c(C#N)c1C 603445217 WTGLFXOHZQXSFI-UHFFFAOYSA-N 346.455 5.080 30 20 EKED C=CCCCN(C)C(=O)C(CC)(CC)Cc1nc2ccccc2s1 605677108 GMJKANUSTCFELJ-UHFFFAOYSA-N 344.524 5.070 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(F)ccc1N1CCCCC1 606943746 JAFQSENRKOHBHQ-UHFFFAOYSA-N 347.478 5.026 30 20 EKED CCC(CC)[C@@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1ccccc1 610400724 CQSBCUPTEYSRBM-IIBYNOLFSA-N 349.478 5.096 30 20 EKED CC(C)Oc1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614179246 KSMYJTIEROCNEV-KRWDZBQOSA-N 336.479 5.126 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1cc(Cl)ccc1Cl 726741161 DAMQDEKMOYQXTP-VMPITWQZSA-N 331.198 5.208 30 20 EKED N#Cc1c(F)ccc(/C=C(/Cl)c2nc3ccccc3o2)c1Cl 761478255 OEMYMMNNHKWTNN-YRNVUSSQSA-N 333.149 5.229 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cc(Cl)ccc1O 775533919 SEGPTEWGTHOKLH-SFHVURJKSA-N 344.842 5.291 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccccc1 796844556 DQQLMDWLTNEMEE-HNAYVOBHSA-N 327.855 5.072 30 20 EKED N#C[C@@H](C(=O)[C@H]1CCCC2(CC2)C1)c1nc2cc(Cl)ccc2s1 850770971 GVAFVESUOQATNJ-AAEUAGOBSA-N 344.867 5.096 30 20 EKED C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352217 IWIYRNBDBIJFNF-CZAAIQMYSA-N 347.462 5.042 30 20 EKED FC(F)(F)c1cccnc1NN=Cc1ccccc1-c1ccccc1 917547957 GNBCOYVHMKSFHF-UHFFFAOYSA-N 341.336 5.213 30 20 EKED CC(C)(C)c1nc(CON=Cc2ccccc2C(F)(F)F)cs1 918186008 MYXDUPGYTWSUSI-UHFFFAOYSA-N 342.386 5.010 30 20 EKED CC[C@H](C)c1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776698232 IYRALTQGGBLMPN-JASJWYONSA-N 338.403 5.012 30 20 EKED C[C@@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1cccc(C#N)c1 181901617 NGOPWVBGGRAKFJ-VFNWGFHPSA-N 347.849 5.047 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)c1nc(-c2ccccc2)cs1 278885295 UCLIATKBENBTQU-HNNXBMFYSA-N 327.497 5.181 30 20 EKED CC(C)c1nc2cc(N[C@@H](C)c3ccc(OCC#N)cc3)ccc2o1 326854017 QESSHCBRQQCEHQ-AWEZNQCLSA-N 335.407 5.027 30 20 EKED OC(=Nc1cc(C(F)(F)F)cnc1O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329026677 VRYYLGLIKLMVMZ-WCFLWFBJSA-N 342.361 5.001 30 20 EKED C[C@H](N[C@@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 363696949 BKSVDMVJLOOLJE-IRXDYDNUSA-N 327.431 5.032 30 20 EKED Cc1nc(CN(CCC#N)CC(C)(C)C)oc1-c1ccc(Cl)cc1 468271796 HAMMOBPCYCHYOR-UHFFFAOYSA-N 345.874 5.065 30 20 EKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)SC2CCCCC2)c1 480209584 ZOYGRXPMCWOEPO-QGZVFWFLSA-N 344.524 5.005 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 489599455 REPNRLHKQQMHHQ-UWJYYQICSA-N 349.478 5.014 30 20 EKED C=CCCc1ccccc1NC(=O)CSc1nccc2ccccc12 504290400 STOFYXYNUBJYAG-UHFFFAOYSA-N 348.471 5.084 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1OC(F)F 512648046 LBDGHTYOUNKBPV-PXAZEXFGSA-N 348.368 5.101 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(C(C)C)nc1C 530402232 OUKXFTKIMULCDU-UHFFFAOYSA-N 342.508 5.679 30 20 EKED C[C@@H](NCc1ccc(CC#N)cc1)c1ccc(Oc2ccccc2)cc1 541329154 XTLFPCVNUXOJJF-GOSISDBHSA-N 342.442 5.396 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-c3cccs3)o2)cc1 543986067 HTSYTLHBIUTOED-UHFFFAOYSA-N 336.416 5.062 30 20 EKED COCc1ccccc1/C=C(\C)CN[C@@H](CCCC#N)c1ccccc1 556908198 MACVMUASRCJUED-BBIZSYTBSA-N 348.490 5.261 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H](C)c1cccc(C#N)c1 588954974 QCDMGUJZXSIWCG-BTYIYWSLSA-N 329.447 5.076 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NCc1ccc(C#N)c(Cl)c1 588959462 CBZBNXAMKLOSTL-HXUWFJFHSA-N 349.865 5.169 30 20 EKED CC(C)(c1noc(CCCCCC#N)n1)c1cccc2ccccc12 590278536 PXJAGNGLWYAKEI-UHFFFAOYSA-N 333.435 5.175 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1C(F)(F)F 599024433 QFKJHIKULGZNIC-NEPJUHHUSA-N 336.332 5.128 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(C#N)cc3F)co2)cc1 603442570 UHRPOZCSXAQHJB-UHFFFAOYSA-N 338.407 5.094 30 20 EKED N#C[C@@H](Nc1ccccc1COCc1ccccc1)C1CCCCC1 609676918 FVNMVTAOXUKNBD-JOCHJYFZSA-N 334.463 5.288 30 20 EKED CC(C)(C)OCc1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1 611392017 IOOXJJOCXDHTDW-QFIPXVFZSA-N 348.490 5.041 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCc2c1ccc(Cl)c2Cl 618806963 UKOHDLIFAOXZHN-MSOLQXFVSA-N 343.257 5.129 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(NC(=O)[C@H](C)CC(=C)C)c(C)c1 619323253 ABRHUBFUAKHFDZ-IAGOWNOFSA-N 342.483 5.077 30 20 EKED CCc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)s1 740011467 NYRBQTBHDRBESU-UHFFFAOYSA-N 338.501 5.200 30 20 EKED CC(C)Oc1ccccc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741467950 BFVGMNOGOYXVBF-ZHACJKMWSA-N 343.426 5.432 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccccc1Cl 794994846 JCHKTYOSPCTROY-UHFFFAOYSA-N 330.884 5.115 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)[C@@]1(C#N)CC12CCCC2 839245236 PEVHPEOZPYEQST-QFIPXVFZSA-N 330.431 5.075 30 20 EKED CC[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1cccc(Cl)c1O 848566550 AFWOVLLXOKZFPW-GOSISDBHSA-N 340.854 5.037 30 20 EKED Clc1ccc(C=NOCc2ccc(Cl)c3cccnc23)cc1 917395548 PYRVISQYNDKZOO-UHFFFAOYSA-N 331.202 5.092 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1ccccc1C(=O)O 1776031373 CPWKLHMGVYALMK-WMLDXEAASA-N 330.472 5.415 30 20 EKED CC(CCCCCCC(=O)O)=NNc1c(Cl)cccc1Cl 1776048795 AFAHFEFKRHPLJM-UHFFFAOYSA-N 331.243 5.206 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776339690 NCZWDTZMOGWIAH-UITAMQMPSA-N 348.398 5.226 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)CCCC(C)(C)C#N 119472514 CLOJGSKKNOPOGJ-MRXNPFEDSA-N 341.524 5.441 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccccc1OC(F)F 172906202 RKYICCZNDDKEKW-ZDUSSCGKSA-N 348.418 5.152 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc2ncccc12 302527705 BJGHKPFGBSNPQP-UHFFFAOYSA-N 349.393 5.026 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)cc1 303229267 UXRISHNEGXABOC-OBHPCNEJSA-N 333.431 5.216 30 20 EKED C=CCC[C@H](NCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 342228559 TUZCDFCMNDKKHN-INIZCTEOSA-N 340.414 5.267 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 392288720 MAQBYKQMTROODY-JPYJTQIMSA-N 326.443 5.193 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc2ccc(F)cc2nc1C 410368757 XRQLOOPPDATUAR-UHFFFAOYSA-N 334.394 5.053 30 20 EKED CC(C)(C)c1csc(NC(=O)c2cccc(C(F)F)c2)c1C#N 410927625 KTKHFUAVNWIGIT-UHFFFAOYSA-N 334.391 5.107 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 425708130 YTCYZLPDJOBPJV-MRXNPFEDSA-N 343.377 5.181 30 20 EKED N#Cc1c(NC(=O)c2sccc2C2CC2)sc2c1CCCCC2 432716685 KRYMAVZTOWREFW-UHFFFAOYSA-N 342.489 5.080 30 20 EKED Cc1ccc(Cl)c(NC(=O)N[C@H](CCC#N)c2ccccc2)c1C 434483876 NMBAVIYRUZIAEL-QGZVFWFLSA-N 341.842 5.123 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)N[C@H](CCC#N)c1ccccc1 438836177 MXXHDQQHVDRLBU-RTWAWAEBSA-N 349.478 5.214 30 20 EKED Cc1cc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)o1 447580326 NWRUTRYASIRDSZ-MRXNPFEDSA-N 330.431 5.286 30 20 EKED CC[C@H](Nc1cc(NC(=O)C(C)C)ccc1C)c1ccc(C#N)cc1 447588273 UMWPETWNZZVWIE-IBGZPJMESA-N 335.451 5.024 30 20 EKED C=CCC[C@H](N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccccc1 467373148 JTGGKWAJFOGXFJ-VQTJNVASSA-N 325.427 5.119 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 467606190 SVFFXYFYEFTPQZ-WOJBJXKFSA-N 337.438 5.420 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)c(Cl)c1 517461644 ZERIBAOGCLCTGO-QWHCGFSZSA-N 348.874 5.904 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)cc1 522607843 DZHNTKXPUUFFAG-INIZCTEOSA-N 341.499 5.168 30 20 EKED C=CCCC(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 524327015 VEVARVIXNQXNCJ-UHFFFAOYSA-N 336.366 5.071 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cc2ccccc2s1 527194542 QIBQFPSBMUBYCO-HNNXBMFYSA-N 334.488 5.553 30 20 EKED COc1ccc(-c2ccccc2)cc1CNc1ccc(CC#N)cc1 546076170 JTNQBNWPIFYRAJ-UHFFFAOYSA-N 328.415 5.040 30 20 EKED FCCCCCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 551450512 HJJZESXCLROOHM-CYBMUJFWSA-N 345.302 5.428 30 20 EKED C=CCOc1cccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)c1 570182347 XQTMHLAZLYCJCJ-UHFFFAOYSA-N 349.396 5.295 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc2ccccc2c1 609387125 NVOVHJFVCDMXQA-SJORKVTESA-N 346.499 6.265 30 20 EKED C[C@@H](SCc1sccc1Br)c1ccc(C#N)cc1 609825816 VBUMTAFIVWILLV-SNVBAGLBSA-N 338.295 5.377 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1ccccc1Br 618285207 QVZKZFMQBDIMJA-QGZVFWFLSA-N 349.316 5.306 30 20 EKED C=C[C@@H](CC(=O)N1CCCC[C@@H]1c1ccccc1OC)c1ccccc1 677541090 NEDYDCHGLIBWPY-GHTZIAJQSA-N 349.474 5.109 30 20 EKED CC[C@H](C#N)Oc1cccc(CNCc2cc3cc(C)c(C)cc3o2)c1 749286005 RZBRPSQVHBAKHB-LJQANCHMSA-N 348.446 5.020 30 20 EKED C[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)c(F)c1 777145224 VWEFRGQKZATBPU-CQSZACIVSA-N 326.415 5.186 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](F)CC1CCCCC1 793460015 GGNVDZMRBCJBAF-GDBMZVCRSA-N 348.487 5.185 30 20 EKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1c(F)cccc1Cl 809159409 OZBIHLALIKBWKI-KTKRTIGZSA-N 343.810 5.499 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CC[C@H](C)c3ccsc32)c1 834650985 SNMKABHKPOHRFS-GMBSWORKSA-N 340.492 5.157 30 20 EKED N#C[C@@H](C(=O)CC(C1CCC1)C1CCC1)c1nccc2ccccc12 860701959 KLZVJSOWHNJFGG-FQEVSTJZSA-N 332.447 5.018 30 20 EKED C#Cc1cccc(NC(=O)N(CCC)[C@@H](C)c2cc3ccccc3o2)c1 919773259 ZKQGZTOKTQSRAQ-INIZCTEOSA-N 346.430 5.419 30 20 EKED C=CCc1ccccc1/C=C\c1cc(C(=O)O)c2cc(C)ccc2n1 1776189075 IURHRXQKZFYICQ-KHPPLWFESA-N 329.399 5.140 30 20 EKED CC(C)Sc1ccccc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 80451959 ALNACFTZTHRVGK-AWEZNQCLSA-N 344.505 5.257 30 20 EKED N#CCC[C@@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccccc1 90664649 AVCJMSBSBKHJCE-MSOLQXFVSA-N 342.895 5.512 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\c2ccc3ccc(Cl)cc3n2)cc1 208271770 GYWAWGFWXQFBCQ-UCEWNTHNSA-N 334.806 5.349 30 20 EKED CCc1c(C(=O)/C=C\c2ccc(NC(C)=O)cc2)oc2ccc(C)cc12 211278595 KTIZZMVGUFETPP-FLIBITNWSA-N 347.414 5.158 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCCc2c(Cl)cccc21)c1ccccc1 340431030 BOCZPGWNIVJUQE-NHCUHLMSSA-N 338.882 5.742 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1F 340449825 XBIITHAWBZESPN-RBUKOAKNSA-N 344.861 5.955 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H]1CCSc2ccccc21 360655870 FFEKVSUXSXFRJB-UXHICEINSA-N 334.488 5.152 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnn(C(CC)CC)c1CC 410351633 MECKWZIHKDOXBO-UHFFFAOYSA-N 339.483 5.178 30 20 EKED CC(C)CCN(C(=O)N[C@H](CCC#N)c1ccccc1)C1CCCC1 440239991 KKACGQCFDZLYSP-HXUWFJFHSA-N 341.499 5.032 30 20 EKED C=CC[C@@H]1N(C(=O)c2cccc(-c3cscn3)c2)CCCC1(C)C 443870498 SNMQATNQZPOLGQ-SFHVURJKSA-N 340.492 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nc(C)oc2c1 471156751 MXUWIFQYESHTHY-UHFFFAOYSA-N 334.419 5.240 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C2CC2)c(C)c1 481929419 CJYDSZUCXLETNR-UHFFFAOYSA-N 326.465 5.154 30 20 EKED C=CCC[C@H](NCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 538258819 KGYKJCSIFSYZPS-FQEVSTJZSA-N 336.410 5.278 30 20 EKED C=C[C@H](Cc1nc(CSc2ccc(F)cc2)no1)c1ccccc1 545525186 UXDUNDXVOFZOJJ-CQSZACIVSA-N 340.423 5.013 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C)CCC#N)n2-c2ccccc2)cc1 556337266 LOVMJYYIDHAQTR-MRXNPFEDSA-N 348.475 5.027 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(OC)c1C)c1ccccc1 572166255 IHBOKBWSTJPHDJ-YLJYHZDGSA-N 339.479 5.370 30 20 EKED Cc1cccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1Cl 572439531 ZHUOTQATKGJOOS-MRXNPFEDSA-N 341.842 5.205 30 20 EKED CCSc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 579531763 GTIXBDPGAWCGPM-UHFFFAOYSA-N 336.382 5.301 30 20 EKED N#Cc1csc(CN[C@H](c2cccc(Cl)c2)C2CCCC2)c1 610916021 SPTICQDJFWOHNK-SFHVURJKSA-N 330.884 5.294 30 20 EKED C#Cc1cccc(NC(=S)Nc2cccc(Oc3ccccc3)c2)c1 726435106 ZXRNBCBJBAONLJ-UHFFFAOYSA-N 344.439 5.269 30 20 EKED C#Cc1cccc(NC(=S)N[C@H](C)c2ccc(Cl)cc2Cl)c1 726444422 KSGCOWMSNOCQKF-LLVKDONJSA-N 349.286 5.022 30 20 EKED CCCCCCCC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 731643939 LPKALLCWGPRSKL-HNNXBMFYSA-N 327.255 5.035 30 20 EKED O=C(/C=C/c1cc(C(F)(F)F)ccc1F)c1ccc(F)c(F)c1 733206485 LSEUFHCBRRSLSC-QHHAFSJGSA-N 330.227 5.019 30 20 EKED Cc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1[N+](=O)[O-] 734981726 SLFBMLNACOTXEC-WTKPLQERSA-N 349.358 5.114 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)s1 758428128 AAYISSOMGIZZTA-FPLPWBNLSA-N 325.355 5.181 30 20 EKED C/C(=C\C(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 773982962 NNQPOHKXJGRKOG-DKGMDFAASA-N 338.476 5.287 30 20 EKED COc1c(O)cccc1/C=C\C(=O)c1ccc(-c2cccs2)cc1 818260520 HUKLIYUXPOIMKW-QXMHVHEDSA-N 336.412 5.025 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(C)cc1 842942409 NYIFLRWYSLLNEZ-RHSMWYFYSA-N 338.476 5.089 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1ccccc1Cl 916135383 VUDDGUHIATYQKK-KHPPLWFESA-N 325.820 5.360 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(C)s1 917028681 UUVJHBVHQNOIBD-UHFFFAOYSA-N 334.659 5.248 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cccc(F)c1 1776785061 BKKGBZMJDSUQJO-IBGZPJMESA-N 337.479 5.414 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccc(Br)c1 37284480 CXFQXAJPMXRDTH-SCLBCKFNSA-N 343.268 5.123 30 20 EKED COc1ccc(CNc2ccc(C(C)C)cc2)cc1OCCCC#N 177552682 ZRXKLCSHKBIKTG-UHFFFAOYSA-N 338.451 5.113 30 20 EKED C[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(OCC#N)cc1 192938891 YPPOXQFKBMRHTG-QWHCGFSZSA-N 349.261 5.308 30 20 EKED N#CCCCOc1cccc(NCc2cccc(Cl)c2Cl)c1 237778615 ZWHLLCOKLLWVKL-UHFFFAOYSA-N 335.234 5.288 30 20 EKED C=CCC1(C(=O)Nc2ccc(SC3CCCC3)cc2)CCOCC1 424579329 CLDRLDQAAFGGQM-UHFFFAOYSA-N 345.508 5.033 30 20 EKED Cc1cc(Cl)c(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1Cl 443948772 WEYCWXKROKYPCX-LLVKDONJSA-N 348.233 5.056 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NC3CCC(C)(C#N)CC3)cc2)cs1 449071690 OCDABKYXNDHYKN-FHTBDLFWSA-N 339.508 5.242 30 20 EKED CCCN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](CC)c1ccccc1 476843694 NCJPQUHHZSHNHL-FQEVSTJZSA-N 335.451 5.262 30 20 EKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@H](CCC#N)c1ccccc1 489003813 ACJBVQYYIHYGIW-SLYNCCJLSA-N 346.474 5.137 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1C[C@H]2CC[C@H]1C2 517701110 JSOLZNVCHYTJIH-ZWOKBUDYSA-N 346.430 5.034 30 20 EKED C=CCN(C(=O)C1CCCCCC1)c1nc(-c2ccccc2)cs1 522393084 QNGWJFSNQUNBON-UHFFFAOYSA-N 340.492 5.300 30 20 EKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2ccccc2)cc1 524243896 VZJUNJRQUKSTOX-INIZCTEOSA-N 344.414 5.532 30 20 EKED C[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1cccc(C#N)c1 540791625 UONYNQJVKFIWFE-GFCCVEGCSA-N 331.246 5.205 30 20 EKED C=CC[C@@H](C)[C@@H](C)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 543113703 ZSOBNNGOGIYYMT-HZPDHXFCSA-N 340.442 5.020 30 20 EKED C=CCC(C)(C)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 560037012 YEVIQFDZQAPFNZ-UHFFFAOYSA-N 330.815 5.068 30 20 EKED CC(C)Oc1cccc([C@H](N[C@@H](C)c2cccc(C#N)c2)C(F)F)c1 585725929 FMORWLQLECFYBN-LIRRHRJNSA-N 344.405 5.002 30 20 EKED N#Cc1ccc(C2(N[C@@H]3CCCc4c3[nH]c3ccccc43)CCC2)cc1 594519697 XUTQPVZNVXEKEX-OAQYLSRUSA-N 341.458 5.086 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)C=C(C3CC3)C3CC3)c2)cc1 729375946 XYMHJVNOJODPAW-UHFFFAOYSA-N 344.414 5.035 30 20 EKED C[C@@H](c1cccc(C(F)(F)F)c1)N(CC(F)(F)C(F)F)C1CC1 733897924 RAINGOLQURDGFG-VIFPVBQESA-N 343.286 5.131 30 20 EKED Cc1cc(/C=C/C(=O)c2ccsc2)cc(C)c1OCc1ccccn1 749105717 XJPZGTKUDZBFRQ-VOTSOKGWSA-N 349.455 5.235 30 20 EKED O=C1/C(=C/c2cnc(-c3cccs3)s2)CCc2sccc21 751514143 PWWYRGZGDRFSDM-CSKARUKUSA-N 329.471 5.146 30 20 EKED C#CCCCNC(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 752716922 TWYGPWFLZYJAOO-MRXNPFEDSA-N 338.476 5.075 30 20 EKED CC(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)=C1CCCC1 753578324 CUDIIGBKGVUVMU-NRFANRHFSA-N 330.431 5.171 30 20 EKED C=CC[C@@H](NCc1ccc(Oc2cccc(F)c2)cc1)c1ccncc1 767690465 NWXNGNOQAXNUIH-JOCHJYFZSA-N 348.421 5.420 30 20 EKED C[C@@H]1CCC[C@H](OCCCCCC(=O)OC[C@H]2CC[C@@H](C#N)CC2)C1 809090453 MGPKUYSFEGVWFM-ZRNYENFQSA-N 349.515 5.015 30 20 EKED O=C(/C=C/c1cscc1Br)c1c(F)cccc1Cl 809158650 BOKNUUUHEMVWEP-SNAWJCMRSA-N 345.620 5.199 30 20 EKED N#Cc1ccc(CN[C@H](CCCc2ccccc2)c2ccccc2)cc1 15056472 FFVGERMIBOXTEW-XMMPIXPASA-N 340.470 5.412 30 20 EKED CCCCCCCC(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1 109420073 IWYHBUIIBDPIMO-QGZVFWFLSA-N 327.472 5.005 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)oc12 118443157 YGDYXDPFMPYRFL-HUUCEWRRSA-N 334.419 5.115 30 20 EKED CC[C@@H](C)[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 302936613 IJAJODODQDDPKI-UZLBHIALSA-N 334.463 5.256 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1cccc(Br)c1 444592080 DZVZLAAWAOEWDG-KRWDZBQOSA-N 349.316 5.306 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cccc(C3CCC3)c2)s1 467231359 SGSVRVRXHBYDLW-INIZCTEOSA-N 338.476 5.198 30 20 EKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)cc1C 475179121 SPWIFYMYJHZJQN-OAQYLSRUSA-N 346.474 5.082 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(C2CC2)CCC1 475566007 GBHHKHRUFSXTJP-UHFFFAOYSA-N 326.484 5.240 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CC)c(C)s1 476106214 DMSMWNIAWIZJMF-UHFFFAOYSA-N 327.493 5.723 30 20 EKED C=C(CNC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 480177805 JLXQQIRDXWNCDF-UHFFFAOYSA-N 336.769 5.113 30 20 EKED N#CCn1c(/C=C\c2csc(Cl)c2Cl)nc2ccccc21 486106147 YOLPDSNKYCJWMR-WAYWQWQTSA-N 334.231 5.099 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)C2(C#N)CCCCC2)c(C)c1 498453726 ONRPGLPKBGEYMD-OAHLLOKOSA-N 330.497 5.298 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)Cc1c(F)cccc1F 505024763 WJVCWWLGYSCFLT-UHFFFAOYSA-N 344.405 5.137 30 20 EKED CC(C)(C)c1ccc(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 521203700 UAHQEZZZDMFIKP-UHFFFAOYSA-N 349.478 5.107 30 20 EKED C[C@@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1 532466048 KWBMDCKZUVRDHF-HZPDHXFCSA-N 332.472 5.699 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 536836662 BUYJIEZFOFYKJM-SUMWQHHRSA-N 333.262 5.689 30 20 EKED Cc1sc(NC(=O)c2cc3cccc(C)c3s2)c(C#N)c1C 554675289 IPJUEEPOPPOYRL-UHFFFAOYSA-N 326.446 5.012 30 20 EKED C[C@H](NC(=O)Nc1cccc(-c2ccccc2)c1)c1cccc(C#N)c1 588342318 KEHAAIIGULSDQJ-INIZCTEOSA-N 341.414 5.108 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1c[nH]c2ccccc12 728440681 RJAWRMDGKPDPCU-FPLPWBNLSA-N 336.441 5.249 30 20 EKED CCC(=NNc1c(Cl)cc(Cl)cc1Cl)C1CCOCC1 745193230 JZQTXHMIPHIRHF-UHFFFAOYSA-N 335.662 5.251 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccccc2)o1 746347030 WXURHQVVUJGZMI-BENRWUELSA-N 334.419 5.237 30 20 EKED CC(C)N(C(=S)Nc1ccc2ccccc2c1)c1cccc(C#N)c1 749768794 RDLCAWHXZFKHTK-UHFFFAOYSA-N 345.471 5.323 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1ccc(C#N)cc1Cl 754718783 FFZOCYYGAMOQFJ-UHFFFAOYSA-N 349.242 5.060 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccncc1 766017806 DRSRWACCIUSOAL-MFKMUULPSA-N 327.280 5.418 30 20 EKED C#CC[C@@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccccc1 773104651 FSODCPUVURPPRK-MSOLQXFVSA-N 327.880 5.231 30 20 EKED COc1ccc2cc(C(=O)/C=C/c3scnc3C3CC3)ccc2c1 782301744 MKFSQVSNFOLBDJ-CMDGGOBGSA-N 335.428 5.078 30 20 EKED C[C@@H](N[C@@H]1CC(C)(C)CCc2ccccc21)c1ccc(OCC#N)cc1 799727127 WVFLFIYBCDUHTM-VGOFRKELSA-N 348.490 5.343 30 20 EKED CC(=C/c1cccc([N+](=O)[O-])c1)/C=C/C(=O)c1c(F)cccc1Cl 809158800 DNSNMGJMCDAQRI-ZLNDROGTSA-N 345.757 5.230 30 20 EKED C=CCN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)C(C)C 915147534 AHIXZQUUOVKODY-UHFFFAOYSA-N 349.430 5.048 30 20 EKED CC(C)(C)CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1 1776033316 FMIQYVLIYGYZJO-UHFFFAOYSA-N 344.842 5.291 30 20 EKED CC(C)c1ccc(NN=Cc2csc3ccc(C(=O)O)cc23)cc1 1776060516 YLWMSJMMHKKGKL-UHFFFAOYSA-N 338.432 5.169 30 20 EKED C=CCn1c(SCc2ccc3ccccc3n2)nc2ccccc21 7177785 IVOKZFVXHWDHBD-UHFFFAOYSA-N 331.444 5.063 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(OC(F)(F)F)c1 90665568 TUCYPINVBYCWPJ-RDTXWAMCSA-N 348.368 5.281 30 20 EKED CC(C)[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccnc1 91412250 RGLJIZFAODTQKS-HSZRJFAPSA-N 341.458 5.107 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)C1CCCCCC1 171743123 MIMRLBIUKBFFNV-HNNXBMFYSA-N 345.512 5.125 30 20 EKED N#CCC[C@H](NCc1ccc(Oc2ccccc2)o1)c1ccccc1 181032235 ONBXCHGHOXGNAM-FQEVSTJZSA-N 332.403 5.207 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1nc(C2CCCCC2)cs1 277666376 SHZSNVASCHHIHI-CQSZACIVSA-N 341.480 5.094 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 358329123 OEEBOPUFPBLQEU-FDDCHVKYSA-N 341.458 5.444 30 20 EKED CC[C@H](N[C@H](c1ccc(C)cc1)c1ccccn1)c1ccc(C#N)cc1 366863896 KGYCOCMFAHZPKX-JTHBVZDNSA-N 341.458 5.092 30 20 EKED CC(C)(C#N)CCCCN1CCC(c2nc3ccccc3s2)CC1 444596856 ZWENLDQHDROCIB-UHFFFAOYSA-N 341.524 5.196 30 20 EKED N#Cc1ccccc1CNc1ccc(Oc2ccc(Cl)cn2)cc1 462167181 GLPSCCKMQTZZOY-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C)cc1C 476155804 QJFFVTJQBRXQBW-UHFFFAOYSA-N 335.491 5.727 30 20 EKED C=CCC1(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2C)CCC1 477828513 WYYRZKSOENTGQJ-KRWDZBQOSA-N 326.484 5.059 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1F 512668604 VYKZHQPHEHMNIP-CVEARBPZSA-N 345.421 5.171 30 20 EKED CCCc1ccc([C@H](NCc2ccc(C#N)cc2)c2cccs2)cc1 512836001 WHJHIHWCMYNMKB-QFIPXVFZSA-N 346.499 5.451 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@H](C)c1ccc(CC)cc1 523103004 LNPCWSCOBXEUCS-INIZCTEOSA-N 327.493 5.019 30 20 EKED N#CC1(CCCNc2ccc3oc4ccccc4c3c2)CCOCC1 537508242 GJAWZEILFGCQSH-UHFFFAOYSA-N 334.419 5.098 30 20 EKED C=C[C@@H](CC(=O)Nc1cnccc1-c1ccccc1)c1ccccc1 555529697 GTGAKIRIOPCZGM-KRWDZBQOSA-N 328.415 5.047 30 20 EKED CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(C#N)ccc1Cl 579999759 BWGGUEXMWZETFQ-UHFFFAOYSA-N 347.245 5.242 30 20 EKED CC(C)[C@@H](C#N)c1ccc(-c2ccccc2OC[C@H]2CCOC2)cc1 592987213 XHACBYYTDMMDNM-LAUBAEHRSA-N 335.447 5.032 30 20 EKED C=CCN(C(=O)[C@@H]1CCC[C@@H](C)C1)c1nc(-c2ccccc2)cs1 607443559 HLGGISNHZBFEGH-NVXWUHKLSA-N 340.492 5.155 30 20 EKED Cc1cc(C#N)ccc1CSCc1coc(-c2cccs2)n1 614394690 IIPHDRHCDXTNIK-UHFFFAOYSA-N 326.446 5.017 30 20 EKED O=C(/C=C/c1ncc[nH]1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 731156699 JJEXNBUINACUQX-VMPITWQZSA-N 348.349 5.053 30 20 EKED Cc1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1 731321758 RNIPMCGVCSJVMB-AWEZNQCLSA-N 341.505 5.198 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 733749164 GBWDOSDNKVXZPL-SOFGYWHQSA-N 339.372 5.121 30 20 EKED CC(C)(C)c1ncc(C=NOCc2ccc(C(F)(F)F)cc2)s1 746575731 GZQLUABKFTWAEA-UHFFFAOYSA-N 342.386 5.010 30 20 EKED CCC(=NNc1nc(C(F)(F)F)cs1)c1ccc(Cl)s1 755906021 VSNYURICTPKBPU-UHFFFAOYSA-N 339.795 5.103 30 20 EKED Cc1nn(C(C)C)cc1/C=C\C(=O)c1ccc(OC(C)C)c(Cl)c1 789157662 PFABSRUEOLKLRJ-VURMDHGXSA-N 346.858 5.109 30 20 EKED C=CCN(C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)C(C)C 799608123 BPJQDEPRJLDZEM-UHFFFAOYSA-N 337.250 5.025 30 20 EKED N#C[C@@H](Cc1ccccc1)Sc1nc(-c2ccc(F)cc2)cs1 852999786 OSPKEEQJEGNJAS-MRXNPFEDSA-N 340.448 5.176 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC(c2ncco2)CC1 862108295 DEGJDPNFUXJXSG-KRWDZBQOSA-N 334.504 5.157 30 20 EKED N#CCC[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 90665733 XAJZXECRQWUOMU-QZTJIDSGSA-N 342.895 5.512 30 20 EKED N#CCC[C@H](NC(=O)Nc1ccc2ccccc2c1)c1ccccc1 159623563 WYBBNKDPLGUYSV-FQEVSTJZSA-N 329.403 5.006 30 20 EKED Cc1ccc2c(c1)[C@H](Nc1cccc(OCCCC#N)c1)CCCO2 179820452 ZVSZNTFHPJCYRC-HXUWFJFHSA-N 336.435 5.003 30 20 EKED Cc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)oc2c(C)cccc12 193494125 TZQFMWOFORFOPI-UHFFFAOYSA-N 332.403 5.103 30 20 EKED N#CCCCCSc1nc(-c2ccccc2)c(-c2ccccc2)o1 195533531 RPVHMNPSOQPATR-UHFFFAOYSA-N 334.444 5.795 30 20 EKED O=C(/C=C/c1csc2ccccc12)c1c(Cl)nc2ccccn12 303700336 AZTAASRZGXRWCN-CMDGGOBGSA-N 338.819 5.099 30 20 EKED C=CCC[C@H](NCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 342218091 GSDDEBLDMGLPRG-HNNXBMFYSA-N 340.414 5.267 30 20 EKED C=C(C)[C@@H](NCc1nc2ccc(F)cc2s1)c1ccc(F)c(F)c1 428879511 HCJNOVMCAZUGPL-GOSISDBHSA-N 348.393 5.121 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc3ccccc23)s1 430621011 CSTSAOUWCCNGDC-GFCCVEGCSA-N 340.473 5.145 30 20 EKED N#CCCCC(=O)Nc1ccc(Cl)cc1-c1ccc(Cl)cc1 464524050 DTZDWMKWSMBQCO-UHFFFAOYSA-N 333.218 5.293 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccc2nc(C(F)F)sc2c1 490597101 KVBBAGPYASXQKP-JTQLQIEISA-N 339.411 5.100 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC(c2ccccc2)CC1 505036103 SNQUQCHOTUUKQA-UHFFFAOYSA-N 334.463 5.217 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 505040585 VVHJZFBNJBKECN-UHFFFAOYSA-N 347.462 5.119 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 510869747 YEGKTRLHFGUKCQ-RDJZCZTQSA-N 344.524 5.483 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(-c2ccncc2)cc1 512668606 VYKZHQPHEHMNIP-HOTGVXAUSA-N 345.421 5.171 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc(C#N)cc3)s2)cc1 517393167 IJJGZYAVHSVKTI-CQSZACIVSA-N 333.460 5.472 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1cc(C)ccc1C)c1ccccc1 534725332 GJZDVRCRJAMPIA-SIKLNZKXSA-N 333.475 5.327 30 20 EKED CCC(CC)[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccs1 538508418 LNEZUMMLKBKVSB-DJJJIMSYSA-N 330.472 5.587 30 20 EKED CC[C@H](NCc1ccc(-c2csc(C)n2)cc1)c1ccc(C#N)cc1 581923874 VODBMSFAMQERPK-FQEVSTJZSA-N 347.487 5.231 30 20 EKED N#CCCCCCC(=O)N(Cc1cccc2ccccc12)C1CCCC1 588753277 QHTQSKPFNYAZFT-UHFFFAOYSA-N 348.490 5.585 30 20 EKED CCC(C)(C)[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 596732809 OMBYRHCYUAVOPN-ZIAGYGMSSA-N 333.501 5.027 30 20 EKED CC(=C/c1ccccc1)/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990261 PSXCROZZIQNTEF-SBPBTPORSA-N 325.411 5.591 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cc(F)ccc1F 757475190 PNDMZZQTCACGDF-DUXPYHPUSA-N 333.384 5.046 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2cccnc2)C2CC2)cc1 773119285 ODJNUMNFBPNLEQ-MGPUTAFESA-N 342.870 5.015 30 20 EKED C#CCCCCC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 773290815 BUOMWCRWQBVGNI-KRWDZBQOSA-N 325.477 5.032 30 20 EKED CC(C)(C)c1csc(NC(=O)c2sccc2C(F)F)c1C#N 875759371 VCHORMANMRWJDN-UHFFFAOYSA-N 340.420 5.169 30 20 EKED N#C[C@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccn1 41493559 RNKCPNNBPCZGLJ-NSHDSACASA-N 347.226 5.093 30 20 EKED N#C[C@H](C(=O)c1ccsc1)c1nc(-c2ccc(Cl)cc2)cs1 41514770 WJUODQVRTPSENZ-CYBMUJFWSA-N 344.848 5.015 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1F 56469600 IAEFFBUAOLPXGP-UHFFFAOYSA-N 346.361 5.050 30 20 EKED N#CCC[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 90665735 XAJZXECRQWUOMU-MSOLQXFVSA-N 342.895 5.512 30 20 EKED CC[C@H]1CCCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 159297067 KDICODRPZHKJLI-CVEARBPZSA-N 345.512 5.267 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)s1 176942282 NVWHFIFGFSHCCG-LJQANCHMSA-N 338.863 5.152 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Cl)cc1C#N 184446600 GMSWXOKYBGRMHI-CYBMUJFWSA-N 341.867 5.076 30 20 EKED CCCCCCCC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 303396767 PTOYWDCNSBJOGI-AWEZNQCLSA-N 327.255 5.035 30 20 EKED C=CCC[C@H](N[C@@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 353626022 WYGKXFXSZRULCK-DLBZAZTESA-N 349.400 5.103 30 20 EKED CCC[C@@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 460154966 LXXMAOCAXJOXCL-OAHLLOKOSA-N 340.854 5.181 30 20 EKED C=C(C)[C@@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccc(F)c(F)c1 467362374 OYVWYCRZAKTYHD-AZUAARDMSA-N 347.380 5.007 30 20 EKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nccc4ccccc34)csc2c1 483975348 FPJUUOIQAXLTOI-KRWDZBQOSA-N 342.423 5.248 30 20 EKED N#Cc1cnc(N[C@@H]2CCc3c2ccc(Cl)c3Cl)c(Cl)c1 500415047 OEUUJIJANSAXNH-CYBMUJFWSA-N 338.625 5.013 30 20 EKED C[C@@H](Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 530694934 UCABFSVRARYIFJ-MRXNPFEDSA-N 347.462 5.250 30 20 EKED Cc1nc(-c2ccc([C@H](C)N[C@H](C)c3cccc(C#N)c3)cc2)cs1 540597423 NSJQKAMWUFVISQ-LSDHHAIUSA-N 347.487 5.402 30 20 EKED C[C@H](Nc1ccc(CN2CCCC[C@H]2C)cc1)c1ccc(C#N)cc1 540700883 NUNKQPXSJZFPHL-MSOLQXFVSA-N 333.479 5.106 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCC2)cc1)c1nc2ccccc2s1 574252886 XVSJHTSXCKYMCF-INIZCTEOSA-N 332.428 5.054 30 20 EKED C[C@@H](c1ccc(Oc2ccccc2)cc1)[S@](=O)CCC(C)(C)C#N 583073973 QJHAOJWAINBNKS-UPCLLVRISA-N 341.476 5.228 30 20 EKED N#Cc1cnc(N[C@H](Cc2ccccc2)c2cccs2)c(Cl)c1 609739104 APDZHTAGILZNQC-MRXNPFEDSA-N 339.851 5.064 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(Br)c1 610830283 KAOCDGQRPZVATR-FZKQIMNGSA-N 343.268 5.123 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc4c(c3)COC4)s2)cc1 742433989 BRIARSBNGOMXPB-HJWRWDBZSA-N 347.439 5.045 30 20 EKED O=C1/C(=C/c2nc(-c3ccccc3)cs2)Cc2cc(Cl)ccc21 742438284 VRHJVLHHKVLUSF-GXDHUFHOSA-N 337.831 5.286 30 20 EKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 746417454 YXVWZBQAHFWGGV-FQEVSTJZSA-N 342.442 5.133 30 20 EKED C[C@H](ON=Cc1ccc(C(C)(C)C)cc1)c1nnc(-c2ccccc2)o1 748094347 BCXWOMMLUMODEE-HNNXBMFYSA-N 349.434 5.146 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1C(F)(F)F 750900057 LSWGLZJZTSEZKB-ROYNJUEVSA-N 347.292 5.066 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cc(Cl)ccc1O)c1ccc(F)c(F)c1 775557790 KLMFEQZBHKEKPW-BBATYDOGSA-N 337.797 5.292 30 20 EKED C=C(C)CNC(=S)N(Cc1cccc2ccccc12)c1ccccc1 776268673 UDIRIDWMZPAWDJ-UHFFFAOYSA-N 346.499 5.297 30 20 EKED O=C(/C=C\c1cocn1)c1ccc(-c2ccc(Cl)cc2F)s1 790222838 FZDHBDUJCSCVTH-RQOWECAXSA-N 333.771 5.092 30 20 EKED N#CC[C@@H](CC(=O)O[C@@H]1CCc2sc(Cl)cc21)c1ccccc1 796768408 BUDQMKSTDTVHKB-DZGCQCFKSA-N 345.851 5.020 30 20 EKED CCCCCCCCC(=O)N1CCC([C@H](O)c2ccccc2C)CC1 804512117 VYEGXAYOLIZNQN-QFIPXVFZSA-N 345.527 5.018 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1O 806142806 QXPPZHSWPJTRNA-PIGZYNQJSA-N 349.261 5.373 30 20 EKED C=CC[C@H](OC(=O)c1nc(C)oc1C)c1ccc(Cl)c(Cl)c1 816068347 QKYFIDDPHKZFQR-AWEZNQCLSA-N 340.206 5.072 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(Br)ccc1C)c1ccncc1 858364502 FVBPFOHZBXFBRX-RDTXWAMCSA-N 345.284 5.121 30 20 EKED C=CCOc1ccccc1-c1nc(-c2c(Cl)cccc2Cl)no1 904309784 ICAHFPYLIPXPGA-UHFFFAOYSA-N 347.201 5.275 30 20 EKED O=C1/C(=C/c2csc(-c3ccccc3)n2)CSc2ccccc21 916154834 WOWHGXOBSWRIKX-GXDHUFHOSA-N 335.453 5.182 30 20 EKED CCOc1c(Cl)cc(/C=C\C(=O)c2ccc(C)s2)cc1OC 917044544 TXJDKDFMEOGWFN-SREVYHEPSA-N 336.840 5.013 30 20 EKED C[C@H]1C/C(=C/c2csc3ccc(C(=O)O)cc23)C(=O)c2ccccc21 1776589528 JBACELPZQSPKRK-CJAAZZPWSA-N 348.423 5.373 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)CCC[C@H]1C 173122090 NGSPGTATYDWYTO-OAGGEKHMSA-N 345.512 5.123 30 20 EKED C=CCN(Cc1cc(-c2ccc(Cl)cc2)no1)Cc1cccs1 248000206 NUDODVOMKOTVEH-UHFFFAOYSA-N 344.867 5.245 30 20 EKED Cc1ccc(N=C(O)[C@H]2CCCC(O)=N2)cc1OCC1CCCCC1 328840360 ZAXZRGTVNJTAHR-QGZVFWFLSA-N 344.455 5.051 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2ccc(OC3CCCC3)c(Cl)c2)CCC1=O 328905568 AWIXTEPUYYDXPG-CHWSQXEVSA-N 349.858 5.255 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCCCCC(C)(C)C#N 435888090 KWRFSFUMFYGNRU-UHFFFAOYSA-N 328.481 5.603 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(Cl)c2SC(C)C)CC1 438274352 WFTYUORXULXVDY-UHFFFAOYSA-N 338.904 5.270 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 464558353 GEZNLVSYAIMTON-KGLIPLIRSA-N 327.390 5.217 30 20 EKED Cc1ccc(Nc2nnc(SCCCC(C)(C)C#N)s2)cc1 476470908 KRZXSYLYKXOTOS-UHFFFAOYSA-N 332.498 5.012 30 20 EKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C 477356915 CAIDRDKSFKVEEU-CTNGQTDRSA-N 347.462 5.057 30 20 EKED Cc1ccc2c(C(=O)[C@H](C#N)c3nccc4ccccc34)csc2c1 483975349 FPJUUOIQAXLTOI-QGZVFWFLSA-N 342.423 5.248 30 20 EKED C=CCN(C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 521936046 QVJATUHDAKYRPP-ROUUACIJSA-N 345.364 5.028 30 20 EKED CC[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCCC1 590067681 GJQNALNKDRKRJW-PMACEKPBSA-N 341.499 5.080 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-c2ccco2)cc1F 619202851 YUQWYWSJSOFWJS-OAQYLSRUSA-N 346.405 5.125 30 20 EKED CCOc1c(Cl)cc(/C=C2\CCc3sccc3C2=O)cc1OC 726891269 HUGAPKFNOLZRNX-XYOKQWHBSA-N 348.851 5.021 30 20 EKED C[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2nc3ccccc3s2)CC(C)(C)C1 727629850 WURUOUPPRMTDRU-ILXRZTDVSA-N 340.492 5.325 30 20 EKED Cc1ccc2c(c1)C(=O)/C(=C\c1nc(-c3ccccc3)cs1)CCO2 727975904 IVZYVWINRCNKOL-VBKFSLOCSA-N 347.439 5.167 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)cn1 750909887 ONBZLGHAKVKXBU-VURMDHGXSA-N 340.423 5.228 30 20 EKED N#Cc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1 750917812 XQXDGFOGBGPWER-DHDCSXOGSA-N 341.382 5.085 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1O)c1ccncc1 756585075 WYNMVASCGDOQHU-XHDPSFHLSA-N 337.250 5.062 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(Cl)nc3)cs2)cc1 759084821 XXDRBRKMMMBWOZ-FPLPWBNLSA-N 340.835 5.063 30 20 EKED C#CC[C@@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccccc1 773104742 FSODCPUVURPPRK-QZTJIDSGSA-N 327.880 5.231 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C/c2scnc2C2CC2)cc1Cl 789157953 RZNMTOFNFLYDPE-SOFGYWHQSA-N 347.867 5.357 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3c(c2)oc2ccccc23)c1 795223578 OKHKHRGHYAMYRZ-UHFFFAOYSA-N 346.773 5.363 30 20 EKED CCc1c(C(C)=NNc2nncc3ccccc23)oc2ccc(C)cc12 915909953 WTPFWXKDTAXQPQ-UHFFFAOYSA-N 344.418 5.083 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776119475 BXQOIURLYVOSQF-HJWRWDBZSA-N 348.851 5.293 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(F)cc(C)cc1Cl 1776783670 BLFYONLJSPQMNB-AWEZNQCLSA-N 343.870 5.081 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cnc2ccsc2c1 126533764 STEBZUAZLQTKRJ-AWEZNQCLSA-N 337.448 5.152 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 303316498 GXJORCILUVIAHD-CYBMUJFWSA-N 344.867 5.295 30 20 EKED N#CCCC[C@@H](NC(=O)c1cccc2ccsc12)c1ccccc1 352168712 VZGRPROXKDVWNZ-GOSISDBHSA-N 334.444 5.066 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1 352179851 CTWLCQDMGCZSAU-GHTZIAJQSA-N 334.463 5.040 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@H]2C[C@H](c3cccc(F)c3)C2)CC1 436312456 KEKJWKXBKZISHK-OMCRWQCVSA-N 348.465 5.065 30 20 EKED CCN(C(=O)CC[C@@H](C)c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 440791637 KEALPRRRGKDWGP-MSOLQXFVSA-N 334.463 5.052 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1 443146438 OWKMPHZKKCCODI-OLZOCXBDSA-N 344.867 5.033 30 20 EKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1cccc(Cl)c1 460165199 FAXZIHJECAPRND-CYBMUJFWSA-N 344.867 5.088 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 466641600 KNWXVFODJLEKMP-LSDHHAIUSA-N 342.508 5.206 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1C 475579689 AEWOPXDCBGJSGU-UHFFFAOYSA-N 336.479 5.511 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(-c2ncco2)c1)c1ccccc1 489590744 LAPZHOKMFFFWSL-IBGZPJMESA-N 332.403 5.030 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc2ccsc12 501273801 PSKHIZRMSXKCPG-UHFFFAOYSA-N 328.462 5.183 30 20 EKED Cc1cc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)oc1C 502409002 VWEDCWSAKQGHJE-INIZCTEOSA-N 330.431 5.286 30 20 EKED COc1ccc([C@H](C)Nc2cc(C#N)ccc2OC(C)C)cc1Cl 507471711 YANDEWLBXAXFCM-ZDUSSCGKSA-N 344.842 5.181 30 20 EKED Cc1ccc(Sc2ccc(NC(=O)C3(C#N)CCC3)cc2)c(C)c1 522880401 CDXINZZXBSQIHB-UHFFFAOYSA-N 336.460 5.087 30 20 EKED N#Cc1cc(C(=O)Nc2ccccc2-c2cccs2)ccc1Cl 537167637 WOZIXUMXZQWWNQ-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#CCCC[C@H](NC1CCC(c2ccc(O)cc2)CC1)c1ccccc1 552083416 DAERAGVDXCMVJK-HCPAQRILSA-N 348.490 5.443 30 20 EKED Fc1cc(C(F)(F)F)c(F)cc1CNc1cccc(C(F)F)c1 577440276 ZLQITFJCMOVGPW-UHFFFAOYSA-N 337.238 5.533 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC(F)(F)F)cc1 586790323 SMDIWGQVQHEGBF-ACJLOTCBSA-N 348.368 5.259 30 20 EKED C[C@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1cccc(C#N)c1 610830274 JFQQAUCMVKXVKH-IRXDYDNUSA-N 327.431 5.032 30 20 EKED C#Cc1cccc(N(C(=O)c2ccc(SC(F)F)cc2)C(C)C)c1 728246809 ITQHRVNAFKBECQ-UHFFFAOYSA-N 345.414 5.038 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 731836011 YZDUBCZRPOXZSM-ZHACJKMWSA-N 343.304 5.257 30 20 EKED CCOc1ccccc1CSCc1cc(Cl)ccc1OCC#N 735318964 SWLWNUTXTSCBKR-UHFFFAOYSA-N 347.867 5.074 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccsc1 737501376 AWRBELHFLJGPHX-FOIQADDNSA-N 346.455 5.146 30 20 EKED C[C@@H](C(=O)OCc1ccc(-c2ccccc2C#N)cc1)c1ccsc1 738828029 CQTHMMOPVRKXQU-OAHLLOKOSA-N 347.439 5.134 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2C=CCCC2)cc1 777520840 SUKZRRRWCPJHHW-LAUBAEHRSA-N 330.431 5.027 30 20 EKED C=CCN(Cc1ccccc1F)C(=S)Nc1cccc(Cl)c1C 918164296 QRYAZWIMHDBUSX-UHFFFAOYSA-N 348.874 5.173 30 20 EKED CCCCCC(CCCCC)=NNc1ccc(Cl)c(C(=O)O)c1 1776033522 VMSYINLMJJOGIZ-UHFFFAOYSA-N 338.879 5.967 30 20 EKED C[C@@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1CCC#N 11408061 CYJWJBRQDICSNH-RHSMWYFYSA-N 349.865 5.243 30 20 EKED CC(C)c1ccccc1NC(=O)Nc1ccccc1SCCC#N 152858770 IAWSORPHPKQHGK-UHFFFAOYSA-N 339.464 5.460 30 20 EKED Cc1cc(N[C@H](C)c2cccc(C#N)c2)cc(C)c1Br 232022486 KJONHMIJYYUECH-CYBMUJFWSA-N 329.241 5.111 30 20 EKED C=C(C)COc1cccc(NC(=O)c2ccc(SC(F)F)cc2)c1 303127603 BFRHETXIFQYQQY-UHFFFAOYSA-N 349.402 5.209 30 20 EKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(Cl)c1 303475792 NTULSQAFRHUQTL-AWEZNQCLSA-N 341.842 5.044 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 340451042 ZIBRONUASFSQFZ-UXHICEINSA-N 337.423 5.071 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425623204 OWUPVHCADDAJGD-INIZCTEOSA-N 335.451 5.215 30 20 EKED C[C@H](N[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 442875941 UQFKMCWUWAATOI-DLBZAZTESA-N 342.442 5.343 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1CSC 469906504 LGWQAORBWQKURI-UHFFFAOYSA-N 340.492 5.160 30 20 EKED CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1cccc2ccccc12 475383560 MSIUUQRIKQNHPH-UHFFFAOYSA-N 342.442 5.308 30 20 EKED C=C(C)[C@@H](NCc1cnc(C(C)(C)C)s1)c1ccc(F)c(F)c1 479412743 JXRGQIJONMBWPQ-MRXNPFEDSA-N 336.451 5.126 30 20 EKED C[C@H](SCCCc1nc(-c2ccccc2)no1)c1cccc(C#N)c1 479545011 RJCITFYVRRWWIR-HNNXBMFYSA-N 349.459 5.035 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccccc2C)C(C)C)cc1OC 482139961 JIHFCWHBTFKBRU-QFIPXVFZSA-N 339.479 5.055 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1csc2ccccc12 493732891 CCGDFYGIJCKUSL-UHFFFAOYSA-N 328.462 5.183 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)c(F)c1 517408593 VQKYMAMZRZAQBV-BUXKBTBVSA-N 328.818 5.079 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)c(F)c1 517408595 VQKYMAMZRZAQBV-HXPMCKFVSA-N 328.818 5.079 30 20 EKED Cc1ccc2oc(CN(Cc3ccco3)Cc3ccc(C#N)o3)cc2c1 536670485 TXIOYPHMKRXGLM-UHFFFAOYSA-N 346.386 5.001 30 20 EKED C=CCN(C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)C1CC1 536753216 OMKYBPTXSMHPJH-UHFFFAOYSA-N 349.459 5.146 30 20 EKED N#Cc1cc(NCc2csc(-c3cccs3)n2)ccc1Cl 557443482 OONIHMBMISAEHV-UHFFFAOYSA-N 331.853 5.009 30 20 EKED N#CCCC[C@@H](NCc1cc(-c2ccccc2)cs1)c1ccccc1 560561003 AYVQAQNPDRTVQU-JOCHJYFZSA-N 346.499 5.940 30 20 EKED CC(C)C[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 727955162 ZZRLNPCRPZJFFT-HOCLYGCPSA-N 326.465 5.059 30 20 EKED Cc1csc(-c2ccc(N=Cc3cc(Cl)ccc3O)cc2)n1 750949982 LUQUZHSDIQLBAO-UHFFFAOYSA-N 328.824 5.228 30 20 EKED Cc1c(C(=O)/C=C\c2cnc(-c3ccncc3)s2)oc2ccccc12 753142038 NDUGPFAUNZLVFO-SREVYHEPSA-N 346.411 5.156 30 20 EKED N#CC1CCC(COC(=O)Cc2coc3ccc4ccccc4c23)CC1 755958177 WHBQYXHWDGFZSP-UHFFFAOYSA-N 347.414 5.002 30 20 EKED C=C[C@@H](CC(=O)O[C@@H](c1ccccc1)c1ccccn1)c1ccccc1 759276535 XDHUKGVTTTUKEN-MBSDFSHPSA-N 343.426 5.074 30 20 EKED Cc1nn(C(C)C)cc1/C=C/C(=O)c1cc(Cl)sc1Cl 798369881 UXRINJJEPDLPDH-SNAWJCMRSA-N 329.252 5.037 30 20 EKED Cc1ccc(-c2nc(CNc3ccccc3O[C@@H](C)C#N)cs2)cc1 182548787 ABQYCUMKRIZGAH-HNNXBMFYSA-N 349.459 5.022 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NCc1ccc(O[C@@H](C)C#N)cc1 236648573 XDTYWBCJCCGFON-AVRDEDQJSA-N 336.479 5.163 30 20 EKED N#CCCC[C@@H](NCc1csc(Br)c1)c1ccccc1 353913737 JBRXXBNVVNUOPU-OAHLLOKOSA-N 349.297 5.035 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 447559789 ASRYMZWWYOCKLF-UGSOOPFHSA-N 332.369 5.379 30 20 EKED CN(CCC1CCCCC1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458800962 MILHYAUJZSIXIL-FQEVSTJZSA-N 341.499 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2cc(C)ccc2O1 476997898 DBWXYFWDGAMRGE-NRFANRHFSA-N 349.474 5.179 30 20 EKED CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 480584554 JKJLZTWXCLZALI-QRWLVFNGSA-N 349.434 5.003 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc1 522607844 DZHNTKXPUUFFAG-MRXNPFEDSA-N 341.499 5.168 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 524831295 VWDNSWVGJDJRGV-UHFFFAOYSA-N 348.535 5.146 30 20 EKED CC(C)[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1 533693386 NXVPAIIVRINKDY-LJQANCHMSA-N 338.426 5.005 30 20 EKED C=C[C@H](CC(=O)Nc1ccc2nc(C3CC3)oc2c1)c1ccccc1 533991077 GYJRTJCWXWSZPN-CQSZACIVSA-N 332.403 5.004 30 20 EKED C=CCCC[C@H](C)Sc1nnc(C2CC2)n1Cc1ccccc1 537071707 FDRVRIMIUXPRBB-HNNXBMFYSA-N 327.497 5.041 30 20 EKED C=CC[C@H](C)[C@H](C)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 543113701 ZSOBNNGOGIYYMT-HOTGVXAUSA-N 340.442 5.020 30 20 EKED CC(C)[C@H](NCc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 543185924 AASVGISMUVJEQC-IBGZPJMESA-N 346.396 5.258 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 578683536 ZAAUCULWZBNFDE-OPAMFIHVSA-N 334.463 5.074 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccccc3)cc2)c1 731317163 AKSDTRCROCKCQF-UHFFFAOYSA-N 345.427 5.159 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccccc3C(F)(F)F)c2c1 734307805 SKWGVYJPOFUSMH-TWGQIWQCSA-N 345.320 5.091 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(SC2CCCC2)cc1 742431291 GTYDMNKNFYLDQV-ZHACJKMWSA-N 329.490 5.382 30 20 EKED CC(=NNc1cccc2ccccc12)c1[nH]c(-c2ccccc2)nc1C 747060231 LZGGRBSMQYBQOW-UHFFFAOYSA-N 340.430 5.374 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc2cc(O)ccc2c1 760266664 XXWJFFRDFTWKIF-CMDGGOBGSA-N 335.428 5.166 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cnn(-c2ccccc2)c1)c1ccccc1 773076843 PDKVMXZNPCBNQZ-XMSQKQJNSA-N 331.463 5.230 30 20 EKED CC(=NNc1nc2cc(Cl)ccc2cc1C)c1sc(C)nc1C 778553390 PCQKVXILQXHWLL-UHFFFAOYSA-N 344.871 5.106 30 20 EKED CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2ccccc2SCC#N)CC1 781461094 WMWCCAIIWGHHJM-JKSUJKDBSA-N 344.524 5.027 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1ccc(SC(F)F)cc1 782889107 BWMYIIZIWVNOEX-TWGQIWQCSA-N 341.382 5.446 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc(C)c(Br)s1)c1ccccc1 796340054 ILPKYGINGWAOBO-UKRRQHHQSA-N 348.309 5.234 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCCc2cc(SC(F)F)ccc21 806176213 JOKQFLGREVUGGE-MRXNPFEDSA-N 338.467 5.298 30 20 EKED COc1cc([C@H](C)Nc2ccc(CCC#N)cc2)ccc1SC 903298242 QSIBMIOVJBROBF-AWEZNQCLSA-N 326.465 5.046 30 20 EKED CCC[C@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 80457949 WVHNJGGIFCSSCY-HOTGVXAUSA-N 326.465 5.027 30 20 EKED CCc1ccc(C(=O)/C=C/c2ccccc2OCc2cccnc2)s1 107842496 FCJURWBSBJFUQT-PKNBQFBNSA-N 349.455 5.181 30 20 EKED CC(C)C[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 109028016 CFVHEAAXBBXMQO-HOTGVXAUSA-N 345.512 5.123 30 20 EKED COc1cc(C(=O)/C=C/c2cccc(OC(C)C)c2)ccc1SC 303019626 LLWQEYAPKHCHOE-CSKARUKUSA-N 342.460 5.100 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2cc(Cl)cc(Cl)c2[C@H]1C 466414037 GLQJGATXPUDGLE-NWDGAFQWSA-N 326.267 5.041 30 20 EKED CC(C)(C#N)c1ccccc1CSc1nccn1Cc1ccccc1 488484612 VBQOPVGWHOYZLE-UHFFFAOYSA-N 347.487 5.025 30 20 EKED CC(C)c1ccc([C@H](NCCCC2(C#N)CCOCC2)C(C)C)cc1 499597795 BEXMTDNDXGGJHK-OAQYLSRUSA-N 342.527 5.197 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(O[C@H](C)CC)cc1 511005774 ZHKLZRONONSPLB-QGZVFWFLSA-N 338.451 5.084 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1)c1ccccc1 536157202 GXXKVEOLGZSOTB-UGKGYDQZSA-N 333.475 5.327 30 20 EKED C[C@@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)c(F)c1 553914783 XVYRZTFNMZTIHC-LLVKDONJSA-N 349.236 5.344 30 20 EKED N#CCCCOc1cccc(CN[C@@H]2CCCC[C@@H]2c2ccccc2)c1 559072230 YQCGKTGHJNXEMI-DHIUTWEWSA-N 348.490 5.185 30 20 EKED CC(C)c1ccc(-c2nc(CN3CCC[C@H](CC#N)C3)cs2)cc1 595609989 RIAMZAKCNZQOAH-MRXNPFEDSA-N 339.508 5.059 30 20 EKED C[C@@H](SCc1coc(-c2ccc(F)cc2)n1)c1ccc(C#N)cc1 609824850 AVQYFKGLIQTTCY-CYBMUJFWSA-N 338.407 5.347 30 20 EKED C=CCN(C(=O)c1ccc(C)c(C)c1)c1nc(-c2ccccc2)cs1 641902346 TWFNKDOVSUBDFF-UHFFFAOYSA-N 348.471 5.260 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(N2CCCCCC2)cc1 766348817 BPTVLGNONKJKSV-OALUTQOASA-N 347.506 5.350 30 20 EKED C#CCOc1ccc([C@H](C)Nc2cccc(-c3nc(C)c(C)o3)c2)cc1 777240897 FDXQHJWNGPGKLN-INIZCTEOSA-N 346.430 5.144 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@]3(C)CC=CCC3)n2)cc1 835067250 CVSHENKDPSJABD-OXJNMPFZSA-N 336.460 5.041 30 20 EKED CC(CC(C)(C)C#N)=NNc1ncnc2sc(-c3ccccc3)cc12 853267599 VYRGVKPIRCYPFK-UHFFFAOYSA-N 349.463 5.086 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)c1 1776341427 HLCKXCNFAZTUOQ-SOFGYWHQSA-N 348.398 5.226 30 20 EKED C=CCC(CC=C)C(=O)N(CC)[C@@H](c1ccc(C)cc1)c1cccnc1 133091607 AAWBCHXDAWSJQT-QFIPXVFZSA-N 348.490 5.096 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)c1cccc(C#N)c1 181971813 JAEILOUQENAVIZ-UZLBHIALSA-N 332.472 5.254 30 20 EKED CC[C@H](c1ccccc1)c1nnc(S[C@@H](C)c2cccc(C#N)c2)o1 189844558 KYDWVMIXOOYGAZ-KBXCAEBGSA-N 349.459 5.336 30 20 EKED COc1ccc(Br)cc1S[C@@H](C)c1ccc(C#N)cc1 303856720 LACGKWITXPSNBB-NSHDSACASA-N 348.265 5.183 30 20 EKED C=CCOc1cccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)c1 432757946 LRPWZMUGHPOXQO-HXUWFJFHSA-N 348.446 5.011 30 20 EKED C=CCC[C@H](NCc1nc2ccc(OC)cc2s1)c1ccccc1 473997338 VNVADDLQAYSVKT-KRWDZBQOSA-N 338.476 5.102 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)ccc(C)c1F 476148941 MZZICFRPORZJQN-UHFFFAOYSA-N 329.390 5.377 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc(OC)c(F)c1)c1ccc(F)c(F)c1 480682328 NZWIONQIPKKHCI-BLVKFPJESA-N 335.369 5.081 30 20 EKED C=C(C)[C@H](NCc1csc(CCCC)n1)c1ccc(F)c(F)c1 481579008 GHLDZPOABDWLSC-SFHVURJKSA-N 336.451 5.171 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(-c2ncco2)cc1)c1ccccc1 489641457 NAVZWQNYGCWLRH-LJQANCHMSA-N 332.403 5.030 30 20 EKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3ccccc3)o2)cc1 489775711 HXBDEVHSKUWZTD-CQSZACIVSA-N 338.432 5.155 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c1 505149020 PDXULWPFAFQRAO-UHFFFAOYSA-N 344.801 5.035 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 505242260 IOKNDRVWADRANU-GOSISDBHSA-N 328.799 5.011 30 20 EKED Cc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517656245 ZHZRQRCIJCFYMH-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C=CCSCc1nc(O)c2c(-c3ccc(C)cc3)c(C)sc2n1 524457845 FOHBPPMPRJJFAS-UHFFFAOYSA-N 342.489 5.100 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)Cc1ccsc1 530553317 JQGJOUDFNTUITM-HNNXBMFYSA-N 342.508 5.353 30 20 EKED C[C@@H](CCC(F)(F)F)NCc1ccc(-c2ccccc2C#N)cc1 541555877 JYOXGIBLHXPFMM-AWEZNQCLSA-N 332.369 5.046 30 20 EKED CCC(CC)c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 545673395 OSTCKAHJPDLBFC-KHPPLWFESA-N 334.423 5.012 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCC#Cc1ccccc1Cl 574896989 VOYGIHDAPBSMAW-HNNXBMFYSA-N 340.879 5.055 30 20 EKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)CCCCCC#N)cc1 588299751 POKOMYXCVXUFAH-IBGZPJMESA-N 326.484 5.122 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccc(C#N)cc1 594010373 KYAAQRPBTZDLCI-QGZVFWFLSA-N 346.474 5.227 30 20 EKED C=CCCCCCN(C)C(=O)c1c[nH]cc1-c1ccc(Cl)s1 606881678 YOKWCFPWDFKVIL-UHFFFAOYSA-N 336.888 5.215 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2cc(C(F)F)ccc2Cl)C1 666393105 XEYGNQVSYJIPRN-LLVKDONJSA-N 328.790 5.098 30 20 EKED CCCCCC[C@@H](C)CC(=O)Nc1nc(C)c(SCC#N)s1 727663716 IGJLTIANGRRXCM-GFCCVEGCSA-N 339.530 5.002 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)Oc2ccc(Cl)cc21 729150998 MGPHVDHYGZVPST-MKMNVTDBSA-N 345.832 5.141 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(Cl)c(Cl)c1 746346579 RTSGKHHNAGYMBW-VURMDHGXSA-N 337.250 5.284 30 20 EKED CC[C@@H](C)CN(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748942386 PBAOKHPJMUKVJC-UTKZUKDTSA-N 349.478 5.242 30 20 EKED C[C@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 755610346 NIVCRYKRHLDJQU-CHWSQXEVSA-N 347.409 5.070 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(F)=C2CCCC2)cc1 763024646 LMPLLEBODYNLJD-LJQANCHMSA-N 334.394 5.078 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2SC(F)F)cc1 792877112 DLVRUBOUPSHWDT-UHFFFAOYSA-N 346.402 5.055 30 20 EKED Oc1ccc(C2CCC(=NNc3ccc4ccccc4n3)CC2)cc1 814697386 LZZWFYPYIJBJCL-UHFFFAOYSA-N 331.419 5.066 30 20 EKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)cc1 845553402 RMLCLSUXHCVUAT-BXUZGUMPSA-N 346.883 5.074 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776119619 GUWCJFDIJFZKMX-WMZJFQQLSA-N 348.398 5.325 30 20 EKED N#Cc1ccc(CN[C@@H](CCCc2ccccc2)c2ccccc2)cc1 15056469 FFVGERMIBOXTEW-DEOSSOPVSA-N 340.470 5.412 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cccc(C#N)c1)C1CC1 65889292 XRFCOHIWNNIULC-INIZCTEOSA-N 340.426 5.077 30 20 EKED CCCCCCCCOC(=O)CCC(=O)OCCCCCCCC 100313378 KWABLUYIOFEZOY-UHFFFAOYSA-N 342.520 5.574 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H]2CCCC[C@H]2C1 191508324 IWJNALBXOVVPNF-ROUUACIJSA-N 326.484 5.192 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 195708784 WBXUQPHNPQFUQG-GOSISDBHSA-N 349.434 5.147 30 20 EKED N#CCCCOc1cccc(NCc2nc(-c3ccccc3)cs2)c1 237827333 ASZHZAVXOQYWJX-UHFFFAOYSA-N 349.459 5.105 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2c[nH]c3ccccc23)o1 277535346 HZCSQDNKQHXJHJ-UHFFFAOYSA-N 340.452 5.030 30 20 EKED N#Cc1ccc(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c(Cl)c1 430366087 HBIDJMZYKPDJDO-ROUUACIJSA-N 346.817 5.107 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(-c2cccnc2)ccc1C 432807418 WTCISHUZEHOHAW-UHFFFAOYSA-N 337.467 5.267 30 20 EKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3ccc(F)cc3)c3ccccc23)C1 450585520 QLWSPORWLIDTSR-CJNGLKHVSA-N 349.434 5.220 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)CC(C)(C)C 467495663 WKVVVNINAXICCE-AWEZNQCLSA-N 347.528 5.417 30 20 EKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3Cl)c2)cc1 482358849 SAXIDNIEWCSMSJ-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccncc1 505034192 BGHNAHQPABFGDC-NRFANRHFSA-N 349.478 5.349 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H](C)Cc1cncc2ccccc12 510138647 FZASPBNIDNBSGO-KRWDZBQOSA-N 344.458 5.171 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1sccc1Cl 511701878 SXKKMSUNKIOZST-JTQLQIEISA-N 336.869 5.048 30 20 EKED CC1(C)CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 520940578 YGJJZRMZVDXSDS-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)sc1Cl 536840795 VVICJAWPKYIICW-FZMZJTMJSA-N 339.291 5.751 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H]1CCc2ccc(Cl)cc21 544046179 PEXCSKMDXCZGBW-SUMWQHHRSA-N 342.895 5.691 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(Oc2cccnc2)cc1)c1ccccc1 571441703 ZCJFHNCEVYQPCC-QGZVFWFLSA-N 344.414 5.172 30 20 EKED CC(C)(c1noc(C[C@H](CC#N)c2ccccc2)n1)C1CCCCC1 589149782 SOHDXLIOSPSNAK-KRWDZBQOSA-N 337.467 5.167 30 20 EKED Cc1nc(-c2ccc(CNc3c(Cl)cccc3C#N)s2)cs1 610272647 NGJTWIMETPSPMA-UHFFFAOYSA-N 345.880 5.317 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2cccc(C(F)F)c2Cl)C1 666700379 AVYDGVURCWYLFT-LLVKDONJSA-N 328.790 5.098 30 20 EKED Cc1cc(NCC(C)(C)CCC#N)ccc1NC(=O)OC(C)(C)C 697643459 UQDLCBAFMULVAZ-UHFFFAOYSA-N 331.460 5.084 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)cc1 741470817 WIBQVZNUQAEEDW-CXUHLZMHSA-N 344.410 5.267 30 20 EKED Cc1cc(C)cc(-c2ccc(C=NNc3cccc(C(=O)O)c3)cc2)c1 1776036858 GYZQPCYPBRIYCM-UHFFFAOYSA-N 344.414 5.115 30 20 EKED CCCCCCC[C@@H](C)CNc1nc2ccccc2c(C)c1C(=O)O 1776782322 HQRYWKXRANZWBW-OAHLLOKOSA-N 342.483 5.650 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 52662637 GCDQEMXCUMHYES-NRFANRHFSA-N 332.834 5.091 30 20 EKED CC(C)Sc1ccccc1NC(=O)c1cccc(SCC#N)c1 122132942 ADHJQCSMWJSSBV-UHFFFAOYSA-N 342.489 5.055 30 20 EKED CCc1c([C@@H](C)NCc2ccc(OCC#N)cc2)oc2ccc(C)cc12 181934067 BJLQRNWHMPCCDV-MRXNPFEDSA-N 348.446 5.057 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1cccs1)c1cccc(C#N)c1 181971832 JAEILOUQENAVIZ-OXJNMPFZSA-N 332.472 5.254 30 20 EKED CCC[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 185223424 XLUHYFYPDSIJBU-HOTGVXAUSA-N 345.512 5.267 30 20 EKED Cc1ccc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1F 330018545 SYLQFLIOHKBAOC-KTAKPFMOSA-N 346.446 5.077 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(CC(C)C)c1 355590451 ZSZXBWAYXAULCB-UHFFFAOYSA-N 340.471 5.035 30 20 EKED C[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1F 427874067 HVENFPUAYZMKSM-QWRGUYRKSA-N 337.225 5.416 30 20 EKED CC1(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCCC1 437480563 YKTGAFGTRSYKTB-UHFFFAOYSA-N 338.382 5.008 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC(C)(C)C1 443595046 SVMUZKRSAADREA-CABCVRRESA-N 345.512 5.171 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 500741975 IRABWJSHDXWIAW-INIZCTEOSA-N 341.476 5.066 30 20 EKED C=CCC(C)(C)c1noc([C@@H](F)c2ccc(C(F)(F)F)cc2)n1 551493481 YFKPMWHTSWSDJX-LBPRGKRZSA-N 328.309 5.001 30 20 EKED Cc1c(C(=O)Nc2cc(F)ccc2Cl)sc2ccc(C#N)cc12 559533562 JHRLALHNJMPULA-UHFFFAOYSA-N 344.798 5.126 30 20 EKED Cc1cc2cc(CN[C@H](CCCC#N)c3ccccc3)oc2cc1C 581840532 NOHFZSAWRMLLDW-OAQYLSRUSA-N 332.447 5.574 30 20 EKED C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)CCCCCC#N 598451903 FMUUDJFTISOQGQ-HXUWFJFHSA-N 348.490 5.120 30 20 EKED Cc1cccc2sc(C(=O)N(CCC#N)CCC(C)C)c(Cl)c12 609142936 MEGSGUQUMMIGTB-UHFFFAOYSA-N 348.899 5.265 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2cc(C(F)F)ccc2Cl)C1 666393107 XEYGNQVSYJIPRN-NSHDSACASA-N 328.790 5.098 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2nccn2Cc2ccccc2)cc1 734097021 WNOKQGZGUFFKOT-OUKQBFOZSA-N 344.458 5.026 30 20 EKED C=CCN(CC1CCCCC1)C(=S)N[C@@H](CC)c1cccs1 734379805 IMDXFFPBAMGHGJ-INIZCTEOSA-N 336.570 5.142 30 20 EKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 735396845 BFKIKJTXSMXZFR-OCCSQVGLSA-N 332.444 5.218 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)ccc1O 747188305 LCSFLFBUCUETIB-NTMALXAHSA-N 336.412 5.025 30 20 EKED C[C@@H](NCc1cccc(SC(F)(F)F)c1)c1ccc(C#N)cc1 781340926 FYVQCPJXHAWRBF-GFCCVEGCSA-N 336.382 5.021 30 20 EKED CCCCCCCCC(=O)N1CCC([C@@H](O)c2ccccc2C)CC1 804512116 VYEGXAYOLIZNQN-JOCHJYFZSA-N 345.527 5.018 30 20 EKED C=CCC(F)(F)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 815146044 LXVULHAUKFTABF-CQSZACIVSA-N 335.419 5.049 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)o1)c1ccc(F)cc1F 916127516 BSTJBBRLNPDHAS-RMKNXTFCSA-N 328.289 5.260 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccsc1C(F)F 935606892 WUSAHILHGXHYTL-UHFFFAOYSA-N 335.419 5.790 30 20 EKED CC(C)(C#N)CCCNc1ccc(Cl)cc1[C@@H](O)c1ccccc1 154048068 YBOXSMJTGVZAKP-IBGZPJMESA-N 342.870 5.164 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Cl)nc1 180220910 XZTFDMSRHMWXCP-OAHLLOKOSA-N 347.849 5.124 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCSc3c(F)cccc32)c1 193906776 RTUBVKZEMKAHJB-GOSISDBHSA-N 342.439 5.157 30 20 EKED CCC(CC)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1 236703691 CTSHKGZGGCSZRD-VGSWGCGISA-N 336.479 5.245 30 20 EKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)C1CCCCC1 330005603 CCNWSQSUNFWDDI-UHFFFAOYSA-N 348.531 5.475 30 20 EKED N#CCCC[C@H](NCc1cscc1C(F)(F)F)c1ccccc1 353902975 UKNQHJQZTNBZHE-INIZCTEOSA-N 338.398 5.292 30 20 EKED C=C(C)COc1cccc(NC(=O)CCc2c[nH]c3ccc(C)cc23)c1 469380903 HUELBCHWGKTKGR-UHFFFAOYSA-N 348.446 5.003 30 20 EKED Cc1cccc(C)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 474361633 ZJZLEWMDTZGFAM-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1cc(Cl)ccc1-c1ccc(C)o1)OCC 477913082 CMYWKBRBJFBFJS-GOSISDBHSA-N 347.842 5.218 30 20 EKED C=CCC[C@@H](C(=O)Nc1cncc(Cl)c1Cl)c1ccccc1 489400358 HOMFDAJKVBMYIY-CYBMUJFWSA-N 335.234 5.077 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccsc1 505034272 CEJVYXOVUPDPFK-SFHVURJKSA-N 326.465 5.236 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 511825630 PMGMIRSZZUJASU-SJORKVTESA-N 338.417 5.261 30 20 EKED N#Cc1c(Cl)cccc1SCc1coc(-c2ccc(F)cc2)n1 536736799 COVALUSDLMTCHM-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C=CC[C@@H](C)[C@H](C)Nc1ccccc1CN(C)C(=O)c1cccs1 541206233 PDYCGAPMEIZPGW-CVEARBPZSA-N 342.508 5.033 30 20 EKED Cc1cccc(COc2ccc([C@@H](C)Nc3cccc(C#N)n3)cc2)c1 570723898 DRGJDKPRBRMLCA-QGZVFWFLSA-N 343.430 5.014 30 20 EKED CC[C@@H](NCc1ccc(-c2csc(C)n2)cc1)c1ccc(C#N)cc1 581923875 VODBMSFAMQERPK-HXUWFJFHSA-N 347.487 5.231 30 20 EKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 609824827 ABWRUPMYXDLDMV-UZUQRXQVSA-N 342.442 5.007 30 20 EKED C#Cc1cccc(NC(=O)c2sc3cc(C)ccc3c2Cl)c1 729170045 FJRRRTXZHVLQHN-UHFFFAOYSA-N 325.820 5.097 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(Br)c(F)c1)c1ccccc1 773114974 LMGWCKDSJFHUAK-ACJLOTCBSA-N 346.243 5.003 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 776073831 ANBJMQFBOUQIMP-RDJZCZTQSA-N 348.471 5.132 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(Cl)c(F)c1 789146661 AVVNGRKNUZYJJJ-XQRVVYSFSA-N 333.771 5.092 30 20 EKED CC[C@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 796902982 HXFRKLQNEBTRNW-NWDGAFQWSA-N 348.418 5.091 30 20 EKED CCCCCCCCCC(=O)N1CC2(CCOCC2)[C@@H]1c1ccco1 855601049 RPCGZOKLSZELOB-FQEVSTJZSA-N 347.499 5.100 30 20 EKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccccc3Cl)c2c1 1776115150 OYIXCLNWIJSFAL-FNORWQNLSA-N 342.803 5.149 30 20 EKED O=C(/C=C/c1ccc(C(=O)O)c(F)c1)c1ccc(-c2ccccc2)cc1 1776131000 DBKRVWJUSOPXQR-NTUHNPAUSA-N 346.357 5.087 30 20 EKED C=C(C)COc1cc(CNCc2ccc3ccccc3c2)ccc1OC 60949502 JECQCGNQUNSXQF-UHFFFAOYSA-N 347.458 5.093 30 20 EKED N#Cc1ccc(CNc2cccc(COC3CCCCC3)c2)s1 123603692 XGMZNDHVZOJHQQ-UHFFFAOYSA-N 326.465 5.081 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 159295375 BOBXIZUWXZMVSX-INIZCTEOSA-N 345.512 5.291 30 20 EKED COc1ccccc1[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1 181942814 CWYQARTYCUJUNK-HXOBKFHXSA-N 342.442 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(F)cccc1Cl 189868389 LFDZXMMHKBIOHX-UHFFFAOYSA-N 345.845 5.512 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 237477104 ZOVMIENFGHASCS-MRXNPFEDSA-N 346.405 5.340 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340438973 BEMQFORMJPDVHQ-PMACEKPBSA-N 328.406 5.441 30 20 EKED C[C@H]1CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)c2ccccc21 356760957 GJSWZEPWTSSDAJ-PKOBYXMFSA-N 332.447 5.004 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cc2ccccc2s1 439455155 TYPYYWWTGSVGSD-LBPRGKRZSA-N 326.852 5.277 30 20 EKED CC(C)(C)c1ccc(CC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487363554 XHTRAEHWQWDMRP-NRFANRHFSA-N 348.490 5.078 30 20 EKED N#CC1(CCCSCc2ccc(Cl)cc2Cl)CCOCC1 507510950 NREPCIWECBJXGT-UHFFFAOYSA-N 344.307 5.327 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2ccccn2)cc1 514695333 CMAIRGALHDOSAW-UHFFFAOYSA-N 349.459 5.030 30 20 EKED Cc1ccc(C)c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 523122684 PWIVXDICRBXWHK-UHFFFAOYSA-N 341.414 5.171 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccccc2N2CCCC2)CC1 538825152 RKGIMIRBJNBSLT-UHFFFAOYSA-N 345.490 5.103 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)c(F)c1 553791266 QAXOSQNOIPHGOJ-ZUOKHONESA-N 326.390 5.028 30 20 EKED C#Cc1cccc(N(C(=O)c2ccc(-c3ccccc3F)o2)C(C)C)c1 728247592 LYSZHEUSKQWITN-UHFFFAOYSA-N 347.389 5.122 30 20 EKED CSc1ccc(C(=O)/C=C\c2c[nH]nc2-c2cccc(C)c2)cc1 728785898 PCKHSADNQJEWCM-FLIBITNWSA-N 334.444 5.003 30 20 EKED C[C@@H](SCC(=O)Nc1ccc2ccccc2c1)c1ccc(C#N)cc1 735675173 CBVCYUNVQQHOOS-OAHLLOKOSA-N 346.455 5.144 30 20 EKED C#Cc1cccc(NC(=O)N(C2CC2)[C@@H](C)c2ccc(Cl)cc2)c1 735863152 BPKJPODGDCLMPJ-AWEZNQCLSA-N 338.838 5.079 30 20 EKED COc1ccc(/C=C2\C(=O)c3ccsc3S[C@H]2C)cc1Cl 742436960 PCRSSOQJEJNCNX-PPLKPFPSSA-N 336.865 5.171 30 20 EKED CCOc1ccc(/C=N/[C@H](C)c2ccc(-c3ccncc3)cc2)c(O)c1 746392917 GDQUGOHUWPZODO-DTVDJLOLSA-N 346.430 5.033 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(F)c1 749324955 WLBPFQHJYKBONJ-FQEVSTJZSA-N 344.389 5.042 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1coc(-c2ccccc2)n1 749893529 ZGOKSKPPFMQSSG-VAWYXSNFSA-N 328.371 5.027 30 20 EKED FC(F)(F)C1CCC(C=NNc2ccccc2Br)CC1 767355334 GLNWLADFMLWOBR-UHFFFAOYSA-N 349.194 5.216 30 20 EKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4ccccc4)cc3)cc2)CC1 776728556 JXISTCTYSXMNMP-UHFFFAOYSA-N 338.410 5.161 30 20 EKED C[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(OCC#N)cc1 777143645 LDYRVTVUTOBLPJ-MRXNPFEDSA-N 338.451 5.077 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2ccc(C3=CCCC3)cc2)cc1 813427991 OYZNIBSYEPZHBT-UHFFFAOYSA-N 330.431 5.123 30 20 EKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCCCCC1 838604107 NYICZXQLEMEWOJ-HXUWFJFHSA-N 341.499 5.176 30 20 EKED N#CCCCCC(=O)O[C@H](c1ccc2ccccc2c1)C(F)(F)F 851583825 RKANMHNDCHKJLG-QGZVFWFLSA-N 335.325 5.070 30 20 EKED C[C@@H](Nc1cccc(Cl)c1SC(F)F)c1cccc(C#N)c1 864010282 UIHHFYIMHPJEJA-SNVBAGLBSA-N 338.810 5.699 30 20 EKED C[C@@H](N[C@H]1CCc2cccc3cccc1c23)c1ccc(OCC#N)cc1 866294646 KVZXGUSVHOWHID-ZHRRBRCNSA-N 342.442 5.080 30 20 EKED CC(=NNc1ccnc2cc(Cl)ccc12)c1cc(F)ccc1F 916269445 OQSIQRMWODMFMR-UHFFFAOYSA-N 331.753 5.003 30 20 EKED CCN(Cc1cc2ccccc2nc1Cl)[C@@H](C)c1ccc(C#N)cc1 918739231 GQENDBSREQCUIH-HNNXBMFYSA-N 349.865 5.343 30 20 EKED CCCCCCCCC[C@@H](C)CC=NNc1ccc(C(=O)O)cc1 1776012488 AMOOQKNCDUKCEQ-QGZVFWFLSA-N 332.488 5.949 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1cc(C(=O)O)ccc1Cl 1776786065 IBYBFXAFOIPDHV-ZDUSSCGKSA-N 339.863 5.363 30 20 EKED CC(C)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 58989373 UNTXYMSIIDYMPW-SFHVURJKSA-N 340.854 5.370 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)sc2ccc(F)cc12 64681014 YAKZHZMHYRTMJN-UHFFFAOYSA-N 344.798 5.126 30 20 EKED Cc1nc(CNc2cccc(Oc3ccc(C#N)cc3)c2)sc1C 88533196 MVIKCDATUWLQHI-UHFFFAOYSA-N 335.432 5.036 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccccc1CC(F)(F)F 131798666 IDVIZVLDADOPBR-UHFFFAOYSA-N 332.369 5.205 30 20 EKED N#CCCSc1ccccc1NCc1ccc(Br)cc1 176872488 VHYZMLAWOOYAMW-UHFFFAOYSA-N 347.281 5.067 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cccc(F)c1F 182721914 QLDZJOKWAQCNLI-VOTSOKGWSA-N 333.384 5.046 30 20 EKED N#CCCC[C@H](NCCCc1ccccc1Cl)c1ccccc1 433021149 VXYCPQVLBWQJRR-FQEVSTJZSA-N 326.871 5.297 30 20 EKED N#C[C@@H]1CC[C@H](Nc2ccc(SCc3ccccc3Cl)cn2)C1 442833346 HLRXSFGQXIKLIX-HIFRSBDPSA-N 343.883 5.131 30 20 EKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCCC1 487387197 INYMMXOKPTVIBV-XLIONFOSSA-N 326.484 5.144 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 523027220 FRWACCVISOBCHX-UHFFFAOYSA-N 344.842 5.562 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(F)F)c1F 529134175 CJXWXSXQHZAHFD-UHFFFAOYSA-N 347.380 5.868 30 20 EKED CCCN(C(=O)c1ccc(CC#N)cc1)[C@@H](C)c1cc2ccccc2o1 533922643 RCZIOIRLZMHIPD-INIZCTEOSA-N 346.430 5.112 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 576256923 FTXYZEWDXJZNIX-KRWDZBQOSA-N 336.435 5.033 30 20 EKED C[C@@H](N[C@@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 609825275 OUQOQQZCZUMABJ-DVECYGJZSA-N 340.470 5.583 30 20 EKED CCCCCCCCCC(=O)N1CCCO[C@@H](c2ccccc2)C1 729836761 UFBZZRKCZAEPAI-HXUWFJFHSA-N 331.500 5.117 30 20 EKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744037573 YLLDGHVZPKPBEU-DOTOQJQBSA-N 340.492 5.593 30 20 EKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 764566832 GRNUSSGDQKJTLQ-HOTGVXAUSA-N 326.465 5.059 30 20 EKED C[C@H](NC[C@H]1CC1(Cl)Cl)c1ccc(-c2cccc(C#N)c2)cc1 782522939 HKIFEFCCGXCDKL-SCLBCKFNSA-N 345.273 5.070 30 20 EKED CCCCCCCC[S@](=O)Cc1coc(-c2ccc(C)cc2)n1 790140628 VHPIHBNTDYXQJR-QHCPKHFHSA-N 333.497 5.259 30 20 EKED CCN(C)c1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 815636322 SNWWJMJMUXSYQL-PGRDOPGGSA-N 335.495 5.228 30 20 EKED N#CCCC[C@H](NC(=O)c1cc(C2CC2)oc1C1CC1)c1ccccc1 820479113 SEBLIAJYWVHHHV-IBGZPJMESA-N 348.446 5.199 30 20 EKED CC(C)(C#N)c1ccc(CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1 848539894 PNEZXBSGMGZZPG-HXUWFJFHSA-N 346.474 5.024 30 20 EKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3F)o2)c(F)c1 917033577 JAYLEJYVEPNORC-JXMROGBWSA-N 340.325 5.130 30 20 EKED COc1cc(C)ccc1C(=O)/C=C/c1csc(-c2ccsc2)n1 920065672 DZQZJXHWFZBQPC-GQCTYLIASA-N 341.457 5.085 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc2ccccc2c1C 1776784759 RPTNGMVMMUBCQL-HXUWFJFHSA-N 341.495 5.442 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)sc2cccc(F)c12 8331488 FVCCEZPTGLOBGL-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1c(F)cccc1F 108408204 UVNUNOMENDUQSD-CHWSQXEVSA-N 332.419 5.390 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCCCC(C)(C)C#N 183711990 CJJQNOAWWQRVQJ-CQSZACIVSA-N 327.497 5.099 30 20 EKED CC(C)c1cccc(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c1 330008392 GOQDGAJBTZEAMC-UHFFFAOYSA-N 342.483 5.192 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccoc3C3CC3)c2)cc1 409652134 NENKYNLWPVASFI-UHFFFAOYSA-N 344.370 5.073 30 20 EKED N#CCCC[C@@H](Nc1nccc(Oc2ccccc2)n1)c1ccccc1 431491899 ZSEGUWVGAFHAHU-LJQANCHMSA-N 344.418 5.116 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1 444938791 YZRIQUSSDOKHFN-UHFFFAOYSA-N 330.378 5.018 30 20 EKED CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458798806 IPUZUCDRYVRJBT-YSIASYRMSA-N 341.499 5.032 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=O)[C@H](C)c3cccc(C#N)c3)c2)o1 462323876 AWHNDVPSZQQMNV-MRXNPFEDSA-N 344.414 5.177 30 20 EKED CC(C)[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 487606992 WSGUHPXSUBVHDN-FGZHOGPDSA-N 348.490 5.368 30 20 EKED C=CCOc1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 497500560 CZCQJXZGRHLNPD-UHFFFAOYSA-N 337.463 5.751 30 20 EKED C=CCC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 498949638 WFZIKEQLTOWYPG-MRXNPFEDSA-N 332.447 5.005 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 520197739 NEQFERZEXWUKPV-MRXNPFEDSA-N 349.434 5.004 30 20 EKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 521271714 ZQVNWGRMBARWLU-LJQANCHMSA-N 349.434 5.003 30 20 EKED CCN(C(=O)c1ccc2sccc2c1)c1ccc(C#N)c(Cl)c1 540273256 DOFQWZLPAGZUKZ-UHFFFAOYSA-N 340.835 5.093 30 20 EKED N#CCc1ccc(CSCc2csc(-c3cccs3)n2)cc1 543149974 MWWQCKQBXUXGKF-UHFFFAOYSA-N 342.514 5.371 30 20 EKED CCOc1ccccc1[C@H](CC)N[C@@H]1CCCc2cc(C#N)ccc21 611392381 PQYMZKGPLLYDTP-LEWJYISDSA-N 334.463 5.075 30 20 EKED Cc1cc(C#N)ccc1CSc1nnc(-c2ccc(C(C)C)cc2)o1 614402964 SVPXWDGQNALQBH-UHFFFAOYSA-N 349.459 5.332 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747193624 KVKWLHOIHXZEPX-RHSMWYFYSA-N 340.492 5.199 30 20 EKED C=CC[C@@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccncc1 766020600 QOUAIDOFMOMETG-DNVCBOLYSA-N 336.435 5.113 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 766350664 NKORMMIAIOKRGY-JKSUJKDBSA-N 340.854 5.101 30 20 EKED C=CCC(C)(C)c1noc(-c2ccc(C3SCCCS3)cc2)n1 815707646 JMMSIVRGNKFNPS-UHFFFAOYSA-N 346.521 5.459 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@]1(C#N)CC12CCCC2 839272864 WRSJMQNWNGEVPP-FQEVSTJZSA-N 342.508 5.298 30 20 EKED CCC(C)(C)OCc1cccc(N[C@H](C)c2cc(C#N)ccn2)c1C 902904041 IUEWIRHFYABJKU-MRXNPFEDSA-N 337.467 5.140 30 20 EKED CC[C@H](C)c1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776698231 IYRALTQGGBLMPN-IEMQHYRPSA-N 338.403 5.012 30 20 EKED N#CC1(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)CCCCC1 44385722 PIWIQAFPRNXDQV-UHFFFAOYSA-N 331.630 5.059 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 90665294 YNOBGEXSQKRWGT-APWZRJJASA-N 347.487 5.506 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccncc1 191440996 JDVIJKMFMZQGOU-INIZCTEOSA-N 337.467 5.158 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(Cl)c1 192970325 ZPELXWNRSVJFGI-AUUYWEPGSA-N 328.843 5.044 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2cccc(CSC3CCCC3)c2)CC(O)=N1 329678911 QOJSEZWDCJOOHW-ZFWWWQNUSA-N 346.496 5.205 30 20 EKED C[C@H](SCc1csc(-c2ccoc2)n1)c1cccc(C#N)c1 443134447 ANUBJRTVDRYSQJ-LBPRGKRZSA-N 326.446 5.269 30 20 EKED C[C@@H](CC(C)(C)C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 454769450 UACUYBDVVONWPB-KBPBESRZSA-N 333.501 5.027 30 20 EKED N#Cc1ccc(SCc2ncc(-c3ccc(Cl)cc3)o2)c(F)c1 524987754 HRUKTYGVEVMCIB-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C[C@@H](Nc1cc(Cl)cc2cccnc12)c1ccc(C#N)cc1F 541897137 XCPBABXQMXZHRP-LLVKDONJSA-N 325.774 5.072 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1nc(-c2cccc3ccccc23)c(C)s1 552441697 SDOPXSMTJPTEET-HXUWFJFHSA-N 349.459 5.150 30 20 EKED Cc1sc([C@H](C)N[C@H]2CC[C@H](C#N)C2)nc1-c1ccc(Cl)cc1 555424517 HJKVWUAODRWBIP-RBOXIYTFSA-N 345.899 5.115 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C2CC2)cc1 597180540 QSQXZGQAIIKKDP-CQSZACIVSA-N 336.460 5.068 30 20 EKED Cc1cccc(Oc2ccc(NC(=O)c3cccc(CC#N)c3)cc2)c1 603730838 PBMKNWYOLZDAET-UHFFFAOYSA-N 342.398 5.106 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C#N)Cc1ccccc1 609918799 PHDRUTPCCGLHLK-RTWAWAEBSA-N 346.499 5.065 30 20 EKED C=C(C)COc1cc(CN[C@](C)(CC)c2ccccc2)ccc1OC 730817973 YEVQGMFMEKFVPT-JOCHJYFZSA-N 339.479 5.065 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc(F)cc(F)c1 755704188 IIJWFCSOALMACJ-UPHRSURJSA-N 333.384 5.046 30 20 EKED CC(C)(CC#N)COC(=O)[C@@H](Sc1ccccc1)c1ccccc1 764835530 YUWGSVXPPSEDMS-SFHVURJKSA-N 339.460 5.003 30 20 EKED C[C@@H](CC(=O)OCC(C)(C)CCC#N)c1ccccc1C(F)(F)F 798877226 QMYAQGBNRBUNQW-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED C=CC[C@H](N[C@H](C)CC(C)(C)c1c[nH]c2ccccc12)c1ccncc1 812716698 PFCRBSGNQOVCIQ-UTKZUKDTSA-N 347.506 5.526 30 20 EKED CC(C)[C@@H]1C[C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccccc21 858520452 ABNAYPFRGWGXQX-SSKFGXFMSA-N 334.463 5.124 30 20 EKED N#Cc1ccc(F)c(CNc2ccc3ccc(Cl)c(Cl)c3n2)c1 864009623 OOUIKMNETNJDCL-UHFFFAOYSA-N 346.192 5.164 30 20 EKED CC1(C)/C(=C\c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 920070354 PQPOEFYREOSCOS-SXGWCWSVSA-N 337.469 5.429 30 20 EKED Cc1c(NN=C2C[C@@H](c3ccccc3)C[C@@H](C)C2)cccc1C(=O)O 1776087053 GHEJHJXBGGDOBO-PBHICJAKSA-N 336.435 5.065 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)CC2 187803070 LFTTWLFNTKKHPG-ZHRRBRCNSA-N 334.463 5.050 30 20 EKED C=CCC[C@H](NCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 342222491 MFHZSRMQSITPJG-KRWDZBQOSA-N 338.373 5.107 30 20 EKED N#CCCCC(=O)N(Cc1cccc2ccccc12)c1ccccc1 362021778 FLEXAYPTJOQSLY-UHFFFAOYSA-N 328.415 5.067 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(-c2cscn2)c1 410354771 PJIGJENHVWOREN-UHFFFAOYSA-N 334.444 5.181 30 20 EKED C=C(C)[C@@H](NCc1cnc(C2CCCC2)s1)c1ccc(F)c(F)c1 479408303 HQNUPUXRJXSGLL-GOSISDBHSA-N 348.462 5.486 30 20 EKED CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 525412327 SPQCBCJWZKGKFG-OAGGEKHMSA-N 345.512 5.029 30 20 EKED Cc1cc2cc(C(=O)[C@H](C#N)c3nc4ccccc4s3)oc2cc1C 525859833 OOPGAQKNOLXYJX-AWEZNQCLSA-N 346.411 5.149 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3sccc3s2)n1 531330839 ACUDPSKVUGUWAS-VIFPVBQESA-N 332.475 5.033 30 20 EKED N#CC1(CCCSc2ccc(Cl)c(Cl)c2)CCOCC1 537501382 ZHZHELBMJBABKP-UHFFFAOYSA-N 330.280 5.186 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccccc1Oc1ccccc1 540596038 JHPBIDYZDXCGMU-OAHLLOKOSA-N 334.444 5.263 30 20 EKED CN(C(=O)CCCCCC#N)[C@@H](c1ccc(Cl)cc1)C1CCCC1 588760258 YGHXQBWLARJTNE-HXUWFJFHSA-N 346.902 5.504 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(F)c1 614160409 UEOFDASXJAQUQK-NHCUHLMSSA-N 338.401 5.121 30 20 EKED Cc1cc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)c(C)s1 727975735 HHLRSAAKVOSQON-CMDGGOBGSA-N 325.458 5.385 30 20 EKED CCC(CC)CN(CCC#N)C(=S)Nc1cccc(C(C)C)c1 729641997 BJOKZJKTYNZUGJ-UHFFFAOYSA-N 331.529 5.159 30 20 EKED O=C(/C=C\c1cnc2ccccn12)c1ccc(-c2ccccc2F)s1 740764695 BXZGSIWSMSJIPJ-HJWRWDBZSA-N 348.402 5.098 30 20 EKED CC(C)c1ccc(NC(=S)N[C@H](CCC#N)c2ccccc2)cc1 747707723 AZQIWYDYSKNLGA-LJQANCHMSA-N 337.492 5.141 30 20 EKED Cc1cc(F)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 771250682 LNQAXUFSOVHQDT-OAQYLSRUSA-N 344.389 5.042 30 20 EKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 776086442 GUNCBXLXKPPQKB-OCCSQVGLSA-N 332.444 5.218 30 20 EKED C#CCCCCCC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 779849256 CCQIVWBTQYBFNC-LJQANCHMSA-N 345.895 5.191 30 20 EKED CC/C(C)=C(\C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 779853540 QMEZVKIJVFFJCJ-WUKNDPDISA-N 348.446 5.017 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(SC(C)(C)C)cc1C 820744411 GJTOYTMTZOGTJD-IYBDPMFKSA-N 344.524 5.601 30 20 EKED CC(=NNc1nccc2sccc12)c1cc(C)ccc1OC(F)F 915980151 OBCSEHKITKBJMK-UHFFFAOYSA-N 347.390 5.042 30 20 EKED Cc1ccc(-c2nc(/C=C3/Cc4c(F)cccc4C3=O)cs2)cc1 921264457 ULIVOKDOTHIKNS-ZROIWOOFSA-N 335.403 5.080 30 20 EKED CC(C)CN(CC(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955074 GHTGULWPTXCIQQ-MRXNPFEDSA-N 347.528 5.227 30 20 EKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1cccc2ccccc12 182905264 LZIXMGZBZWIKGZ-UHFFFAOYSA-N 340.426 5.062 30 20 EKED C[C@@H]1CCC[C@H](C/C(O)=N/[C@H](C)c2ccc3c(c2)CCC(O)=N3)C1 329011046 ZRWDJICHQZPING-KFWWJZLASA-N 328.456 5.455 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)CSCC1(C#N)CCC1 419576049 FUDZFHMZIZRXAK-UHFFFAOYSA-N 344.524 5.299 30 20 EKED C[C@@H](CC1CCCCC1)NC(=O)N[C@H](CCCC#N)c1ccccc1 431908732 GBYAXMSJEWFDSQ-FXAWDEMLSA-N 341.499 5.080 30 20 EKED CCc1cc(C#N)c(NC(=O)C2CCC(c3ccccc3)CC2)s1 443881570 RWOAFRLKPKADSS-UHFFFAOYSA-N 338.476 5.095 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 464537389 XHQOKGAOKPKJNR-AWEZNQCLSA-N 336.460 5.504 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C1CCCCC1 475546035 KUNQUZZVAXVHEQ-UHFFFAOYSA-N 328.500 5.725 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C(C)C)C(F)(F)F 475556950 VFSPFDHNEFIABH-INIZCTEOSA-N 342.405 5.247 30 20 EKED C[C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(Cl)c2ccccc12 483692125 LWYSEJFWEHWMBL-CYBMUJFWSA-N 338.813 5.355 30 20 EKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1 495531513 SQULBADZMOZVQM-INIZCTEOSA-N 346.405 5.449 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cccc(C#N)c1 500443767 VFSREAFPGDOFFY-MRXNPFEDSA-N 346.455 5.023 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 503139608 MOWNPJOCGLHOHT-XUWVNRHRSA-N 330.497 5.092 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(C2CCCC2)n1 511284829 ZXAGFEKKIDQPEO-UHFFFAOYSA-N 338.451 5.436 30 20 EKED C[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1F 512612820 QBJQNSYAODQCHC-QGHHPUGFSA-N 349.236 5.342 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCC1CCCC1 521811143 VISGLWRLELGYCT-HNNXBMFYSA-N 345.512 5.173 30 20 EKED CCN(CCC1CC1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 546930498 XFYSMDDRRDRDHR-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H](NCc1ccc(CC#N)cc1)c1ccc(-c2ccccc2)cc1 570316955 WBIJYDNZTXEIPD-SFHVURJKSA-N 326.443 5.270 30 20 EKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nccc4ccccc34)sc12 579037034 OMRVSCRUANOWMV-QGZVFWFLSA-N 342.423 5.248 30 20 EKED CC(C)c1ccc([C@H]2CCCCN2C(=O)CCCCCC#N)cc1 588663524 SNJQYQHOKAGAHB-HXUWFJFHSA-N 326.484 5.338 30 20 EKED N#CC1(CC(=O)Nc2ccc3nc(C(F)F)sc3c2)CCCCC1 597649118 GICOBFMCKGYSRO-UHFFFAOYSA-N 349.406 5.037 30 20 EKED Cc1cccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 609175842 IXWXLEVZYAQLAV-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CCSc1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614178766 DFNPFBAFIZVSIM-INIZCTEOSA-N 338.520 5.451 30 20 EKED N#Cc1cc(F)ccc1CN1CCC[C@H]1c1ccccc1C(F)(F)F 728570843 QIIDNNNAXNGXFG-SFHVURJKSA-N 348.343 5.053 30 20 EKED COc1cc(/C=C\C(=O)c2oc3ccccc3c2C)ccc1SC 746341601 DEIHKDJZGXPBFK-NTMALXAHSA-N 338.428 5.368 30 20 EKED C[C@H](ON=C1CCC1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753822016 GCDGAKACCGBXID-VIFPVBQESA-N 325.195 5.266 30 20 EKED COc1ccc2ccccc2c1C=NOc1ccccc1C(F)(F)F 754709575 KUJUDNPSBNRBAY-UHFFFAOYSA-N 345.320 5.280 30 20 EKED C[C@H](C=NOCc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1 756895486 PLKMPGHMEKITLE-GFCCVEGCSA-N 325.305 5.151 30 20 EKED C=CC[C@H](N[C@H]1CCCc2c1sc1ccccc21)c1ccncc1 766023031 ZPXCXTMIESUXDA-OALUTQOASA-N 334.488 5.581 30 20 EKED CC(C)(C#N)CCCCSCc1cc(Cl)ccc1OCC#N 766822447 IDVYOPJARXBQPW-UHFFFAOYSA-N 336.888 5.196 30 20 EKED CC(C)Sc1cccc(Cl)c1CNCc1ccc(C#N)cc1 792919141 DTDJURYWMULOTH-UHFFFAOYSA-N 330.884 5.002 30 20 EKED O=C(/C=C\c1ccc(OC(F)F)c(F)c1)c1c(F)cccc1Cl 809159142 JBAHFTLSGQQGDP-XQRVVYSFSA-N 344.691 5.116 30 20 EKED COc1c(O)cccc1/C=C\C(=O)c1ccc(-c2ccccc2)s1 810235334 OCJPMFOIZRGPNC-KHPPLWFESA-N 336.412 5.025 30 20 EKED CCC[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 813060800 KDMAHTMEWMVZTP-BPLDGKMQSA-N 344.867 5.076 30 20 EKED N#C[C@H](C(=O)[C@H]1CCCC2(CC2)C1)c1nc2cc(Cl)ccc2s1 850770973 GVAFVESUOQATNJ-WCQYABFASA-N 344.867 5.096 30 20 EKED Cc1c([C@H](N[C@H](C)c2cc(C#N)ccn2)C(C)C)oc2ccccc12 902800814 UMYKMLDPZLEOMW-FOIQADDNSA-N 333.435 5.056 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(C(C)(F)F)c1 1776784739 OXIDWBBLHBKWQA-QGZVFWFLSA-N 341.442 5.092 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1 105464659 PPEOJLQEAGAJGZ-LJQANCHMSA-N 341.499 5.285 30 20 EKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1 329059289 YRHPGECJOQDUOW-MTFMMBMASA-N 342.483 5.410 30 20 EKED N#CCCC[C@@H](N[C@H]1CCSc2c(F)cccc21)c1ccccc1 340442207 FGUKJIHAGWWWFL-MOPGFXCFSA-N 340.467 5.387 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 340451034 ZIBRONUASFSQFZ-PMACEKPBSA-N 337.423 5.071 30 20 EKED C[C@H](C1CCCCC1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458840006 MXTVQEGBLMXKNN-YLJYHZDGSA-N 341.499 5.032 30 20 EKED CC(C)C[C@@]1(C)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458857045 ZJDNMRJKYRGDBA-TZIWHRDSSA-N 341.499 5.032 30 20 EKED N#CCCCC(=O)Nc1ccc(Sc2ccccc2Cl)cc1 461916750 KKUWNWLTSPSOHS-UHFFFAOYSA-N 330.840 5.124 30 20 EKED CCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](CC)c1ccccc1 461990355 XBVOYDWWBWGIJI-UWJYYQICSA-N 334.463 5.052 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 466254373 PSJBPIYCWCPLHW-CYBMUJFWSA-N 338.278 5.211 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)S[C@@H](C)c2ccc(C#N)cc2)n1 476171428 XXLBINGBWDLQDX-LSDHHAIUSA-N 349.459 5.472 30 20 EKED COc1ccc(Cl)c(CNc2ccccc2SC[C@H](C)C#N)c1 479469581 HRQGVSSIDMHTPD-CYBMUJFWSA-N 346.883 5.212 30 20 EKED C[C@@H](Nc1ccc(Cl)cc1C#N)c1nc2ccccc2n1C(F)F 486454264 YMBNQWJQPLTQIL-SNVBAGLBSA-N 346.768 5.130 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccc3ccccc3c2)c1 518818391 AXOIVWFWJQEJQO-VWLOTQADSA-N 348.449 5.591 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 523090622 NXWVGHHCNQQBHA-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 535397993 UWJSZVHKFWYAGI-APWZRJJASA-N 339.866 5.016 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1C(F)(F)F 540442940 BHKYAXNGEXVYJT-CQSZACIVSA-N 346.396 5.357 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Nc1ccc(F)cc1F 588957322 UFJOKMCEJYGZTG-UHFFFAOYSA-N 343.377 5.121 30 20 EKED N#CCCC[C@H](N[C@@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593628624 DQILSKPZDVDGPX-ZWKOTPCHSA-N 342.845 5.491 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(F)cc1C(F)(F)F 599037884 ILFQRHNADXRVIA-GFCCVEGCSA-N 348.343 5.056 30 20 EKED CC(=O)c1c(C)cc(C)c(CSc2ccc(C#N)cc2F)c1C 607433746 VZNIEXIORYEARX-UHFFFAOYSA-N 327.424 5.118 30 20 EKED C=C(C)CNc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 733305077 XOFLFUKAXRAOSY-UHFFFAOYSA-N 326.293 5.020 30 20 EKED CCCCCCCCCC(=O)N1CCCC[C@@H]1c1noc(C2CC2)n1 737626287 HMFMEXUFTZAKAI-QGZVFWFLSA-N 347.503 5.141 30 20 EKED C[C@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 755665845 RKNMHYXJSRWRHW-YPMHNXCESA-N 332.444 5.074 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1nc2ccccc2s1 756519450 OJBLXMHIHOXFSW-QKPAOTATSA-N 338.476 5.079 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(N2CCCCC2)cc1 776796345 JCSUPDBIVBZHOG-JOCHJYFZSA-N 331.463 5.038 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1cc2ccccc2s1 780187719 FGDZXQMKISQOHF-KHPPLWFESA-N 342.423 5.254 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3csc(Cl)c3)co2)cc1 787186956 ULMONWTYWVRZEF-VOTSOKGWSA-N 329.808 5.261 30 20 EKED C#Cc1ccc(CN[C@H](C)c2ccc(-c3ccccc3OC)cc2)cc1 809624800 QANSCNMIJMHCDY-GOSISDBHSA-N 341.454 5.194 30 20 EKED CSc1ccc(C=NOCc2ccc(C(F)(F)F)cc2)s1 814882818 YGZRCZHETBVYIK-UHFFFAOYSA-N 331.384 5.040 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1O 815635708 IAKHZWPYCZTEQQ-VGOFRKELSA-N 344.458 5.631 30 20 EKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccs1 818194733 OEVZVOOJJDBJLQ-CLFYSBASSA-N 341.413 5.281 30 20 EKED CC1(C)C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932564002 PMZHPYQYMBNNLA-FQEVSTJZSA-N 347.462 5.148 30 20 EKED Cc1cccc(CNc2cccc(OCc3cccc(C#N)c3)c2)c1 59801051 FRQRXYBHCHPMMG-UHFFFAOYSA-N 328.415 5.058 30 20 EKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 163558399 NQNZNPMVMVDYIQ-HNNXBMFYSA-N 348.233 5.160 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1O 186150848 CUQGPFFAXWMUHG-HRAATJIYSA-N 330.431 5.241 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1cccc(OCc2ccccc2)c1 434796238 SXEUJLAUACTPLK-MRXNPFEDSA-N 348.471 5.050 30 20 EKED CC(C)Oc1ccc([C@@H]2CCC[C@H]2NCC2CCC(C#N)CC2)cc1 442867705 MCKQOOSRZPCAMV-GHZCZGOHSA-N 340.511 5.029 30 20 EKED N#Cc1cccc(NC(=O)c2c(F)cccc2Sc2ccccc2)c1 463635819 QTPVBVSBRSGJCK-UHFFFAOYSA-N 348.402 5.101 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cccc(Cl)c1F 466841916 APNGKRXNMGEBSZ-GFCCVEGCSA-N 334.847 5.343 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C(C)C)c(Cl)c2)n1 467269318 RAOBWQJWFYVVCE-CQSZACIVSA-N 346.883 5.533 30 20 EKED C=CCC[C@@H](NCc1nc2ccc(OC)cc2s1)c1ccccc1 473997339 VNVADDLQAYSVKT-QGZVFWFLSA-N 338.476 5.102 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(F)cc1 476086011 UKGJKSZFINHPFX-OAHLLOKOSA-N 341.426 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc2ccccc12 476166451 WEQUYTDZXYCZRG-UHFFFAOYSA-N 343.470 5.873 30 20 EKED C=CCCCC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1ccccn1 480843980 NHFRANLYTLFNKG-FQEVSTJZSA-N 342.870 5.029 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F 505016925 NYIRSLIWZUQPBP-AWEZNQCLSA-N 344.405 5.308 30 20 EKED C=C[C@@H](CC(=O)Nc1scnc1-c1ccccc1)c1ccccc1 536249336 QEJVOMHCUJNSEO-HNNXBMFYSA-N 334.444 5.109 30 20 EKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 540333850 ZCWQMXLYEKOPKN-LJQANCHMSA-N 326.871 5.382 30 20 EKED CCc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 550826415 DZNXLEVCDJCRMW-LAUBAEHRSA-N 346.474 6.081 30 20 EKED CC(C)c1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)C(C)C)cc1 603650880 KNRBTADDUYVZSE-NRFANRHFSA-N 349.478 5.395 30 20 EKED CCCN(CCC)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434329 URBRICNUUZUIMK-UHFFFAOYSA-N 337.423 5.004 30 20 EKED Cc1ccccc1-c1nnc(S[C@H](C#N)c2ccc(Cl)cc2)o1 619863839 JDILLZNKWYFCCL-OAHLLOKOSA-N 341.823 5.055 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cccc(Cl)c1Cl 734981306 PLYONVHBUAQCBG-XQRVVYSFSA-N 327.594 5.249 30 20 EKED CCC[C@@H](CC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744766314 NLZGWWJTKRTZBH-QUCCMNQESA-N 335.451 5.042 30 20 EKED CCOc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)ccc1O 744869234 RMATXDHZEOUXTB-HYXAFXHYSA-N 343.231 5.055 30 20 EKED CC(C)[C@H]1CC[C@H](C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)CC1 753551509 XWKKMKBEFPJSKW-YDHLFZDLSA-N 344.455 5.074 30 20 EKED Cc1ccc(OC(F)F)c(C=NOc2ccccc2C(F)(F)F)c1 754712755 SBJPTHPSVRLUSK-UHFFFAOYSA-N 345.267 5.028 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccncc1 766017807 DRSRWACCIUSOAL-ZWNOBZJWSA-N 327.280 5.418 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccc(Cl)c(Cl)c1)c1ccncc1 766021424 STCQJPANIIVTSK-ROUUACIJSA-N 335.278 5.747 30 20 EKED CC(C)C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1 774816082 UWXADPITJUJYIW-LJQANCHMSA-N 342.870 5.119 30 20 EKED N#CCCCCCC(=O)N1CC2(CCCCCC2)[C@H]1c1ccccc1 828002277 SCHGAJXAKCXQGB-OAQYLSRUSA-N 338.495 5.385 30 20 EKED O=C(O)c1cc(NN=Cc2ccc(C3CCCCC3)cc2)ccc1F 1776065158 YCMGJTXUJVKEGU-UHFFFAOYSA-N 340.398 5.018 30 20 EKED CC(C)c1cc(C(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccc2n1 15532746 XJTYFWJHRFKSGN-UHFFFAOYSA-N 349.821 5.136 30 20 EKED CC[C@@H](C#N)Sc1ncnc2scc(-c3ccc(C)cc3)c12 436060916 SDWQWGOPPDBHHH-ZDUSSCGKSA-N 325.462 5.061 30 20 EKED C=CCOc1ccc(CNc2ccc(COCC)cc2)cc1Cl 439479558 VJNBXYGKEUPONA-UHFFFAOYSA-N 331.843 5.053 30 20 EKED C[C@@H](CCCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 480169651 XCCPZBSJPIOAOA-GXFFZTMASA-N 345.302 5.530 30 20 EKED CC(C)c1ccc(CCC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487607863 YJZVHHJKWAEXLZ-JOCHJYFZSA-N 348.490 5.294 30 20 EKED N#Cc1ccccc1SCc1nc2cc(C(F)(F)F)ccc2o1 488870002 NAMXFWYKQYDBML-UHFFFAOYSA-N 334.322 5.011 30 20 EKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3ccccc3)o2)cc1 489775710 HXBDEVHSKUWZTD-AWEZNQCLSA-N 338.432 5.155 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@]1(CCC)C(F)(F)F)c1ccccc1 499521598 SBGKBGOVVZFFCD-MAUKXSAKSA-N 339.401 5.070 30 20 EKED CC(C)CC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 518255115 GBBGCZKCSPYPNJ-CABCVRRESA-N 333.501 5.027 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C)c1ccc(C#N)cc1 524069125 XWHHSTFJWXTKLE-DYESRHJHSA-N 346.499 5.563 30 20 EKED Cc1cccc2sc(C(=O)Nc3ccc(C#N)c(F)c3)c(Cl)c12 589799290 CKAGJVUUJVVZEE-UHFFFAOYSA-N 344.798 5.126 30 20 EKED COc1ccc([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)c2ccccc12 618807875 XVVRJGNZEZQNLP-IVZQSRNASA-N 342.442 5.058 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)C1(C#N)CCCC1 726762312 BWRWFTGTSIVBQY-UHFFFAOYSA-N 338.838 5.338 30 20 EKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 747194122 TWCCNOKVVPCCLQ-SJORKVTESA-N 340.492 5.273 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccccc1C(F)(F)F 760263734 IAGAHIINOZJDLB-CMDGGOBGSA-N 337.366 5.326 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1cccc(C(F)(F)F)c1 760263802 IOHJRVHSQPUYHI-BQYQJAHWSA-N 337.366 5.326 30 20 EKED CC(C)c1cc(=O)oc2cc(OCCCCC(C)(C)C#N)ccc12 767048238 XPIXUZLPNUMXQA-UHFFFAOYSA-N 327.424 5.015 30 20 EKED CC(C)C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 772960318 QZNUALSQBSEBQF-HXUWFJFHSA-N 342.870 5.119 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2C=CCCC2)cc1 777520839 SUKZRRRWCPJHHW-DYESRHJHSA-N 330.431 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C(C)=C\c1ccc(F)cc1 789718968 MALODKHVQWEATL-PEZBUJJGSA-N 337.438 5.720 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(F)c3ccccc23)cc1 808437907 YGILSBOXLSXKGT-HZPDHXFCSA-N 348.421 5.121 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ccccc2Cl)n1 810606157 SXFGBQWLTXVVPB-AWEZNQCLSA-N 346.883 5.119 30 20 EKED CC(CC(C)(C)C#N)=NNc1nc2cc(C(F)(F)F)ccc2s1 853312526 XVISDIULMYHFIT-UHFFFAOYSA-N 340.374 5.043 30 20 EKED N#CC1(Cc2nc(-c3ccc(-c4ccccc4)cc3)no2)CCCCC1 904547452 AWGWZXHNPQZKIC-UHFFFAOYSA-N 343.430 5.420 30 20 EKED CC(F)(F)C(C)(C)CNC(CCC(F)(F)F)CCC(F)(F)F 926798470 AWUPOANIIWIDOR-UHFFFAOYSA-N 343.302 5.311 30 20 EKED Cc1ccc(CCCC(=O)Nc2ccccc2SCCC#N)s1 79472270 UDCCTMRNZOGCPR-UHFFFAOYSA-N 344.505 5.024 30 20 EKED C[C@H](NCc1ccc(F)c(-c2cccs2)c1)c1ccc(C#N)cc1 324698846 XEPFQCNTTFHFIT-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C=CCC[C@@H](NCc1ccc(C)nc1)c1ccc(C(F)(F)F)cc1 360730145 WAAQMBISINYKNE-GOSISDBHSA-N 334.385 5.206 30 20 EKED Cc1ccc(-c2nnc([C@H](C)SCCC(C)(C)C#N)o2)cc1C 419472381 HQFAJVPGSZGDQO-AWEZNQCLSA-N 329.469 5.088 30 20 EKED N#CCCC[C@@H](Nc1ncnc2sc3c(c12)CCC3)c1ccccc1 431491546 WGBKMLVXHXIPCL-MRXNPFEDSA-N 348.475 5.027 30 20 EKED Cc1ccc2c(C3=CCN(CCCCC(C)(C)C#N)CC3)c[nH]c2c1 444652966 VEMJADCVQAPWPE-UHFFFAOYSA-N 335.495 5.286 30 20 EKED CCc1ccc(Cl)c(CC)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 463105847 MCYYKCINVPPWKF-ZDUSSCGKSA-N 340.854 5.079 30 20 EKED C=CCSc1ccccc1C(=O)N[C@H](C)c1cc2ccccc2o1 468283292 XGGRZFKQRQPRCJ-CQSZACIVSA-N 337.444 5.202 30 20 EKED Cc1cc2cc[nH]c2cc1NC(=O)c1sc2ccc(C#N)cc2c1C 504223905 ZKUCEASXTMYKBQ-UHFFFAOYSA-N 345.427 5.123 30 20 EKED C=CC1CCN(C(=O)c2ccccc2SCc2cccs2)CC1 518377583 GKVIQHFWTRMIAL-UHFFFAOYSA-N 343.517 5.079 30 20 EKED CC(C)(CCC#N)CNCc1ccccc1Oc1cccc(F)c1 525182674 LSEAKFPIDXCYRN-UHFFFAOYSA-N 326.415 5.038 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(C(F)F)c1Cl 541792632 CBDYYDHUVGJSTG-UHFFFAOYSA-N 330.806 5.488 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H]1CCc2ccc(Cl)cc21 544046178 PEXCSKMDXCZGBW-GUYCJALGSA-N 342.895 5.691 30 20 EKED Cc1cc(C)c(C#N)c(S[C@H](C)c2ncc(-c3ccccc3)o2)n1 564684951 OCYCMTILJPVJJB-CQSZACIVSA-N 335.432 5.078 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1nccc2ccccc12)c1ccc(F)c(F)c1 569860962 JHDLDYYKWRGORW-JLTOFOAXSA-N 338.401 5.481 30 20 EKED N#CCCCCCC(=O)Nc1cccc(-c2ccc3ccccc3c2)n1 588340401 BMYFQRFPKXNXPK-UHFFFAOYSA-N 343.430 5.314 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2ccccc2)c1 589741241 WMQRMMHSRRFHGS-HXUWFJFHSA-N 336.435 5.011 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(C)cc1OCc1ccccc1 605913335 QILXLXQUOUMBIQ-UHFFFAOYSA-N 338.451 5.004 30 20 EKED CC[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 609046365 CQUWPSFCKHNXFN-QGZVFWFLSA-N 349.434 5.065 30 20 EKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1CCCCC1 609434377 AGIVLLKBQGQAJI-UHFFFAOYSA-N 349.434 5.147 30 20 EKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCCC2)c1ccsc1 609969233 MDHSTWXSIUACGK-GFCCVEGCSA-N 344.505 5.082 30 20 EKED CC[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2s1 734078916 FIOQAKOAIKASFP-CVEARBPZSA-N 340.492 5.469 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3ccccc3Cl)c2)s1 740013293 CHKJSWFMIIESDE-UHFFFAOYSA-N 338.863 5.230 30 20 EKED N#CCc1ccc(NC(=S)Nc2ccccc2-c2ccccc2)cc1 750982530 XVCLTVPRPAIGMK-UHFFFAOYSA-N 343.455 5.229 30 20 EKED C=CCC[C@@H](NCc1ccc(F)nc1)c1ccc(C(F)(F)F)cc1 778172188 YCSRLFTUVASCQT-MRXNPFEDSA-N 338.348 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)nc(Cl)c1 789718947 LHJWTCVIKBHZRZ-UHFFFAOYSA-N 349.261 5.493 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccc(N=Nc2ccccc2)cc1 806101615 LBIAZDUSUUFAKA-UHFFFAOYSA-N 349.438 5.553 30 20 EKED N#Cc1ccc(Br)c(CNc2cccc3ccccc23)c1 863996711 XPBJUZLCXIFDDQ-UHFFFAOYSA-N 337.220 5.086 30 20 EKED N#Cc1ccc(CNc2ccccc2SCc2ccccc2)c(F)c1 896823441 TYPLDWBIHMJVRH-UHFFFAOYSA-N 348.446 5.602 30 20 EKED CC[C@H](c1ccc(F)cc1F)[S@@](=O)CCCCC1(C#N)CCC1 899392018 ODFOEOWQRZPKJK-HXOBKFHXSA-N 339.451 5.029 30 20 EKED CCOc1ccc(/C=C\C(=O)c2ccc3ccccc3c2)cc1OC 33414437 OCJULMIJMQUBCL-WQLSENKSSA-N 332.399 5.143 30 20 EKED CC(C)CCc1nc(CN(Cc2ccc(C#N)cc2)C(C)C)cs1 58396936 UPAFYIISLBQPAV-UHFFFAOYSA-N 341.524 5.014 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 106141844 RCLRRAUWDVRJRS-QGZVFWFLSA-N 342.483 5.284 30 20 EKED C(=C\c1ccccc1)\C=N\CCCCCC/N=C/C=C/c1ccccc1 138227035 ATPFMBHTMKBVLS-NWWNNFLXSA-N 344.502 6.115 30 20 EKED CC(F)(F)c1cccc(NCc2cccc(OCCCC#N)c2)c1 189546572 XDKNVZQIIRKLCS-UHFFFAOYSA-N 330.378 5.093 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cnn(C(C)(C)C)c1C)c1ccc(F)c(F)c1 191507825 DSSNSNVHCFJYCL-YJYMSZOUSA-N 347.453 5.193 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O)c(Cl)c1 192315720 CIRCDQVFPWCOHH-UHFFFAOYSA-N 344.842 5.542 30 20 EKED C[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1cccc(C#N)c1 193002045 RJLUMNRTQPDUKP-SJKOYZFVSA-N 328.868 5.099 30 20 EKED CCCc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432694605 WOZGCYAEOIGJPK-HXUWFJFHSA-N 335.451 5.196 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 472249657 DMEBAKKBAYNTNJ-KRWDZBQOSA-N 338.417 5.562 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)ccc1OC 476121156 MSSPFJLQEYVZLV-UHFFFAOYSA-N 337.463 5.037 30 20 EKED CC(C)(C#N)CCCSCCOc1ccc(C(F)(F)F)cc1 480397642 XMTGAQUGQGKHIN-UHFFFAOYSA-N 331.403 5.147 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c(OC(F)F)c1 485494289 QMFIAZRJXAUUHJ-UHFFFAOYSA-N 349.402 5.127 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccccc1 487182700 CHWKGBCBPBRBQP-PMXSJFBMSA-N 338.495 5.144 30 20 EKED CC(C)(C#N)CCCNc1cccc(OCc2ccc(F)cc2)c1 532296706 XTZWZHRJAUGRAT-UHFFFAOYSA-N 326.415 5.147 30 20 EKED C[C@H](CCc1ccc(F)cc1F)N[C@@H](CCCC#N)c1ccccc1 551211859 YKLQENXZIFPINS-IERDGZPVSA-N 342.433 5.311 30 20 EKED Cc1nc(-c2cccc(N[C@H]3CCCc4cc(C#N)ccc43)c2)oc1C 611475771 LAHSWORLTYGWCX-NRFANRHFSA-N 343.430 5.320 30 20 EKED C=C(C)COc1cccc(NCc2csc(-c3ccsc3)n2)c1 676322922 ZTNXUJRXZXRVGU-UHFFFAOYSA-N 342.489 5.439 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2cccc(C#N)c2)o1 734304697 SRZITGWZGJIXNE-TWGQIWQCSA-N 331.346 5.162 30 20 EKED Cc1cc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc(C)c1F 741466848 GFOPNENTAKHFMM-CMDGGOBGSA-N 337.394 5.021 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc(C(F)(F)F)cc1 760261691 GSBZZBFZAZMDRF-CMDGGOBGSA-N 337.366 5.326 30 20 EKED CCC(C)(C)c1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1 776171598 UJZXJZPDMXSNGA-QGZVFWFLSA-N 336.479 5.127 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C1 780311320 AOPLIFCSCZHACZ-ABFRBSLYSA-N 338.476 5.059 30 20 EKED O=C(/C=C\c1cc(-n2ccnc2)cs1)c1cccc(Cl)c1Cl 783705959 DRCUSBHGFVMIIJ-PLNGDYQASA-N 349.242 5.137 30 20 EKED C[C@H](Oc1ccc(NC(=O)OC(C)(C)C)cc1)c1cccc(C#N)c1 794721676 VQLZMMFZPJHWOU-AWEZNQCLSA-N 338.407 5.045 30 20 EKED Cc1ccc(-c2ccc(/C=C/C(=O)c3ccc(OCC#N)cc3)o2)cc1 915985177 QQXXGAOCGQYCKO-ZRDIBKRKSA-N 343.382 5.054 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(Cl)cccc1CC 1776783343 SANGHRIIZSRIHJ-INIZCTEOSA-N 339.907 5.196 30 20 EKED CCCCCCCOc1cccc(CNc2cccc(C(=O)O)c2)c1 1776787599 MOTQLQVRNQEAMO-UHFFFAOYSA-N 341.451 5.346 30 20 EKED N#Cc1cccc(CN[C@H](CCc2ccccc2)c2ccccc2)c1 237847538 LFXOAVVTIJEDQX-HSZRJFAPSA-N 326.443 5.022 30 20 EKED N#CCCC[C@@H](NCc1c(Cl)oc2ccccc12)c1ccccc1 353918379 YAJHJCZXYIGJSU-GOSISDBHSA-N 338.838 5.611 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c(Cl)c1 439454621 NWLLLMJCGUBHSS-GOSISDBHSA-N 331.246 5.106 30 20 EKED COc1ccc(Cl)cc1CNc1ccccc1SC[C@@H](C)C#N 466387847 VQFFQXMNGVQLRQ-ZDUSSCGKSA-N 346.883 5.212 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(C(F)F)cc1 481993167 SQXYHDGWDGKWDX-IBGZPJMESA-N 326.390 5.053 30 20 EKED N#CCCCCNCc1ccc(-c2ccc(Cl)c(Cl)c2)s1 504163273 RGOUWQIAHJMOND-UHFFFAOYSA-N 339.291 5.505 30 20 EKED CC[C@H](Nc1cc(Cc2ccccn2)ccc1C)c1ccc(C#N)cc1 511031769 NHBBUUWXAQYOQH-QFIPXVFZSA-N 341.458 5.416 30 20 EKED Cc1oc(-c2cccs2)nc1CS[C@@H](C)c1ccc(C#N)cc1 522840432 KLFPQSAMJPENDC-ZDUSSCGKSA-N 340.473 5.578 30 20 EKED C=CCCC[C@H](C)NC(=O)N(Cc1cccs1)Cc1cccs1 540490955 JKLROIOSQGDXRK-HNNXBMFYSA-N 348.537 5.266 30 20 EKED C=CCN(Cc1c(C(=O)O)sc2ccccc12)CC1CCCCC1 574762942 BGJKQZFLPGSXNT-UHFFFAOYSA-N 343.492 5.168 30 20 EKED C=C(C)CCNc1ccc(Oc2nncc3ccccc23)c(Cl)c1 580978162 POONYOSHQMCTII-UHFFFAOYSA-N 339.826 5.454 30 20 EKED Cc1cccc2sc(C(=O)Nc3sccc3C#N)c(Cl)c12 602099651 YNIDZZGKXVGUNB-UHFFFAOYSA-N 332.837 5.049 30 20 EKED O=C(/C=C\c1ccc(Br)cc1Cl)c1ccsc1 742435013 QPRSHIZDMDNBMS-RQOWECAXSA-N 327.630 5.060 30 20 EKED CCCc1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1 743056753 LASVHOTYNWMHDZ-MDWZMJQESA-N 344.414 5.118 30 20 EKED C[C@@H](CC(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 773984062 QDCPVNJQXGZUBD-JQWIXIFHSA-N 334.872 5.198 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792094769 GQIFIDOISAKPGO-IIBYNOLFSA-N 342.442 5.167 30 20 EKED CC(=NNc1cccc2cnccc12)c1nc(-c2ccccc2)cs1 814836628 WKPTYYYJVLDMRN-UHFFFAOYSA-N 344.443 5.194 30 20 EKED Cc1cc(Cl)ccc1CNc1ccc(Oc2ccnc(C#N)c2)cc1 864027886 HVORVMUSFGGFPF-UHFFFAOYSA-N 349.821 5.320 30 20 EKED COc1cccc(/C=C/C(=O)c2cc(C)sc2C)c1OC(C)C 916155893 KUJFVKNODMRIBA-MDZDMXLPSA-N 330.449 5.057 30 20 EKED O=C(O)c1cccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c1 1776126343 JNPUWRUUSPHCQN-NTEUORMPSA-N 344.366 5.073 30 20 EKED CCc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 66037213 OFEUBNAFMLCQEO-UHFFFAOYSA-N 348.427 5.227 30 20 EKED CCc1cccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 217184579 JBSKDRGDYQXHTE-AWEZNQCLSA-N 339.464 5.145 30 20 EKED C[C@@H](Nc1cccc(Cl)c1Br)c1cccc(C#N)c1 235267719 FQHWTBCKFISKAH-SNVBAGLBSA-N 335.632 5.147 30 20 EKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1C(C)(C)C 425617109 BCDFPTBACPDNKI-HNNXBMFYSA-N 335.451 5.081 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cc(C#N)cs1)C1CC1 437549104 RQKIZRMVVFFPFT-CQSZACIVSA-N 346.455 5.139 30 20 EKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cc2ccccc2s1 475758523 XLKMZHCXXHUMNX-WBVHZDCISA-N 348.471 5.166 30 20 EKED N#CCCCCSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 501821607 BFKBQGMLJJAROU-UHFFFAOYSA-N 345.518 5.653 30 20 EKED CN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccccc1C#N 508079700 JTFXTZJILAXKBT-UHFFFAOYSA-N 346.817 5.155 30 20 EKED N#Cc1ccc(OCc2cc(-c3ccc(Cl)cc3)no2)c(Cl)c1 514912563 VESZWVQAMWTSGF-UHFFFAOYSA-N 345.185 5.099 30 20 EKED C=CC[C@H](C)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 522646472 RRAMHPCQYDLRHB-QMMMGPOBSA-N 347.789 5.268 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F)c1ccccc1 533937482 ZSWVZLCTHZCLIX-LZJOCLMNSA-N 337.438 5.095 30 20 EKED CC(C)[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 538225917 KKSGJOPPIRREFD-HXUWFJFHSA-N 342.433 5.253 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C)c1cccc(C#N)c1 540595076 UBRHSKWNDJKAIC-UTKZUKDTSA-N 346.499 5.563 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCCC(C)(C)C#N)s2)cc1 542591375 ZSPAYACJVWHPIG-CQSZACIVSA-N 327.497 5.017 30 20 EKED CCCC[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(OC)cc1 565532663 LNWUCESFSWPRKG-YADHBBJMSA-N 334.463 5.075 30 20 EKED N#CCCCCC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCc2ccccc21 593998906 RSFAEEUVIWSSRI-GGAORHGYSA-N 346.474 5.048 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2cc(Cl)ccc2o1 618807385 UGXWZDBXPXOLRO-XIKOKIGWSA-N 336.822 5.296 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)c(Cl)c1 618807785 WQZBKRICOVGLPJ-ADLMAVQZSA-N 331.246 5.203 30 20 EKED CCCCC[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1 728134976 SAIIPKCGKKKGRW-OAQYLSRUSA-N 349.478 5.021 30 20 EKED CC(C)c1ccc(NC(=S)N(Cc2ccc(C#N)cc2)C2CC2)cc1 745652865 HYKQBDBIKFXORW-UHFFFAOYSA-N 349.503 5.043 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1csc(Cl)c1Cl 761828117 LDKYGTZDHMWBHW-UHFFFAOYSA-N 340.153 5.487 30 20 EKED C=CC[C@@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccncc1 766017783 DDLANPHBNWMRSH-CRAIPNDOSA-N 335.476 5.173 30 20 EKED O=C1/C(=C\c2cscc2Cl)CCc2ncc(C(F)(F)F)cc21 777468780 ZREVQMLPKGDTCB-BAQGIRSFSA-N 343.757 5.028 30 20 EKED CC(C)(C#N)CCCOC(=O)CCCSc1ccc(Cl)cc1 779751588 KHPMUHRNQAKXQC-UHFFFAOYSA-N 339.888 5.085 30 20 EKED C#CCCCCCC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 779868303 MTYFNNYRUIUIEH-LJQANCHMSA-N 345.895 5.191 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(cc1O)CCCC2 815636350 TTZMKNSKYMVHDD-JTSKRJEESA-N 348.490 5.357 30 20 EKED C#CCCOc1ccc(C(=O)Nc2c(CC=C)cccc2C(C)C)cc1 830896287 CVIYTVXDJGUCDY-UHFFFAOYSA-N 347.458 5.193 30 20 EKED C=CCCC(C)(C)NC(=O)c1ccc(C2SCCCS2)cc1 856374494 BNIDGRQSPKYDRP-UHFFFAOYSA-N 335.538 5.030 30 20 EKED CC(CCCCCCC(=O)O)=NNc1ccnc2cc(Cl)ccc12 1776011864 VJJXXROTVLEIMZ-UHFFFAOYSA-N 347.846 5.101 30 20 EKED Cc1cc(C)c(/C=C\C=NNc2ccc(Cl)c(C(=O)O)c2)c(C)c1 1776034401 FEJNTYIDVVCZDP-XCZIAOCSSA-N 342.826 5.075 30 20 EKED CC(C)c1cccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)c1 1776375994 QAEMFLGATHCCGC-LDADJPATSA-N 334.415 5.111 30 20 EKED Cc1ccccc1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777465255 CWPLLYCPNVFOQH-LUAWRHEFSA-N 348.423 5.318 30 20 EKED CCOc1cc(/C=C/C(=O)c2ccc(C)s2)cc(Cl)c1OC 32531712 AWPMEIPCOURCEH-VOTSOKGWSA-N 336.840 5.013 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCO[C@H](CCC)C1 189879618 PZZVRCZRIYOJSI-ZWKOTPCHSA-N 329.484 5.072 30 20 EKED Cc1cccc([C@H](Nc2cc(Cl)ccc2C#N)c2ccccn2)c1 301869847 HCQWOJGYMUOUEG-FQEVSTJZSA-N 333.822 5.117 30 20 EKED CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303917000 YAAIKZAOSSATAK-SFTDATJTSA-N 346.474 5.353 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccc(-c2cccc(C#N)c2)cc1 363718466 LCEFELDCVLMGNS-HNNXBMFYSA-N 343.455 5.009 30 20 EKED C=CCCCC(=O)Nc1csnc1-c1cccc(C(F)(F)F)c1 425605624 HCMAGWZNXJOZGO-UHFFFAOYSA-N 340.370 5.124 30 20 EKED N#Cc1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)c(Cl)c1 430366086 HBIDJMZYKPDJDO-QZTJIDSGSA-N 346.817 5.107 30 20 EKED C=CCC(C)(C)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 431753994 WTKBOVHPCZSICE-IBGZPJMESA-N 346.474 5.018 30 20 EKED CC[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 447573959 JYBXYYRSXWLAAT-XZOQPEGZSA-N 344.433 5.528 30 20 EKED N#CCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 464524677 KVTWLLLRVZGZBX-UHFFFAOYSA-N 333.218 5.293 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1cccnc1)c1cc(C)ccc1Cl 466607104 CNLRXTAZEPHOLV-INIZCTEOSA-N 342.870 5.179 30 20 EKED N#Cc1cccc(CN[C@@H]2CCCc3c(Cl)sc(Cl)c32)c1 480795465 MQYSSSXTWIWIAS-CYBMUJFWSA-N 337.275 5.094 30 20 EKED Cc1cc(CNCc2cccc(C#N)c2)ccc1Oc1ccc(F)cc1 500887792 LUMPVPCWOZXDAA-UHFFFAOYSA-N 346.405 5.088 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2c(F)cccc2c1 506045326 CADMFDGZZFZQLI-UHFFFAOYSA-N 348.421 5.478 30 20 EKED C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1F 512619965 NUPSOSCTYLFWGP-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1F 512620985 UMJVSDMFAZXYBW-DJJJIMSYSA-N 328.406 5.274 30 20 EKED CCC[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 518150526 DFPWBCCKBFVTSG-LLVKDONJSA-N 344.402 5.086 30 20 EKED COc1cc([C@H](C)Nc2ccc(C#N)cc2)ccc1OC1CCCC1 603861165 QCOFOMXLFSWEKD-HNNXBMFYSA-N 336.435 5.061 30 20 EKED C=CCOc1ccc(CN[C@H](Cc2ccccc2)c2cccs2)cc1 604892263 NZZRDKXQXFXLRI-OAQYLSRUSA-N 349.499 5.387 30 20 EKED CC[C@H]1CCCCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610051654 QMTUHWKOTVOQOR-IBGZPJMESA-N 348.446 5.145 30 20 EKED CCc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1 740014487 QEJFIHDBJRHCSL-UHFFFAOYSA-N 332.472 5.139 30 20 EKED COCc1cccc(/C=C/C(=O)c2cc(Cl)sc2Cl)c1 742432543 XRJNUOIVLTYBPG-AATRIKPKSA-N 327.232 5.097 30 20 EKED Cc1ncsc1/C=C1\CC(C)(C)C/C(=C\c2scnc2C)C1=O 742434107 DVNCXKCFHRKKOK-ACFHMISVSA-N 344.505 5.073 30 20 EKED CCCCCCC[S@](=O)Cc1coc(-c2ccc(Cl)cc2)n1 764454172 UBNYHHPYFGUGQE-QFIPXVFZSA-N 339.888 5.214 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cccc(F)c3F)s2)cc1 776269002 ZAZLKODWOIBBTJ-MDZDMXLPSA-N 341.382 5.293 30 20 EKED CCc1oc2ccccc2c1C=NOCc1cccc2cccnc12 809863096 INPDLALAVIHUSM-UHFFFAOYSA-N 330.387 5.094 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc2ccccc2c1)c1ccccc1 814479724 GCYUOIROWKXPOR-OAQYLSRUSA-N 343.430 5.396 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(C(F)F)cc1)c1ccccc1 933102171 XNXVJTDGYWNHGW-KRWDZBQOSA-N 343.377 5.181 30 20 EKED O=C(/C=C/c1ccc(C(=O)O)s1)c1ccc(-c2ccccc2)cc1 1776131312 OAPLPBKOJSODTQ-ZRDIBKRKSA-N 334.396 5.009 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(C2CCCC2)c1 1776783834 PDIBPFATGNHAND-NRFANRHFSA-N 345.527 5.638 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(C)[C@@H](C)CC#N 86285240 DYYNINSPGHPVIE-AWEZNQCLSA-N 341.842 5.081 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2ncsc2c1 189874492 XIQXPCQSTZBMRJ-UHFFFAOYSA-N 336.460 5.401 30 20 EKED C[C@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1ccc(C#N)cc1 296179285 CRYDBKHTBVEFRB-KGLIPLIRSA-N 332.369 5.075 30 20 EKED Cc1cccc2nc(C3CCN(CCCCC(C)(C)C#N)CC3)oc12 365597984 JQXQXGJGUBVDAP-UHFFFAOYSA-N 339.483 5.036 30 20 EKED CCO[C@H](C)c1nc(CSCCC2(C#N)CCCCC2)cs1 419410618 AUHCBFUMTMYUIK-CQSZACIVSA-N 338.542 5.338 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C1CCCCC1 438047784 DVUIBUFXUVADMS-LSDHHAIUSA-N 345.512 5.171 30 20 EKED C=CCC(CC=C)C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F 469198918 BLEPFRWLCQYPHG-OAHLLOKOSA-N 345.792 5.170 30 20 EKED C[C@H](S[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 471412243 PZZBWFWQJNWEOT-GJZGRUSLSA-N 334.444 5.769 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1ccc(F)c(F)c1 480679730 JNIPTYBNIBPCRJ-SGTLLEGYSA-N 348.462 5.268 30 20 EKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3F)c2)oc1C 512281707 SARLRZANOQZYFM-CYBMUJFWSA-N 335.382 5.142 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1oc2c(Cl)cccc2c1C 519157831 YQODVSNDLJZOKK-UHFFFAOYSA-N 346.858 5.187 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 533883803 COMGLYREVIOASQ-OXQOHEQNSA-N 339.866 5.363 30 20 EKED C=C[C@@H](CC(=O)N(C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 534642256 AEYWNPFVQZIEIJ-INIZCTEOSA-N 347.380 5.024 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccnc3ccccc23)cc1 537507166 OGUAMJVFSXJIFB-UHFFFAOYSA-N 349.437 5.063 30 20 EKED Cc1ccc(Cl)cc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 552703267 QJOJDPPGJZEDKQ-UHFFFAOYSA-N 332.856 5.131 30 20 EKED CC1(C)C[C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccc21 589508469 MALFZDHWFXIQJT-SFHVURJKSA-N 344.380 5.089 30 20 EKED Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(Cl)c1 591860156 OFACXGHJLKPVLD-AWEZNQCLSA-N 341.842 5.053 30 20 EKED N#Cc1ccccc1CN[C@@H](c1ccccc1)c1cccc(Cl)c1 604009609 SQBDRXRZQJVAIU-NRFANRHFSA-N 332.834 5.091 30 20 EKED C(=Nn1cnc2ccccc21)c1c(-c2ccccc2)[nH]c2ccccc12 725849781 SCSWJSUBJILWSI-UHFFFAOYSA-N 336.398 5.067 30 20 EKED C[C@@H](ON=Cc1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 727484908 XUMGWSWDPCCBRQ-SNVBAGLBSA-N 339.178 5.013 30 20 EKED O=C(/C=C/c1cnc2ccccn12)c1cc2c(ccc3ccccc32)o1 740765156 RAUJOLKZLCSKGN-MDZDMXLPSA-N 338.366 5.130 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(SC(F)F)cc1 740765543 FVBRDGMZLYSOIO-MDZDMXLPSA-N 341.382 5.446 30 20 EKED Cc1cc(C)c(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1C 743057911 VPWBJNLWXODWAG-TWGQIWQCSA-N 344.414 5.090 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccc2cc(OC)ccc2c1)c1ccncc1 766020504 PYCKXMYKHMWTTD-GOTSBHOMSA-N 346.474 5.602 30 20 EKED C[C@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(C#N)c(F)c1 780743591 GXKAVOHDYNKWOY-VIFPVBQESA-N 340.732 5.125 30 20 EKED O=C(/C=C\c1ccc(-n2cccn2)cc1)c1cc(Cl)ccc1Cl 884003449 SXTASEYXXQRVBE-WTKPLQERSA-N 343.213 5.075 30 20 EKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc(C)o1 916311630 FXFQAIXMTPFWSF-UHFFFAOYSA-N 348.431 5.096 30 20 EKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccccc1-c1ccccc1 1776077002 PRVGQXPBZLCSSK-UHFFFAOYSA-N 348.377 5.027 30 20 EKED CC(C)[C@@H]1/C(=C/c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776308778 MUXKDUNGYOWEPC-PSXSOWLISA-N 346.382 5.151 30 20 EKED COc1cc(C(=O)/C=C\c2ccccc2C)ccc1SC(F)F 214922088 VTONJKZEXSJXGP-CLFYSBASSA-N 334.387 5.214 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CSC)C1 297964766 YGXYERYKEXOYAB-INIZCTEOSA-N 346.540 5.145 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 303207053 ZHPPOEPUXYMOHR-HNNXBMFYSA-N 343.854 5.235 30 20 EKED Cc1ccc(F)cc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303394985 YUJYSZNFNSBZDG-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 390967958 NUAMXZBEBNSHGL-CYBMUJFWSA-N 349.261 5.849 30 20 EKED CCCCCCCCCCNc1nc(C(F)(F)F)ccc1C(=O)O 391671034 OZBXOOBFMUFHPW-UHFFFAOYSA-N 346.393 5.351 30 20 EKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430584432 OOLZZBMYLOUTOI-OAHLLOKOSA-N 326.465 5.054 30 20 EKED CC(C)CN(C(=O)c1cccc2ccsc12)c1ccc(C#N)cc1 464529477 QCXUBBDCOUCVPT-UHFFFAOYSA-N 334.444 5.076 30 20 EKED CCCCN(C(=O)NCc1cccc(C#N)c1)[C@@H](CC)c1ccccc1 523705228 DZTATCHFBOTQOM-NRFANRHFSA-N 349.478 5.021 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc2cc(OC)ccc2c1 532466517 VJNVLKMMVDXXJF-QMHKHESXSA-N 344.458 5.522 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 533883801 COMGLYREVIOASQ-OXJNMPFZSA-N 339.866 5.363 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(C)cc1Br)c1ccccc1 534704057 DSWRXIKIXFUFBB-AWEZNQCLSA-N 344.252 5.056 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCCC(C)(C)C#N)s2)cc1 542591368 ZSPAYACJVWHPIG-AWEZNQCLSA-N 327.497 5.017 30 20 EKED CCC[C@@H](C)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944689 TYRLJGPIWSWSEU-SJORKVTESA-N 349.478 5.116 30 20 EKED CCC[C@H](NC(=O)CCCCCC#N)c1ccc(Cl)c(Cl)c1 588154756 MXTREOHFMOBLCN-INIZCTEOSA-N 341.282 5.425 30 20 EKED COc1ccc(C(C)C)cc1CNc1cccc(OCCCC#N)c1 594548525 QSYBAWVRVVVAQC-UHFFFAOYSA-N 338.451 5.113 30 20 EKED CCc1ccc(N(C(=O)[C@@H](C)CC#N)c2nc3ccccc3s2)cc1 598801477 ZIIHUOSYESKSEW-AWEZNQCLSA-N 349.459 5.073 30 20 EKED Cc1cc(C(F)F)oc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 602296509 JTYSAPSCYCUEHA-UHFFFAOYSA-N 338.379 5.009 30 20 EKED C=CCCCN(C)C(=O)c1oc2ccccc2c1COc1ccccc1 605645424 SREZIVSDJUKXJD-UHFFFAOYSA-N 349.430 5.050 30 20 EKED CC(=NNc1nccnc1Cl)c1ccc(SC2CCCC2)cc1 733079039 RDUJYSCPSWZQGP-UHFFFAOYSA-N 346.887 5.001 30 20 EKED C#CC[C@@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccccc1 773118189 YRAQNGDXNJCXNS-WZONZLPQSA-N 326.443 5.164 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1O 806152069 ULWOBZUDAVUAOQ-GOSISDBHSA-N 344.842 5.291 30 20 EKED CCC/C(C)=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920323769 JQYLFUKRPBCVGU-SAAWKEMMSA-N 344.867 5.386 30 20 EKED Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776127033 FYINHAZYOKJFRH-LUAWRHEFSA-N 348.423 5.318 30 20 EKED Cc1cc(Cl)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 120335260 YTHQUNZIDLQJFS-LBPRGKRZSA-N 344.867 5.153 30 20 EKED CC(C)c1nc(CNc2ccccc2SC[C@@H](C)C#N)cs1 153872129 QPFDTVIBAJWVML-ZDUSSCGKSA-N 331.510 5.130 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)s1 176943784 MLWQNXKGPPCSLM-OAQYLSRUSA-N 344.439 5.245 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cccc(C(F)(F)F)c1 212899313 HPWBCDKJMLAPTC-CLFYSBASSA-N 327.305 5.150 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)C2CCCCC2)cc1 237603467 NGCQZNWVJLAWDY-WZONZLPQSA-N 348.490 5.389 30 20 EKED Cc1cccc([C@@H](Nc2ccc(C#N)c(Cl)c2)c2ccccn2)c1 301863914 FNKNTWAPNHMTBD-HXUWFJFHSA-N 333.822 5.117 30 20 EKED Cc1ccc(C)c2c1CCC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 340431019 BMGFKVVMCLCUJG-VXKWHMMOSA-N 332.491 5.706 30 20 EKED N#CCCC[C@H](N[C@H]1CCC[C@H](c2cccnc2)C1)c1ccccc1 340440733 CTGYCODLRZWUAS-BVSLBCMMSA-N 333.479 5.133 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1ccc(C#N)cc1Cl 439447646 FZIAAVCSLYSUJN-CYBMUJFWSA-N 347.915 5.293 30 20 EKED C[C@@H](SCc1ncc(-c2cccc(F)c2)o1)c1cccc(C#N)c1 443160908 QRCLDNZAHFYPJH-CYBMUJFWSA-N 338.407 5.347 30 20 EKED CC[C@H](C)[C@@H](C)N(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CC1 458806263 VXAIYXHKSKPVKS-SQGPQFPESA-N 341.499 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2ccccc2c1 476165352 SQLZKTWGNBGEJF-UHFFFAOYSA-N 329.443 5.944 30 20 EKED C[C@H](CCCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 480169703 XCCPZBSJPIOAOA-ZWNOBZJWSA-N 345.302 5.530 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 510810005 CHASSPCOHKHQKM-IIBYNOLFSA-N 336.435 5.013 30 20 EKED C[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)c(F)c1 538508164 ZOUIYZYKDUDWBL-GHMZBOCLSA-N 337.225 5.416 30 20 EKED Cc1cccc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c1C 566592935 OWIFECPFZLGFTK-CQSZACIVSA-N 332.369 5.045 30 20 EKED N#CC[C@@H](Cc1nc(-c2ccc3ccccc3c2)no1)c1ccccc1 582149024 RUTDEIYBUYWTOS-IBGZPJMESA-N 339.398 5.130 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(C2CC2)cc1)c1ccccc1 590824814 HHDAFNQVDKJMNW-HXUWFJFHSA-N 333.435 5.121 30 20 EKED Cc1oc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 604458563 FMYUVAFDWSGLAE-UHFFFAOYSA-N 346.386 5.121 30 20 EKED C=CCCCSCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 609805211 VYMCYAJAYKQRSW-UHFFFAOYSA-N 338.687 5.285 30 20 EKED Fc1cc(F)cc(CNC(CCC(F)(F)F)CCC(F)(F)F)c1 657707161 SMLHRUJGYHDZJG-UHFFFAOYSA-N 349.265 5.108 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1nccc2ccccc12 682993880 CFYGHEAPWPMFIS-HNNXBMFYSA-N 344.395 5.046 30 20 EKED Cc1ncccc1/C=C/C(=O)c1ccc2ccccc2c1OC(F)F 728786189 UIEZRLFAINHVSC-PKNBQFBNSA-N 339.341 5.041 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 729891667 LULPBCOHTLRRCF-WCQYABFASA-N 334.872 5.198 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1cccc(C(C)C)c1 732625740 SNWXOLIMAUEYHO-UHFFFAOYSA-N 330.541 5.575 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1ccc(SC(F)F)cc1 734979341 CDUUISHDAVKBDK-BJMVGYQFSA-N 344.382 5.216 30 20 EKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 744115391 JRTYRDHIWBRRAE-JSGCOSHPSA-N 332.444 5.218 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccc(-c2ccncc2)cc1 745198970 XCVLBSKUPRGXDE-UHFFFAOYSA-N 338.414 5.133 30 20 EKED C#CCCCCCC(=O)N1CCC(c2cccc3ccccc23)CC1 779880969 ADMTZZLDRQVZDP-UHFFFAOYSA-N 333.475 5.130 30 20 EKED O=C(/C=C/c1cc(Cl)cs1)c1cccc(-c2ccncc2)c1 782342117 ODSSXJYTBKEJHO-SNAWJCMRSA-N 325.820 5.360 30 20 EKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100193 KRHVSZJSIIITSC-XYDKVEKUSA-N 346.817 5.168 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)c1cc(Cl)ccc1Cl 915918031 ZEBOQXZLBLUVGJ-UHFFFAOYSA-N 348.155 5.243 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccccc3)n2)cc1 916627170 COEPJLHDKSZZAX-ZVBPTUHVSA-N 344.439 5.008 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2cc3ccccc3s2)cc1 237498533 QNTWIGMTHYACLT-GJZGRUSLSA-N 336.460 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCc2occc2C1 288867779 PSQNYFGQXHUMAG-UHFFFAOYSA-N 338.451 5.112 30 20 EKED CC1(C)CC(/C(O)=N/C2CCC(/N=C(/O)C3CC(C)(C)C3)CC2)C1 329110863 QODRFZSNLRHXIE-UHFFFAOYSA-N 334.504 5.083 30 20 EKED CCc1nc(C(C)C)ccc1CN[C@@H](CCCC#N)c1ccccc1 339236484 PSLSXVHXTLIXDT-QFIPXVFZSA-N 335.495 5.292 30 20 EKED Cc1c(C#N)cccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 432282740 CHYPKBUGWDAOEK-HXUWFJFHSA-N 333.435 5.016 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1F 435883908 NBVPRTYTOCLQGO-LBPRGKRZSA-N 334.847 5.485 30 20 EKED Cc1nc(C(F)(F)F)c(CS[C@@H](C)c2cccc(C#N)c2)s1 443143080 ISGMDWAZNUSEIA-VIFPVBQESA-N 342.411 5.336 30 20 EKED Cc1nc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c(Cl)cc1C#N 461966745 QRPXHRSBWBHRHV-CYBMUJFWSA-N 348.837 5.150 30 20 EKED C=CCC1(C(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)CCC1 479651989 MZLIEQKHABFIHX-OAHLLOKOSA-N 340.492 5.042 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)cccc1Cl 489774770 GNNFYLCBXUGDKA-UHFFFAOYSA-N 341.882 5.682 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1ccccc1)C(C)(C)C 503386417 UFXKMGLLJJHOGA-SFHVURJKSA-N 342.508 5.233 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 505011248 SEXJDMFJHRMLTG-INIZCTEOSA-N 348.446 5.776 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1ccccc1 540147082 OVBZMCOARVDDJR-DOTOQJQBSA-N 326.509 5.380 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC(C)=C(c2ccco2)C1 558812272 FVMKHBFGGWRJTE-UHFFFAOYSA-N 336.435 5.110 30 20 EKED CC(C)(CC#N)CSc1nnc(-c2ccco2)n1C1CCCCC1 565430561 DJWVQXWMUQPXJB-UHFFFAOYSA-N 344.484 5.075 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(F)c2ccccc12 590254390 UDAHHENHLQSRQJ-FPTDNZKUSA-N 330.406 5.189 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc2ccccc2c1 609387123 NVOVHJFVCDMXQA-IAGOWNOFSA-N 346.499 6.265 30 20 EKED CCCCN(CCCC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609435185 WQYNTPAFQGIFLY-INIZCTEOSA-N 347.528 5.515 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1cc(Cl)sc1Cl 726743355 DZDYKQKJSBCGGQ-WAYWQWQTSA-N 337.227 5.270 30 20 EKED CCc1ccc(/C=C/C(=O)c2sccc2Br)s1 731157369 WDKGVBGSKPHOBZ-AATRIKPKSA-N 327.268 5.031 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2cnn(C(C)C)c2)o1 734303940 BJZAQVJJNFSXBX-VQHVLOKHSA-N 338.382 5.068 30 20 EKED CC(C)C[C@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 747194121 TWCCNOKVVPCCLQ-IRXDYDNUSA-N 340.492 5.273 30 20 EKED CCCCCCCCCC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 754564955 HJBJQVLKPZXBPZ-VQTJNVASSA-N 349.490 5.303 30 20 EKED CCn1cc(C=NOc2ccccc2C(F)(F)F)c2ccccc21 754710147 RGBVBAPGFWUSIY-UHFFFAOYSA-N 332.325 5.093 30 20 EKED C[C@H](N[C@@H](C)c1ccc(N2CCCCCC2)cc1)c1ccc(C#N)cc1 765332477 PSCQTJSMGMYAOK-OALUTQOASA-N 347.506 5.350 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780147416 GYVUPBGFOAWLPO-WMZOPIPTSA-N 342.483 5.159 30 20 EKED N#Cc1ccccc1NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 841284143 DVYCTDULRDDAGE-BENRWUELSA-N 348.402 5.078 30 20 EKED CCC/C(C)=C\C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 920222848 UMYAHTQYHQEOLA-VKAVYKQESA-N 348.446 5.017 30 20 EKED CC(=NO[C@H](C)c1ccccc1)c1sc2ccccc2c1C(=O)O 1776083032 INGZSIWLTZALOI-CYBMUJFWSA-N 339.416 5.101 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc([C@@H](C)C(=O)O)cc1 1776786191 WJUJAOUBUUHHIJ-JKSUJKDBSA-N 333.472 5.200 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1CC(C)C 1776786942 CBGXGMOJUMKPJF-FQEVSTJZSA-N 333.516 5.179 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CC1CCCCC1 66954311 AWGFXVMHNZFMRC-HNNXBMFYSA-N 345.512 5.125 30 20 EKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1ccccn1 159748497 WNGVBZRWMKQGNW-SFHVURJKSA-N 348.789 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccc(C)cc1 189902941 XGUFSHSIMJRWOK-UHFFFAOYSA-N 339.504 5.578 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N[C@H]2CC[C@@H](CC#N)C2)cc1 296278921 DXXPAFPHOLYJFY-ZWOKBUDYSA-N 334.463 5.095 30 20 EKED N#CCCC[C@@H](NCc1nc(-c2ccccc2)cs1)c1ccccc1 353914039 KKBLQDBDVWYZAA-LJQANCHMSA-N 347.487 5.335 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)CC1CCCCCC1 426281832 OXCUWRUNFIRSKZ-OAHLLOKOSA-N 330.497 5.237 30 20 EKED Cc1cc2cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)oc2cc1C 483219774 VDMMBPWLXBTFGQ-SFHVURJKSA-N 340.382 5.088 30 20 EKED C=CCCC1(C(=O)Nc2ccccc2COCc2ccccc2)CC1 483318990 DUTKGZNGGYFZSM-UHFFFAOYSA-N 335.447 5.088 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(C#N)s1)C1CC1 486658899 QBEDZSSTDNWLSP-CQSZACIVSA-N 346.455 5.139 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 540151217 PADFESCRGZTEPZ-IUODEOHRSA-N 340.414 5.520 30 20 EKED C=CCC(F)(F)c1nc(-c2ccc(C)cc2OC2CCCC2)no1 551016540 OEYGAMJHAYDNCM-UHFFFAOYSA-N 334.366 5.034 30 20 EKED COc1ccc([C@H]2C[C@@H]2[C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559860435 UNYQNVWYZZCWCZ-VAFVZNMKSA-N 348.490 5.212 30 20 EKED CC(C)(C#N)CCSCc1cccc(C(=O)Nc2ccccc2)c1 565622306 VAPQWFUELTYVJP-UHFFFAOYSA-N 338.476 5.112 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 576256924 FTXYZEWDXJZNIX-QGZVFWFLSA-N 336.435 5.033 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](CCC)c1cccc(C(F)(F)F)c1 605965454 BRUZSYSOBIDYKE-INIZCTEOSA-N 342.405 5.154 30 20 EKED Cc1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609496042 KHAORWJOFJLJRX-UHFFFAOYSA-N 342.398 5.106 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc(Cl)s1 751511906 DKCDPHCQVBFQRB-ARJAWSKDSA-N 337.878 5.483 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 755191694 LLEVCKYHVFSHEB-UHFFFAOYSA-N 348.352 5.064 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 766018393 HHSFNUWJRQNWEA-JPYJTQIMSA-N 328.459 5.717 30 20 EKED CCc1ccc([C@H](CC)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772984566 OLBADFLFNOVZAC-UNMCSNQZSA-N 336.479 5.171 30 20 EKED N#CC[C@H](CC(=O)O[C@H]1CCc2sc(Cl)cc21)c1ccccc1 796768409 BUDQMKSTDTVHKB-HIFRSBDPSA-N 345.851 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(C(F)(F)F)c1 808764819 AXLUOIKQUIDLNP-UHFFFAOYSA-N 348.368 5.205 30 20 EKED CCCCCCCOc1ccc([C@H](C)N[C@@H]2CCn3ccnc32)cc1 834836089 LIKVAXFZEWKLBG-FXAWDEMLSA-N 341.499 5.028 30 20 EKED O=C(/C=C\c1ccccc1Cl)c1sccc1Br 915112532 CHMNYPUFFSJKDI-WAYWQWQTSA-N 327.630 5.060 30 20 EKED CC(C)(C)CC(=NNc1ccccc1C(=O)O)c1ccc(Cl)cc1 1776030214 SZJLTJOSLUXWGE-UHFFFAOYSA-N 344.842 5.291 30 20 EKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2ccc(C(=O)O)s2)c1 1777461812 WVKYCFJZTLUQGS-KTKRTIGZSA-N 348.423 5.318 30 20 EKED O=C(/C=C/c1ccc(N2CCCCC2)cc1)c1ccc(Cl)s1 6339856 PDLHGIPBRCIUMH-RMKNXTFCSA-N 331.868 5.288 30 20 EKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C#N)cc1 182102772 CXBZPBLJBSQTNI-SJCJKPOMSA-N 336.332 5.042 30 20 EKED O=C1/C(=C\c2cccnc2Cl)CCC/C1=C\c1cccnc1Cl 255658391 MBFQUDXGLKJACY-PJABCKPXSA-N 345.229 5.003 30 20 EKED CC[C@H](CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)c1ccc(C)cc1 303865192 PPEPBJWQARSEGQ-AZUAARDMSA-N 348.490 5.360 30 20 EKED Cc1ccc([C@H](NCc2cccc(C#N)c2)c2ccccc2)c(C)c1 327358952 HKLLWCRAOBZSQD-HSZRJFAPSA-N 326.443 5.054 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CC[C@H]4CCCC[C@H]4C3)c(F)cc2CC1 328765259 GTILGACWCNXNSO-VNHYZAJKSA-N 344.430 5.554 30 20 EKED OC1=Nc2cc(Cl)cc(N=C(O)[C@@H]3C[C@@H]3C3CCCCC3)c2OC1 329205143 DHQCAEGWOAOUMX-CHWSQXEVSA-N 348.830 5.125 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2n1 340457883 WMMKOCJRSUFGGO-LAUBAEHRSA-N 329.447 5.321 30 20 EKED CC(C)Cn1c(SCCCCC(C)(C)C#N)nnc1-c1ccco1 436134315 DHBXCTTWYRXBET-UHFFFAOYSA-N 346.500 5.006 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NC2CCC(C)(C#N)CC2)cc1 449175406 QUSFCISDAJRPKI-JVPSVYLMSA-N 348.490 5.485 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C2CC2)[C@@H]1C1CC1 455242711 HPHQDOKOCKDIGY-CTNGQTDRSA-N 338.495 5.191 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1CN(C)C1CCCCC1 467733614 XOTIPACAPJBRNB-UHFFFAOYSA-N 340.511 5.158 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCSCC(C)C 475581142 IDZVUDWGYBFCCY-UHFFFAOYSA-N 334.529 5.049 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cc2ccccc2o1 476118884 OFLFQOGQHZKRES-UHFFFAOYSA-N 347.458 5.856 30 20 EKED CC(C)(C#N)CCCSCCOc1ccc(OC(F)(F)F)cc1 480411289 FRGPWJAIJJDVGT-UHFFFAOYSA-N 347.402 5.027 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccc(F)cc1)C1CCC1 487366878 RCRBXJBJSKZWJE-NRFANRHFSA-N 336.454 5.258 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 490642216 UPLDMFSNMKMABZ-UHFFFAOYSA-N 328.799 5.011 30 20 EKED CC(C)N(Cc1cccc(C(F)(F)F)c1)CC(C)(C)CCC#N 508540848 HCPACZGQQYMZKF-UHFFFAOYSA-N 326.406 5.246 30 20 EKED CC[C@](C)(C#N)C(=O)N[C@H](C)c1ccccc1-c1ccc(Cl)cc1 513295145 FBGOEAZDOAMSJI-JLTOFOAXSA-N 340.854 5.124 30 20 EKED CCSc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 540728657 KGGFPQCJESXKEX-INIZCTEOSA-N 340.492 5.654 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 550826196 BMASHXZRWDNELB-JPYJTQIMSA-N 328.459 5.926 30 20 EKED N#CC1(CCCSc2ccc(-c3ccccc3)cc2)CCOCC1 553972758 BJWBAHNPVPQQJB-UHFFFAOYSA-N 337.488 5.546 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 559862962 FWOHLLWTQDPULN-RXVVDRJESA-N 344.458 6.032 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 611390437 AKZOPOGJXPBBTH-KKSFZXQISA-N 334.463 5.074 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(OC(C)(C)C)cc1 618805635 OTVAYBAMZSYQQD-VFNWGFHPSA-N 334.463 5.074 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2=CCCCC2)cc1 730170474 FRLJJXPFTXVBEJ-OAQYLSRUSA-N 330.431 5.171 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1F 734981684 RXINFMAFNGWXBS-WAPJZHGLSA-N 338.350 5.045 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cc(Cl)ccc1O)c1ccc(F)c(F)c1 775557782 KLMFEQZBHKEKPW-ADLMAVQZSA-N 337.797 5.292 30 20 EKED CSc1ccc(C)c(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1 776196980 BKIDUDSORJTTGE-UHFFFAOYSA-N 347.896 5.051 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1O 806142805 QXPPZHSWPJTRNA-GTNSWQLSSA-N 349.261 5.373 30 20 EKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1F 916135840 WOEGTHQTFBKQHY-LUAWRHEFSA-N 349.386 5.592 30 20 EKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2cccc3ccccc23)CC1 1776167959 JTLPVWQXCPTRGV-KRWDZBQOSA-N 337.463 5.034 30 20 EKED C[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 122157430 HDDUKHIZNZHOFK-SJCJKPOMSA-N 328.868 5.099 30 20 EKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 193728840 FOQNFIZPBDRSIX-FQEVSTJZSA-N 347.462 5.165 30 20 EKED CC(C)(C#N)CCCCSc1nnc(CCCc2ccccc2)o1 277792152 VMQDNSCAWFGHPX-UHFFFAOYSA-N 343.496 5.057 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc(F)c2ccccc2c1)c1ccccc1 352224626 BGDGLLHTUZBRBS-OAQYLSRUSA-N 346.405 5.144 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](CC(F)F)c1ccccc1 421115478 HLBCVDRIUYYIOQ-GOSISDBHSA-N 344.405 5.323 30 20 EKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)c2ccccc2n1 433021071 PSPTZXMMTNNFEX-OAQYLSRUSA-N 329.447 5.068 30 20 EKED CC(C)(C#N)CCCCSCc1csc(-c2ccsc2)n1 435883642 ACTPLTVZGISGPK-UHFFFAOYSA-N 336.551 5.825 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(C#N)cs1 437690256 VRRANWCEFQVDQL-HNNXBMFYSA-N 346.455 5.120 30 20 EKED N#Cc1ccc(N[C@H]2CCCc3cn(C4CCCC4)nc32)cc1Cl 445593688 RKZFWLKWLIAYJX-SFHVURJKSA-N 340.858 5.013 30 20 EKED CC(C)(C)C[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458804762 SWTJCSVYVZYIEO-RTBURBONSA-N 341.499 5.032 30 20 EKED Cc1nc(CN(CCC#N)CCC(C)C)oc1-c1ccc(Cl)cc1 468273908 FARKJANAHKKJLW-UHFFFAOYSA-N 345.874 5.065 30 20 EKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccccc1C(C)(C)C#N 487369166 SWFRYVAQEGGJQV-OAHLLOKOSA-N 349.503 5.290 30 20 EKED C[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 509736207 QUPRMHAOPGJARE-CVEARBPZSA-N 349.434 5.003 30 20 EKED N#Cc1ccc(F)c(CN[C@@H](CCc2ccccc2)c2ccccc2)c1 537077163 GGKXKEMMCSPGSF-QHCPKHFHSA-N 344.433 5.161 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1cc2c(ccc3ccccc32)o1 540597807 ZQUQXRPNMMFWDJ-OAHLLOKOSA-N 326.399 5.308 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N1Cc2cccc(C#N)c2C1 593187682 QLVWLWZXEVZPQU-UHFFFAOYSA-N 347.462 5.182 30 20 EKED CCOc1ccc(C(F)(F)F)cc1N[C@@H](C)c1cccc(C#N)c1 600847181 AXCQWOZHGSYBHM-LBPRGKRZSA-N 334.341 5.149 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(COC3CCCC3)cc2)cc1 614058741 UYIOPCKMNSMXSR-UHFFFAOYSA-N 348.490 5.559 30 20 EKED C=CCCOCC(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 674522500 CXLZKQKCQWLRAO-INIZCTEOSA-N 341.476 5.071 30 20 EKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2sccc2C)ccc1OC 733749668 SNRAZHMQCCSVRI-QPBFKRLHSA-N 330.449 5.139 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1cccc(N(C)C)c1 735478790 OLXSVXVGPDQFQR-HXUWFJFHSA-N 330.516 5.167 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@@H]1c1cccnc1 735632220 ZCRILHLYEHGICS-CKOFDZGGSA-N 328.500 5.442 30 20 EKED N#CCCn1cc(C=NNc2cccc3ccccc23)c2ccccc21 747060598 ZRLMPUAUUXEWNX-UHFFFAOYSA-N 338.414 5.154 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(C(F)(F)F)s1 761478628 URSKCWWOBOLZFK-FNORWQNLSA-N 342.386 5.057 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(O)c(Cl)c1 768756242 KZCNWPMPUYESTF-GQCTYLIASA-N 347.848 5.127 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(OC)c2ccccc12)c1ccccc1 773114815 KCADLMYQHPLIHD-VGOFRKELSA-N 329.443 5.264 30 20 EKED CCCC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 800385828 FODZHXNSVBTGJV-DOMZBBRYSA-N 346.883 5.466 30 20 EKED N#CC1(c2ccc(-c3ccc(C(F)F)c(F)c3)cc2)CCOCC1 904843097 GJKPMPWQIDKKIW-UHFFFAOYSA-N 331.337 5.002 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776697573 ISSJYMFRSMQEKE-DEYRLNKFSA-N 348.398 5.541 30 20 EKED CCc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)s1 1776966075 VRQSAEHVOGQKDM-UTCJRWHESA-N 342.441 5.120 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Cl)ccc1F 40419481 HHLIAFUEFOWGBU-UHFFFAOYSA-N 344.238 5.022 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)[C@@H](C)CC#N 86284772 VOYGHCUFZYXLOM-HNNXBMFYSA-N 345.512 5.186 30 20 EKED O=C(/C=C\c1cc(Br)cs1)c1ccc(Cl)s1 212556814 XXLONZAPNUHLRT-UPHRSURJSA-N 333.659 5.122 30 20 EKED C[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1c(F)cccc1F 321937253 UQZKFWZVFCBHPQ-SECBINFHSA-N 326.268 5.028 30 20 EKED Cc1nc(CC/N=C(/O)C2(C3CCCCC3)CCCCC2)c(C)o1 329106382 HKQQEIVKXDXPJR-UHFFFAOYSA-N 332.488 5.321 30 20 EKED C=CCCc1ccccc1NC(=O)c1scnc1C1CCCC1 410345824 RLMWAXDAWRKZNB-UHFFFAOYSA-N 326.465 5.172 30 20 EKED C[C@@H](Nc1ccc(NC(=O)CCCC#N)cc1Cl)c1ccccc1 461915303 GZVQXTAEICHVDA-CQSZACIVSA-N 341.842 5.145 30 20 EKED CC[C@@H](C)n1c(SCCCC(C)(C)C#N)nnc1-c1ccccc1 476495938 XHTHCZIVQRHWRS-OAHLLOKOSA-N 342.512 5.338 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccccc1CCC(F)(F)F 486591579 RWMZCIKWUGKQJE-UHFFFAOYSA-N 346.396 5.595 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 488827906 BBVHTWNHPUDUFN-FQEVSTJZSA-N 344.414 5.172 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)[C@@H](CC)c1ccncc1 505010617 JMVSAYIVZBKJKC-FQEVSTJZSA-N 337.467 5.205 30 20 EKED CC(C)c1ccc(Cc2noc(C[C@@H](CC#N)c3ccccc3)n2)cc1 554792664 KWABOSVSHSJWOI-HXUWFJFHSA-N 345.446 5.024 30 20 EKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(C)cc2)c1 589738825 AGLLAOMUCWEMGZ-KRWDZBQOSA-N 338.451 5.175 30 20 EKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1 609825586 HBIRADOALWVQFQ-CHWSQXEVSA-N 344.867 5.033 30 20 EKED CCOc1ccc([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cc1 619508235 YNQKZYNDWUUTOR-AOMKIAJQSA-N 334.463 5.075 30 20 EKED Cc1cccc(COc2ccc(C(=O)/C=C\c3c(C)noc3C)cc2)c1 727654580 NSHBTNKWRTUCKC-QXMHVHEDSA-N 347.414 5.075 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2cccc(C#N)c2)cc1 741467137 HJLHROIZYQEQNK-SDNWHVSQSA-N 339.394 5.130 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)COC3)o1 742436964 PEBSEMXJWXJLPN-VMPITWQZSA-N 348.373 5.320 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(C#N)s2)cc1 749006436 VGTCCNWPWAIAKB-OUKQBFOZSA-N 345.423 5.191 30 20 EKED C=CC[C@@H](NC(=O)N1C[C@H](C(C)(C)C)c2ccccc21)c1ccncc1 770625315 KBRBSJMBGWOUAA-RBUKOAKNSA-N 349.478 5.058 30 20 EKED C=CC[C@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccncc1 788579799 HMQJQLHDWRNHDH-HNKHHVNMSA-N 332.900 5.196 30 20 EKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NOCCC(F)(F)F 799485966 YCKFRCZMVYFOSW-UHFFFAOYSA-N 326.362 5.181 30 20 EKED CCC(CC)N(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 808815415 DZNCEEUJFVEPDY-NRFANRHFSA-N 349.478 5.384 30 20 EKED CC[C@H](NCc1ccc(CC#N)cc1)c1cc(Cl)cc(Cl)c1O 842888454 RUXUNOYKSBTHLY-KRWDZBQOSA-N 349.261 5.006 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776114491 RBFXFAHDNKOPSB-BENRWUELSA-N 348.423 5.318 30 20 EKED COc1cc(Cl)c(CN[C@@H](CCC#N)c2ccccc2)cc1Cl 157930463 YBLFYYJYSZHWCQ-KRWDZBQOSA-N 349.261 5.137 30 20 EKED CCCCCCCCOC(CCC#N)OCCCCCCCC 225067116 AAFZKYZZZXQHQU-UHFFFAOYSA-N 325.537 6.370 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@H](C)c1cccc(C#N)c1 447557046 KLDUWQMGYJOZRQ-RDTXWAMCSA-N 332.369 5.211 30 20 EKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(SC)cc1 466672469 OVLSILRKMRXGMC-CQSZACIVSA-N 343.517 5.178 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 505029097 LFGOXYRBHJENKO-VQIMIIECSA-N 338.451 5.403 30 20 EKED CCN(Cc1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 507688319 NNJPSXWVLSPZGP-AWEZNQCLSA-N 332.369 5.160 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccc(C#N)cc1 509656249 UWKLYURBPLKKEB-CABCVRRESA-N 338.476 5.191 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccccc1C#N 525599384 ONBFPDHGBNAWMM-GJZGRUSLSA-N 338.476 5.191 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC[C@@H](C#N)CCC#N)cc1 575741503 ZAISAANKWDJACF-IAGOWNOFSA-N 335.476 5.395 30 20 EKED CC(C)c1ccc(C[S@](=O)CCCCC(C)(C)C#N)c(C(C)C)c1 618129626 SCKDIVQSCDSMOD-XMMPIXPASA-N 347.568 5.902 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1cc(-c2ccccc2)cs1 618741622 HRUILZWRWDCZME-OAQYLSRUSA-N 330.456 5.064 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@@H]2CCc3cc(C#N)ccc32)o1 618742659 OHTWRSFBDKIPJQ-OAQYLSRUSA-N 346.405 5.043 30 20 EKED CC[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1F 618801315 ACILSMJOUCLLGB-MSOLQXFVSA-N 328.818 5.079 30 20 EKED C#CCCOc1ccc(CN[C@@H](C)c2cccc3ccccc23)cc1 733322794 DKQZTATWADJNCC-SFHVURJKSA-N 329.443 5.093 30 20 EKED CCCCCCCCC(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1 747786304 ZWDGKINYEJDQLA-IRLDBZIGSA-N 345.527 5.363 30 20 EKED Cc1cc(/C=C\C(=O)c2ccsc2)cc(C)c1OCc1ccccn1 749105716 XJPZGTKUDZBFRQ-SREVYHEPSA-N 349.455 5.235 30 20 EKED C#CC[C@@H](N[C@@H](c1cccc(OC(C)C)c1)C(F)F)c1ccccc1 788684385 CVYCUKHMAVAVLC-UXHICEINSA-N 343.417 5.134 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792096839 SJZBYVBEILXFPD-FIIODCPWSA-N 346.817 5.168 30 20 EKED COc1ccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)cc1 853323095 PGAWQVPIPIQTIT-UHFFFAOYSA-N 342.283 5.148 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(Br)ccc1C)c1ccncc1 858364499 FVBPFOHZBXFBRX-KBXCAEBGSA-N 345.284 5.121 30 20 EKED CCCCCCCCSc1nnc(-c2sc(C)nc2C)o1 915795351 JAQGWLHVVJFTAH-UHFFFAOYSA-N 325.503 5.263 30 20 EKED CC(C)c1cccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)c1 1776375401 MDZRZPPREAEUOQ-SREVYHEPSA-N 334.824 5.119 30 20 EKED C[C@@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 181322728 NSAMOIHJWIHEMY-IAGOWNOFSA-N 327.431 5.032 30 20 EKED C[C@H](c1ccc(C#N)cc1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 303665844 FGBQXQGEDMEUAU-OAHLLOKOSA-N 347.437 5.119 30 20 EKED Cc1ccc(C)c([C@@H](NCc2cccc(C#N)c2)c2ccccc2)c1 327410043 WXMYCCGDCBUGON-QHCPKHFHSA-N 326.443 5.054 30 20 EKED Cc1c(Cl)cccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432468484 IYBWBOFTKDJIMA-GOSISDBHSA-N 341.842 5.205 30 20 EKED N#CCCC[C@H](NCc1ncc(-c2ccccc2F)o1)c1ccccc1 433032393 LVTPBOBWZBRZMT-IBGZPJMESA-N 349.409 5.005 30 20 EKED C=CCC[C@H](N[C@H](C)c1nccnc1C)c1ccc(C(F)(F)F)cc1 446941614 MBBRWFNSQPPSNI-PBHICJAKSA-N 349.400 5.162 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 467822677 BXGDYNSQGFXWIO-QGZVFWFLSA-N 334.463 5.567 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(O[C@H](C)CC)cc1 510986310 VCQWFYQPXQHNNE-OAHLLOKOSA-N 344.480 5.146 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccccc3Cl)cc2)ccn1 520666725 JGKZSFPTKBCECS-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 539495744 CDWCTOVPDRQJAO-UZUQRXQVSA-N 344.433 5.332 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccc(CCC(F)(F)F)cc1 540548175 BGXXSPNGOMFESR-ZDUSSCGKSA-N 328.378 5.048 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@@H](CCCC#N)c1ccccc1 572065012 MMCRLBHSCFDHPO-FCHUYYIVSA-N 348.490 5.442 30 20 EKED N#CCCCCCC(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 588264596 PFPHIGNXXUFEFF-UHFFFAOYSA-N 349.459 5.376 30 20 EKED C=CCN(Cc1ccccc1)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 607787700 BDPHAFWMBPFFLC-HNNXBMFYSA-N 347.380 5.024 30 20 EKED CCc1c(C)sc(NC(=O)c2ccccc2SC(C)C)c1C#N 609033457 UTNVBBZAYYJGDY-UHFFFAOYSA-N 344.505 5.243 30 20 EKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2SC[C@H](C)C#N)C1(C)C 609376753 IWFQWNPEXYYPOO-RKVPGOIHSA-N 342.508 5.115 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)c(Cl)c1 618807786 WQZBKRICOVGLPJ-BBATYDOGSA-N 331.246 5.203 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)/C=C\c2ccccc2C#N)cc1 726760069 ITTGVXDWYMBCMS-JYRVWZFOSA-N 336.460 5.101 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cccc(OC(F)(F)F)c1 730949544 XYPLIBUEIMAHTH-VQHVLOKHSA-N 343.304 5.030 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1cccc(Cl)c1Cl 734980022 GOFYFNCYFKQQMD-HJWRWDBZSA-N 331.198 5.208 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1cccc(Cl)c1Cl 742434630 LTCOBXASTGXDSG-KTKRTIGZSA-N 343.213 5.280 30 20 EKED N#Cc1ccc(/C=C2\CCSc3ccc(Cl)cc3C2=O)s1 749006249 SQJOMSUFLPHODZ-JXMROGBWSA-N 331.849 5.035 30 20 EKED C[C@@H]1CCC[C@H](OCCCCCC(=O)OCC2CCC(C#N)CC2)C1 755974881 MGPKUYSFEGVWFM-OAHAVBBTSA-N 349.515 5.015 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3csc(C(C)C)n3)co2)cc1 787479283 ALAHQUFNLCDFQG-CMDGGOBGSA-N 338.432 5.126 30 20 EKED CC[C@@H](NCC1CCC(C#N)CC1)c1cc(Cl)cc(Cl)c1O 806164277 PJCBERTYIFZIAA-ZEPSKSRBSA-N 341.282 5.070 30 20 EKED CCCCCCCOc1cccc(/C=C\C(=O)c2ccnc(O)c2)c1 806556224 QJPBMDRCWWIOPT-KHPPLWFESA-N 339.435 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1cccs1 857611904 QFSCVLRBEOUFAI-SQFISAMPSA-N 325.477 5.642 30 20 EKED Cc1ccc(N(C)C(=O)c2ccccc2-c2ccccc2C#N)c(C)c1 917813811 JURBYIRIXSMPNA-UHFFFAOYSA-N 340.426 5.119 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(F)c(C(=O)O)c(F)c2)cc1 1776700021 PBTPUBUMCOTWBB-OXFRDRNISA-N 344.357 5.073 30 20 EKED C=CCC(CC=C)C(=O)N(CC)[C@H](c1ccc(C)cc1)c1cccnc1 133091808 AAWBCHXDAWSJQT-JOCHJYFZSA-N 348.490 5.096 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc3ccccc3c2)c1 207617935 CYWMTUUYFFUERT-RAXLEYEMSA-N 341.410 5.418 30 20 EKED C[C@H](NCc1cccc(Oc2ccccc2)c1)c1ccc(C#N)cc1 327333723 ZEEUNYWBXMMORP-KRWDZBQOSA-N 328.415 5.201 30 20 EKED C=CCCN(C)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 466551683 QHOUBUCBYXESPJ-INIZCTEOSA-N 340.492 5.580 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)cc(Cl)c1 476087732 CRSOTZIGOWRCAV-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C=CCOc1ccc(CN[C@H](CC)c2ccc(OC)cc2)cc1Cl 520208341 KAOWSONJKUVGGW-LJQANCHMSA-N 345.870 5.154 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1cccc(C#N)c1 521765124 XJZIOXUPXRJPKY-NSHDSACASA-N 348.233 5.090 30 20 EKED CCC(CC)N(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 530706594 BFHSUBJGCBUODS-CQSZACIVSA-N 345.512 5.266 30 20 EKED C[C@H](NC(=O)N[C@H](CC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 610356811 APPPDTUPTJJRQY-OXJNMPFZSA-N 349.478 5.096 30 20 EKED CCN(C(=O)c1cc2c(Cl)cccc2s1)c1ccc(C#N)cc1 611073615 IUGBIHIYAZMQJD-UHFFFAOYSA-N 340.835 5.093 30 20 EKED CCCCc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 613290788 LBBWTYIVAIWGQM-LJQANCHMSA-N 328.415 5.067 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(OCC(C)C)cc1 730149217 CTZBMOXJKBHYIC-XFXZXTDPSA-N 340.467 5.012 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(Cl)cc2)c1 743476024 BDSLKYFNDNDGQS-UYAOXDASSA-N 342.870 5.262 30 20 EKED N#C[C@H](C(=O)C1CCCCCCC1)c1nc2cc(Cl)ccc2s1 744036413 YKUGMOSYGKVKPS-CQSZACIVSA-N 346.883 5.486 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NCCCC1(C#N)CCOCC1 798388624 VRUVQYFBHPQDHA-UHFFFAOYSA-N 346.540 5.398 30 20 EKED C#C[C@H](NCc1cc(Cl)cc2cccnc12)c1ccc(Cl)cc1 811517182 KHASGDPLCCAOFW-SFHVURJKSA-N 341.241 5.006 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1cc(Cl)cc(Cl)c1F 864021644 CEAVXOULQAYYTB-JTQLQIEISA-N 339.197 5.035 30 20 EKED COc1cccc(/C=C\C(=O)c2ccc(Cl)cc2)c1OC(C)C 916135239 NHPONTILWVHPRT-XFXZXTDPSA-N 330.811 5.032 30 20 EKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)o2)c(F)c1 916141170 CMYZDDBQBRJNDH-JXMROGBWSA-N 340.325 5.130 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc2ccccc12 66856337 NPYVPFHQKPMORH-HNNXBMFYSA-N 346.455 5.486 30 20 EKED C[C@@H](NC(=O)c1ccc(CC#N)cc1)c1ccc(Cl)c2ccccc12 462229508 YBEBMOUVHQWUSP-CQSZACIVSA-N 348.833 5.050 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)c2cc3ccccc3o2)C1 463301041 MBIJUTOJFKORHK-ZWDAVXSWSA-N 330.431 5.194 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2oc(C)nc2c1 471156466 KVWAKTUSRFHYOE-UHFFFAOYSA-N 334.419 5.240 30 20 EKED COCC[C@@H]1CCC[C@@H]1N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 502413091 HRCDZGRASARRFI-FHZYATBESA-N 348.490 5.081 30 20 EKED CC(C)CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccoc1 561315734 RROMFDRFQXEPOQ-HXUWFJFHSA-N 326.440 5.552 30 20 EKED C[C@H](Nc1ccccc1COc1ccccc1)c1cccc(C#N)c1 600849172 KYDSEXGVCONAAB-KRWDZBQOSA-N 328.415 5.310 30 20 EKED N#Cc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 604124750 OJFGIDFJWXPPNH-JOCHJYFZSA-N 346.861 5.285 30 20 EKED Cc1nc(-c2ccccc2)sc1CNc1cc(Cl)ccc1C#N 609892762 XWGSOEVBRVIANN-UHFFFAOYSA-N 339.851 5.256 30 20 EKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747197590 IXDKJTHSIQVXFC-QGZVFWFLSA-N 340.492 5.199 30 20 EKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747198823 LDJQRJFGVAROGU-QGZVFWFLSA-N 340.492 5.164 30 20 EKED N#CCOc1cccc(/C=C2/CCc3c(sc4ccccc34)C2=O)c1 763099924 HKCBOUCBCOGTLE-QINSGFPZSA-N 345.423 5.016 30 20 EKED Cc1cc(Cl)cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1O 815635614 GLKBWXTVWHXJSS-BEFAXECRSA-N 342.870 5.440 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Nc1ccc(CCC#N)cc1 905856296 VYADJHWJCCQSHX-SJORKVTESA-N 349.478 5.095 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776697579 ISSJYMFRSMQEKE-LZTOIUFZSA-N 348.398 5.541 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1cccc(CCC(=O)O)c1 1776786019 CJGBNDNBLPYXCQ-MRXNPFEDSA-N 333.472 5.029 30 20 EKED C=CCN(Cc1cccs1)Cc1ccccc1Oc1cccnc1 63517542 CPHXYUZBHLHUKQ-UHFFFAOYSA-N 336.460 5.124 30 20 EKED CCCCc1nc(CNc2ccccc2S[C@H](C)CC#N)cs1 172907504 WVKOLMLEHROWLU-CQSZACIVSA-N 345.537 5.492 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(F)cc1Cl 189892127 FMRKPBZRMVXYLW-UHFFFAOYSA-N 349.808 5.722 30 20 EKED COc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)cc1N=C(C)O 329001564 LGWZWBAAAKJRAE-DJIMGWMZSA-N 344.455 5.498 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@H](N[C@H](CCC#N)c2ccccc2)C1 343435416 BHRXMMCEIBJVCZ-QHAWAJNXSA-N 333.479 5.051 30 20 EKED CC[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)s1 439435427 FATVJYRBLNPIEQ-ZDUSSCGKSA-N 325.264 5.167 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCSc1ccccc1 476076745 BPAXKBDQLVCOIA-UHFFFAOYSA-N 339.504 5.659 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1)c1ccccc1 496740047 SWWPSIYRYHCKHK-VQIMIIECSA-N 339.866 5.016 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2ccccc2c1 521725427 CXHAVIRKPKEDMR-HNNXBMFYSA-N 346.455 5.344 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 538394663 JONPKPBHCXSPFF-VLIAUNLRSA-N 336.435 5.199 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 556203278 JBQLJQSEEAQBLB-LIRRHRJNSA-N 347.289 6.079 30 20 EKED CC(C)Oc1cccc([C@@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)c1 595415298 LNIOHEUVWFTGBA-KUHUBIRLSA-N 328.843 5.043 30 20 EKED C[C@@H](CC#N)Sc1ccccc1N=Cc1cc(Cl)ccc1O 731320237 XHMQVRAAZBUAGF-LBPRGKRZSA-N 330.840 5.190 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C/c3cccc(C(F)(F)F)c3)c2c1 734306931 JGMVHWIGTXDGAM-VMPITWQZSA-N 345.320 5.091 30 20 EKED COCc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1 741841663 NUIVPQVWLSZMAQ-WDZFZDKYSA-N 334.387 5.044 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1cccc2ccccc12 750898994 BPJBCHXJNODOBC-LSQDYUBESA-N 329.355 5.200 30 20 EKED C[C@@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc(C#N)c(F)c1 777659217 JPHKIJRCWFKZNZ-CYBMUJFWSA-N 343.833 5.124 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1nccc2ccccc12 792103591 LJBAJVGSLPYUNN-UIXUWTQFSA-N 332.447 5.018 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792103698 LQYXDRBGEIXUDO-VUVZNRFTSA-N 346.817 5.168 30 20 EKED N#CC[C@H](CC(=O)O[C@@H]1CCc2sc(Cl)cc21)c1ccccc1 796768410 BUDQMKSTDTVHKB-UKRRQHHQSA-N 345.851 5.020 30 20 EKED CCC[C@@H](N[C@@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902786762 SJQSACAFLHWKLQ-SUMWQHHRSA-N 347.384 5.164 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(CC(C)C)c1 1776033925 YONIPBUSULEREC-UHFFFAOYSA-N 344.842 5.073 30 20 EKED C=C(C)[C@H](NCc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1 187784987 CNTYFBTYXMUGTN-INIZCTEOSA-N 343.204 5.074 30 20 EKED C=C(C)[C@H](NCc1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 187791676 BWYQFKZUJMFWFY-FQEVSTJZSA-N 340.373 5.027 30 20 EKED CCCCC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1 236686342 VSXANMVCPRPOCG-GCJKJVERSA-N 336.479 5.389 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1Cl 286546027 RCYXJZBHNACSLA-UHFFFAOYSA-N 340.854 5.540 30 20 EKED C[C@@H]1Cc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@H](C)C1 411011349 LVKIACKQRZZBIM-WDEREUQCSA-N 340.448 5.028 30 20 EKED N#C[C@H]1CC[C@H](N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)C1 429696353 IKMRMHMZPZLGTF-YOEHRIQHSA-N 335.278 5.165 30 20 EKED N#CCCC[C@@H](NCc1coc(-c2cccc(F)c2)n1)c1ccccc1 433019916 QLWPOXKXEIHFMN-HXUWFJFHSA-N 349.409 5.005 30 20 EKED Cc1nc(C(F)(F)F)c(CS[C@H](C)c2cccc(C#N)c2)s1 443143077 ISGMDWAZNUSEIA-SECBINFHSA-N 342.411 5.336 30 20 EKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)CCCCC(C)(C)C#N 444625972 QUXJZTOVHATOQD-AWEZNQCLSA-N 326.406 5.418 30 20 EKED CC(F)(F)c1ccccc1NCc1cccc(OCCCC#N)c1 449477356 WQPZUHDXFYUOMR-UHFFFAOYSA-N 330.378 5.093 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 466667868 XPNFITRCBSSXRB-ZQIUZPCESA-N 339.401 5.217 30 20 EKED Cc1cccnc1[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(C)C 481670566 PDBCGNVDUCVXRM-RTWAWAEBSA-N 333.479 5.016 30 20 EKED C[C@@H](Nc1c(Cl)cccc1C#N)c1nc2ccccc2n1C(F)F 486445102 AWSDPISNMAKYJG-SNVBAGLBSA-N 346.768 5.130 30 20 EKED CCC(C)(C)c1ccc(C[S@@](=O)CCCCC(C)(C)C#N)cc1 505718893 GYCPGDZJHXWZRK-QHCPKHFHSA-N 333.541 5.343 30 20 EKED N#Cc1ccc(C[S@@](=O)Cc2ccc(C3CCCCC3)cc2)cc1 505746598 YHDWQLJMVMPSMM-XMMPIXPASA-N 337.488 5.055 30 20 EKED C[C@H](SCCCC1(C#N)CCOCC1)c1cccc(Cl)c1F 512383427 YMVAFKCOGSFJHK-ZDUSSCGKSA-N 341.879 5.374 30 20 EKED C[C@@H](SCC(=O)Nc1cccc(C#N)c1)c1ccc2ccccc2c1 604070545 NVSOFHZUVIMEGZ-OAHLLOKOSA-N 346.455 5.144 30 20 EKED C=CCC[C@@H](NCc1conc1CC)c1ccc(C(F)(F)F)cc1 660204475 MDIUVAHIFBICFR-QGZVFWFLSA-N 338.373 5.053 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(-c2ccc(C)o2)ccc1C 666967956 YCEWWUWKQRWFKP-HDICACEKSA-N 336.435 5.278 30 20 EKED C=CCN(C(=S)Nc1ccccc1-c1ccccc1)c1ccccc1 750975157 QSSBTTGNIOJTMI-UHFFFAOYSA-N 344.483 5.743 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc(C)ccc1OC(F)F)c1ccccc1 773106945 NHLFGESNVKXICW-CRAIPNDOSA-N 329.390 5.012 30 20 EKED CC(C)(CCC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792096386 OIIZDENCPQOTBL-HXUWFJFHSA-N 342.442 5.169 30 20 EKED C=CC[C@@H](C(=O)O[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803061898 CTHIXLVMKLDGQI-XJKSGUPXSA-N 349.352 5.065 30 20 EKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(F)c2ccccc12 808437905 YGILSBOXLSXKGT-CVEARBPZSA-N 348.421 5.121 30 20 EKED C=CC[C@@H](N[C@H](C)CC(C)(C)c1c[nH]c2ccccc12)c1ccncc1 812716691 PFCRBSGNQOVCIQ-DYESRHJHSA-N 347.506 5.526 30 20 EKED CCCCCCCCC[C@H](C)CC=NNc1ccc(C(=O)O)nc1 1776070973 UPPDKXBDLYDFJS-INIZCTEOSA-N 333.476 5.344 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1c(Cl)cccc1Cl 1776783329 QREAVRICWYAXIP-CYBMUJFWSA-N 346.298 5.287 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCCC)cc1 1776784699 JDHJYXLEKXNJGE-LJQANCHMSA-N 349.515 5.159 30 20 EKED Cc1cccc2c(C(=O)/C=C\c3cc(C(=O)O)c(Cl)s3)coc12 1777449107 XQHFPMYTOAYXAW-WAYWQWQTSA-N 346.791 5.050 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccs3)s2)cc1 1777671152 LSUNALGZPDMVSS-CLFYSBASSA-N 340.425 5.071 30 20 EKED C[C@@H](Nc1cccc(OC2CCCC2)c1)c1ccc(OCC#N)cc1 183081835 IKAOBVDIUKEURY-MRXNPFEDSA-N 336.435 5.083 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1sc(-c2ccccc2)nc1C 185845348 RWCDAZSFXSDGOP-HOCLYGCPSA-N 342.508 5.240 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ncc(C(C)(C)C)o1)c1ccc(F)c(F)c1 187777537 ZSIPBFJWCCCNMJ-SJCJKPOMSA-N 334.410 5.218 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccncc1 191441012 JDVIJKMFMZQGOU-MRXNPFEDSA-N 337.467 5.158 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)OCc1ccccc1 276487274 TTWKFVBCJFBLOL-QGZVFWFLSA-N 337.463 5.082 30 20 EKED C[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(OCC#N)cc1 293905996 ZUPSOFWAZWJMRH-WBMJQRKESA-N 346.883 5.032 30 20 EKED C[C@@H](Nc1cccc(OCc2ccccc2)c1)c1cccc(C#N)c1 310877166 HHHPETCSJKASOJ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED C[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 429755695 HXHUANROCSPLGV-MAUKXSAKSA-N 349.434 5.003 30 20 EKED Cc1c(CNCc2cccc(C#N)c2)sc2ccc(Cl)cc12 441338968 GNTZBXHRGYTHMA-UHFFFAOYSA-N 326.852 5.025 30 20 EKED C=C(C)[C@H](N[C@@H]1CCSc2ccccc21)c1ccc(F)c(F)c1 480670025 VXUJMPMIVYVUBM-MJGOQNOKSA-N 331.431 5.409 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2oc(C)c(C)c2c1 481664292 WREOOLBHQWHHHK-UHFFFAOYSA-N 340.448 5.331 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C 503221170 CACUNRQQVJUJPV-UGUYLWEFSA-N 345.512 5.027 30 20 EKED CCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512642499 QFTXHBKZEJCNGI-HXPMCKFVSA-N 332.369 5.168 30 20 EKED C=C[C@H](CC(=O)Nc1scnc1-c1ccccc1)c1ccccc1 536249355 QEJVOMHCUJNSEO-OAHLLOKOSA-N 334.444 5.109 30 20 EKED CC(C)[C@@H](c1ccc(Cl)cc1)c1noc(CCCCCC#N)n1 589153478 WNHVTFNUHUVHQL-KRWDZBQOSA-N 331.847 5.137 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1Cl 609387308 WPPKSTNJACGOHC-ZIAGYGMSSA-N 330.884 5.765 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccccc1 681653345 TUQXVSPAOJUMPE-FQEVSTJZSA-N 346.430 5.257 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1c[nH]c2ccccc12 727266949 KRQIIEDXDJXYRL-ZHACJKMWSA-N 330.412 5.188 30 20 EKED C#Cc1cccc(N(C)C(=O)c2oc3c(ccc4ccccc43)c2C)c1 728483012 GAZYNIFXWKMOQE-UHFFFAOYSA-N 339.394 5.152 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1ccc(Cl)cc1Cl 742429097 HHKCUXIRLCNCQK-CLFYSBASSA-N 343.213 5.280 30 20 EKED Cc1ccc(-c2cc(C(=O)OCCCCC#N)c3ccccc3n2)cc1 747661828 ZNPZSICPIDDDEM-UHFFFAOYSA-N 344.414 5.061 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cc(F)cc(F)c1 755707134 XLBOJJGIPSFDOT-ONEGZZNKSA-N 333.384 5.046 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C\c2nccc3ccccc23)cc1Cl 773162065 SUNOSPISOOLELR-WAYWQWQTSA-N 343.213 5.020 30 20 EKED C#CCCCCCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 780385835 SRJMOIFRMQGIHY-KRWDZBQOSA-N 338.278 5.241 30 20 EKED C=CCC[C@H](N[C@@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 857858652 PMOJWRCOMPXXAC-DLBZAZTESA-N 349.400 5.103 30 20 EKED O=C(/C=C\c1csc(Br)c1)c1ccccc1Cl 913615272 JSNDTNHKDICOSA-WAYWQWQTSA-N 327.630 5.060 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1ccc(Cl)s1 916135766 PXKXQXCPSOBPIV-VOTSOKGWSA-N 331.849 5.421 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cccc(C)c1 1776785186 HHYQUDIEVYCERZ-FQEVSTJZSA-N 333.516 5.583 30 20 EKED COc1cc2nccc(Oc3ccc(N=C(C)C)cc3)c2cc1OC 2048532352 DZAAZDROUWMGPJ-UHFFFAOYSA-N 336.391 5.157 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1sccc1C#N)C1CC1 52032407 UXZDKPNYZUEHKD-AWEZNQCLSA-N 346.455 5.139 30 20 EKED N#CC1(/C(O)=N/[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CCCC1 329793403 BALZVPPEQQQMBK-JOCQHMNTSA-N 337.250 5.280 30 20 EKED C=CCCc1ccccc1NC(=O)CCSc1ccc(F)cc1 410371916 GJVARBGKXBYVMM-UHFFFAOYSA-N 329.440 5.065 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)C2CCCCC2)cc1F 437486435 VLIQXIGJYAZAIT-UHFFFAOYSA-N 338.382 5.008 30 20 EKED N#CCCC[C@H](NC(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 458809261 AGAVQXVNCYCLPG-ACRUOGEOSA-N 345.446 5.023 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC)c1ccc(Cl)s1 513102749 NEXFJTAYWBIESH-OAHLLOKOSA-N 348.899 5.250 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(-c2nccs2)cc1 523556929 UZQGLXULWNJMRL-UHFFFAOYSA-N 329.469 5.020 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cccc(-c2ncco2)c1)c1ccccc1 533162024 ASIQLKGTGYUEEU-LJQANCHMSA-N 347.418 5.171 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccc(CC#N)cc1 541293616 SEZFDLXOAZGBEF-UHFFFAOYSA-N 340.473 5.211 30 20 EKED C[C@@H](NCc1ccc(Cl)cn1)c1ccc(-c2cccc(C#N)c2)cc1 582440466 RIVYUAUGOSJXSF-OAHLLOKOSA-N 347.849 5.124 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1 609826179 ZHTNSHQGYBPAMG-OLZOCXBDSA-N 344.867 5.033 30 20 EKED CC(C)c1ccc(C=NO[C@@H](C)c2nnc(-c3cccs3)o2)cc1 748097167 DNICPEJJJHKXBS-ZDUSSCGKSA-N 341.436 5.033 30 20 EKED C=CCNC(=S)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 752238971 CLKSQFXMYNPGDH-CQSZACIVSA-N 328.506 5.012 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1 753135453 QVIHZKZOFWGKNT-HJWRWDBZSA-N 348.471 5.399 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c(C)ccc(C)c32)c1 769962470 IKNQPYPOGLEDNZ-SIKLNZKXSA-N 348.490 5.152 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1C(F)(F)F 772960041 QEVLLJBXWGFOFR-KGLIPLIRSA-N 348.368 5.020 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccccc1 773118078 YKNSGMPIYQKMHP-WMZHIEFXSA-N 332.491 5.092 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)OC(=O)c1ccc(C#N)c(Cl)c1 777775965 GABDINGFHQPMMN-NSHDSACASA-N 348.855 5.018 30 20 EKED C[C@H](C#N)OCCNc1cccc(-c2ccc(Cl)c(Cl)c2)c1 802740991 KTEYZLJZVBGXOM-GFCCVEGCSA-N 335.234 5.001 30 20 EKED CC(=NNc1nc(-c2ccccc2)cs1)c1nccc2ccccc12 811635542 BIKMABZFYQQBJM-UHFFFAOYSA-N 344.443 5.194 30 20 EKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3cccnc3)ccc21 916137337 VJSVQWFWUHFFTB-ZRDIBKRKSA-N 326.399 5.106 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776113959 DDYJAHSDFBMWMF-LUAWRHEFSA-N 348.423 5.318 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Cl)c(Cl)c1 1776784006 CYFXNEQSJMSGBR-CQSZACIVSA-N 346.298 5.287 30 20 EKED C[C@@H](Nc1ccc(NC(=O)C(C)(C)C#N)cc1Cl)c1ccccc1 78466872 KDHYHZKHWJDPQW-CYBMUJFWSA-N 341.842 5.001 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(SC(F)F)cc1 90665476 KGXDZDSICCRVRW-KDOFPFPSSA-N 346.446 5.697 30 20 EKED CCCCCCCCC[C@@H](CBr)CCCCCCC 117718297 HQILOMHBUXBHBX-SFHVURJKSA-N 333.398 7.499 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CC[C@H](C)c2ccccc2)n1 161084972 MNMZGAKEFCANGF-HOCLYGCPSA-N 326.465 5.027 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnn(C(C)C)c2)cc1 172692906 DGQPUXHTHFGTCT-MDWZMJQESA-N 346.430 5.036 30 20 EKED C=CC[C@H](C(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 188528312 IRKQCDQWBIFCFK-KRWDZBQOSA-N 347.380 5.480 30 20 EKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 352175569 VXZOJBAJEPOOHS-HIFRSBDPSA-N 346.883 5.056 30 20 EKED C=CCC[C@H](N[C@@H]1C[C@H](C)n2ccnc21)c1ccc(C(F)(F)F)cc1 453175632 QIGBBUJGSQYYTF-RRQGHBQHSA-N 349.400 5.205 30 20 EKED Cc1ccc([C@@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1C 475174982 JSGFAMYOHKKZAZ-UNMCSNQZSA-N 346.474 5.055 30 20 EKED Cc1cc([C@@H](NCCCCC#N)c2ccccc2Cl)ccc1F 491062813 XFDLEUOWZPRWQC-LJQANCHMSA-N 330.834 5.160 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@@H](C)c1ccc(C#N)cc1 508992509 AIKKZQPWXULBDL-KRWDZBQOSA-N 327.431 5.026 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(c2ccccc2)CC1 529135562 KLUXWHPGULIADK-UHFFFAOYSA-N 333.475 5.599 30 20 EKED Cc1c([C@@H](NCc2cc(C#N)ccc2F)C(C)C)oc2ccccc12 540358670 GNBYCRKNDNSWLK-FQEVSTJZSA-N 336.410 5.239 30 20 EKED N#CC1(CCCSCc2c(Cl)cccc2Cl)CCOCC1 540806672 UGOKVLINTOOYGB-UHFFFAOYSA-N 344.307 5.327 30 20 EKED CC(C)CCN(CCC#N)C(=O)N(c1ccccc1)c1ccccc1 541124781 XIWFPEGJNQGYLY-UHFFFAOYSA-N 335.451 5.206 30 20 EKED N#Cc1ccc(Oc2cccc(NCc3nc(C4CC4)cs3)c2)cc1 543162845 YOURBPUNRJTTRY-UHFFFAOYSA-N 347.443 5.297 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 552607075 MQRLVOLWFAISCG-GOEBONIOSA-N 339.401 5.014 30 20 EKED CC(C)(C)c1ccc(C#N)c(N[C@@H](CCCC#N)c2ccccc2)n1 590062357 UVLCVCPBXGTMKW-SFHVURJKSA-N 332.451 5.098 30 20 EKED N#CCCCSCc1coc(-c2cc(Cl)cc(Cl)c2)n1 600652602 WZDVDVDRYWUIAR-UHFFFAOYSA-N 327.236 5.185 30 20 EKED C[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C#N)cc1 608982471 LDJWGQSQTXJJAW-NSHDSACASA-N 338.760 5.081 30 20 EKED C[C@H](SCc1csc(C2CCCC2)n1)c1ccc(C#N)cc1 609825591 HFZVOHGIEUGIQI-ZDUSSCGKSA-N 328.506 5.667 30 20 EKED CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 610142572 APKCOOFIOAQWAH-XHSDSOJGSA-N 345.512 5.171 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2ccccc2Cl)o1 618742732 QSTAFYSOZFRCLI-FQEVSTJZSA-N 348.833 5.249 30 20 EKED Cc1ccc(-c2nnc(S[C@@H](C#N)c3ccc(Cl)cc3)o2)cc1 619863706 KNENZZWFIZMEHJ-HNNXBMFYSA-N 341.823 5.055 30 20 EKED C=CC[C@@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccncc1 766017784 DDLANPHBNWMRSH-MAUKXSAKSA-N 335.476 5.173 30 20 EKED C[C@H](Nc1cc(Cl)cc2cccnc12)c1ccc(C#N)c(F)c1 777626452 TYCYQGKPEFUJAW-NSHDSACASA-N 325.774 5.072 30 20 EKED C=CCC[C@H](Nc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1ccco1 796895325 BSVGOJFUZBCDIC-QKNQBKEWSA-N 341.451 5.081 30 20 EKED CC/C=C(/C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 918622132 SORCHIIEZOGKLQ-WMBZCPDOSA-N 338.838 5.290 30 20 EKED C=CCN(C(=O)c1ccc(COc2ccccc2)cc1)c1ccccc1 71846273 NYPINQOPNJYTSA-UHFFFAOYSA-N 343.426 5.098 30 20 EKED CC(C)(CCCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 171875440 IQGCZFKQPOIRGN-KRWDZBQOSA-N 346.430 5.053 30 20 EKED CC(C)[C@@H](C)N1Cc2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2C1 172417747 UNDSPCAIVBIGSD-DLBZAZTESA-N 333.479 5.091 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1cccc(C)c1 189880280 XRJPMHWYFUIFPK-KRWDZBQOSA-N 337.463 5.253 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2ccc(Cl)s2)o1 277707599 NIAAWIWWTZOXSQ-UHFFFAOYSA-N 341.889 5.264 30 20 EKED COc1ccc2cc([C@H](C)N[C@H](C)c3ccc(C#N)cc3)ccc2c1 327312110 VRSSVNCPFMYRTR-CVEARBPZSA-N 330.431 5.132 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)C(C)(C)C 433147068 XQLFKZVEDNIWBJ-CYBMUJFWSA-N 333.501 5.027 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCCCCC(C)(C)C#N)cc2)cs1 444673230 HFILUPONURHSQU-HNNXBMFYSA-N 341.524 5.489 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCc2ccccc21 475573312 RVUJCBYFBKMELI-FQEVSTJZSA-N 334.463 5.348 30 20 EKED C=CCCCC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 480897418 KOMHGUFBQGXVBN-UHFFFAOYSA-N 332.494 5.206 30 20 EKED CC(C)(C#N)CCCNc1ccccc1Nc1ccc(F)cc1F 486200324 RHELVQYOLUTBMM-UHFFFAOYSA-N 329.394 5.450 30 20 EKED N#CC1(CCCOc2c(Cl)cc(Cl)cc2Cl)CCOCC1 499904123 DJONGACHLUZXIP-UHFFFAOYSA-N 348.657 5.126 30 20 EKED CC(C)(C)C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 503338990 IAABFVQBBWEECS-LJQANCHMSA-N 335.451 5.052 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cc(OC)ccc1OC)c1ccccc1 539045949 DAPJEVFPLULSDR-OXJNMPFZSA-N 325.452 5.062 30 20 EKED Cc1c([C@H](NCc2ccc(F)c(C#N)c2)C(C)C)oc2ccccc12 539259814 YFHZYGKTSZCDLX-HXUWFJFHSA-N 336.410 5.239 30 20 EKED N#CCCC[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1 556907901 FHQMHRMFYKYSMQ-HSZRJFAPSA-N 348.490 5.533 30 20 EKED C#Cc1cccc(NC(=S)N[C@@H](c2cccs2)C(CC)CC)c1 726480285 HWUQGNZHZMQGJM-GOSISDBHSA-N 342.533 5.193 30 20 EKED C#Cc1cccc(NC(=S)N(CCCC)[C@@H](C)c2ccccc2)c1 726484096 CLVDKNIUASCFAB-KRWDZBQOSA-N 336.504 5.228 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(O)c(C)c3)cs2)cc1 728231199 JTCFYFQSYQNCGN-CSKARUKUSA-N 335.428 5.029 30 20 EKED CC(=NNc1ccc(F)cn1)c1ccc(Cl)c(Cl)c1Cl 731319589 WKYYJDCFRYDIGR-UHFFFAOYSA-N 332.593 5.017 30 20 EKED O=C(/C=C/c1ccsc1)c1ccc(SCC(F)(F)F)cc1 741843782 PZLIZLAKAJGZJQ-LZCJLJQNSA-N 328.380 5.299 30 20 EKED C=CCN(C(=O)Nc1ccc(SC2CCCCC2)cc1C)C(C)C 748447365 MEGLDAVWFXCXNE-UHFFFAOYSA-N 346.540 5.848 30 20 EKED CC(C)(C#N)CCOC(=O)[C@H](Sc1ccccc1)c1ccccc1 776357966 WKSYZEYGQQKOSA-GOSISDBHSA-N 339.460 5.003 30 20 EKED C=CCCc1ccccc1NCc1cc(C#N)ccc1Br 864027562 GSRMKUYDHADJAR-UHFFFAOYSA-N 341.252 5.051 30 20 EKED Cc1nc(-c2cccc(N=Cc3cc4ccccc4nc3O)c2)cs1 912779279 YVPLBYWVRMIRBJ-UHFFFAOYSA-N 345.427 5.123 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776113964 DDYJAHSDFBMWMF-PKNBQFBNSA-N 348.423 5.318 30 20 EKED CCCCCCCCCCCN(C)[C@@H](CCc1ccccc1)C(=O)O 1776784626 XPLKEEHVTYKWHF-NRFANRHFSA-N 347.543 5.535 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CC1CCCC1 72025229 PXJOUKGRYIKBJL-UHFFFAOYSA-N 334.419 5.178 30 20 EKED C=C[C@H](CC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 129202248 BJNFMEWVHMVEDV-QGZVFWFLSA-N 346.430 5.257 30 20 EKED C[C@@]12CC3CC(C(=O)[C@@H](C#N)c4nc5ccccc5o4)(C1)C[C@](C)(C3)C2 193623050 WPVIGPASDHBOIO-UTXAHIFOSA-N 348.446 5.001 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1ccc(Cl)cc1 206843368 IBCXPFWGHGZSKN-KHPPLWFESA-N 325.820 5.360 30 20 EKED CC(C)CCOc1cccc(NCc2ccc(O[C@H](C)C#N)cc2)c1 236587333 RDHYQACBACTVFJ-QGZVFWFLSA-N 338.451 5.014 30 20 EKED C[C@H]1C[C@@H](C(O)=Nc2ccc3oc(CC(C)(C)C)nc3c2)CCC1=O 328960638 PNYABZBSRJMQOB-STQMWFEESA-N 342.439 5.010 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H](C)c1cn(C)c2ccccc12 410346091 SUBJGCKYYAGOLB-INIZCTEOSA-N 332.447 5.039 30 20 EKED CN(CCC#N)C(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 433847179 DACZQSUGFCAURN-UHFFFAOYSA-N 348.233 5.038 30 20 EKED Cc1cscc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 439397496 PMYFVGJAYKXDON-UHFFFAOYSA-N 349.415 5.365 30 20 EKED C=CCCC1(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2C)CC1 476342675 ZAFINYWNOQHFNV-KRWDZBQOSA-N 326.484 5.059 30 20 EKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)cc1Cl 483713315 RWLREOFTURIVIZ-CYBMUJFWSA-N 332.856 5.027 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@@H](C)c1ccc(C#N)cc1F 510977574 IOMJGBQUDIGDGK-INIZCTEOSA-N 345.421 5.165 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccccc2)C2CCC2)cc1 517898112 OKPJURHJRBZNCC-FQEVSTJZSA-N 347.462 5.151 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 523512007 CRBQCHBTKGGUAJ-HZPDHXFCSA-N 339.401 5.014 30 20 EKED C=CCC[C@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 537156900 FFRWBIUCKXMHER-FQEVSTJZSA-N 336.410 5.278 30 20 EKED Cc1c(Cl)cnc(N[C@@H](C)c2ccc(-c3cccnc3)cc2)c1C#N 541350190 VDYNSPPSRUYTLZ-AWEZNQCLSA-N 348.837 5.150 30 20 EKED CC(C)[C@@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 556205728 MGWJPAWDWVTICG-VABKMULXSA-N 332.491 5.896 30 20 EKED Cc1c(-c2noc(C[C@H](CC#N)c3ccccc3)n2)oc2ccccc12 570483580 XMKSTOGOYDDUQA-INIZCTEOSA-N 343.386 5.031 30 20 EKED N#C[C@@H](NC(=O)CCC1CCCCC1)c1ccc(Cl)c(Cl)c1 609460550 PTNWHVYYSWOHLF-MRXNPFEDSA-N 339.266 5.035 30 20 EKED Cc1cc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)ccc1C#N 618196505 FBWRVPFSJPPSLT-UHFFFAOYSA-N 340.295 5.133 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2oc3c(C)ccc(C)c3c2C)cc1 726939997 BGHWDWLVXIBWQE-UHFFFAOYSA-N 346.430 5.227 30 20 EKED Cc1cc(C(=O)/C=C\c2csc(-c3cccs3)n2)c(C)s1 728439865 PWJZSLHHNOLRIY-WAYWQWQTSA-N 331.487 5.446 30 20 EKED CC(C)(C)CCCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 729070690 SRWSABKKGFJTIK-OAHLLOKOSA-N 326.465 5.203 30 20 EKED O=C(/C=C/c1ccnc2ccccc12)c1cccc(C(F)(F)F)c1 731835505 GNABFVAAZVIFOR-CMDGGOBGSA-N 327.305 5.150 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)c1cccc2ccccc12 739421479 JSFMLUIZBCIVKI-UHFFFAOYSA-N 329.325 5.090 30 20 EKED COc1cc(C(=O)/C=C\c2cc3cc(F)ccc3o2)ccc1SC 741844047 NVRMCIJVPVOADZ-WAYWQWQTSA-N 342.391 5.199 30 20 EKED CCOc1ccc(/C=N\[C@H](C)c2ccc(-c3ccncc3)cc2)c(O)c1 746392921 GDQUGOHUWPZODO-OYJNRBEISA-N 346.430 5.033 30 20 EKED CC(=C/c1ccccc1)/C=C/C(=O)c1sccc1Br 750904188 GQDWZUNDRSMDMM-MDFXNHGISA-N 333.250 5.353 30 20 EKED Clc1cnc(NN=C2CCC(OC3CCCC3)CC2)c(Cl)c1 834926475 NZKNRLWUYOYESL-UHFFFAOYSA-N 342.270 5.058 30 20 EKED C[C@@H](C#N)Oc1ccc(CNC(C)(C)c2ccc3ccccc3c2)cc1 858321176 VDQNEHBEPDBWCK-KRWDZBQOSA-N 344.458 5.156 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCCC)cc1 1776784698 JDHJYXLEKXNJGE-IBGZPJMESA-N 349.515 5.159 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1csc(C2CC2)n1 134853416 LJLYHXKANDFUJM-LBPRGKRZSA-N 329.494 5.027 30 20 EKED CC(C)(CCC#N)CNc1ccc(F)c(NC(=O)C2CCCCC2)c1 135484236 MGSGYVFXFJEYIE-UHFFFAOYSA-N 345.462 5.086 30 20 EKED C[C@@H](Sc1nnc(-c2cc3ccccc3o2)o1)c1cccc(C#N)c1 189854830 CSNAXFVHKAWOIW-GFCCVEGCSA-N 347.399 5.208 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccnc(Cl)c1 189912934 QZRYQOYEABPZFR-MDZDMXLPSA-N 340.854 5.239 30 20 EKED C[C@@H]1C(=O)CC[C@@H](C(O)=Nc2ccc3c(Cl)cccc3n2)C1(C)C 329335991 XWSMIDCTJNVLQX-YPMHNXCESA-N 344.842 5.118 30 20 EKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 439602360 GFBXLTRBCQKGHC-MRXNPFEDSA-N 339.398 5.395 30 20 EKED N#C[C@H](C(=O)c1ccc(F)c2ccccc12)c1nccc2ccccc12 483989396 VODJHQRQKIHQTI-IBGZPJMESA-N 340.357 5.017 30 20 EKED CCC1(C)CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 486652396 NBSWPQGDVWOSPD-UHFFFAOYSA-N 348.446 5.003 30 20 EKED N#Cc1cccc(CN[C@H](c2cccc3ccccc23)C(F)(F)F)c1 510401765 JVNKVCIYBFFRTB-LJQANCHMSA-N 340.348 5.105 30 20 EKED CCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@H](CC)c1ccccc1 521767358 JPHZQNRMJDDIDA-DYESRHJHSA-N 349.478 5.192 30 20 EKED C=CCCC(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 523272898 LCVOHUSJLPHQLF-UHFFFAOYSA-N 337.206 5.085 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccccc1C(F)(F)F 531309546 JEWILNMZIAMZGC-ZDUSSCGKSA-N 346.352 5.018 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)F)cc1 609428398 MVYCWJSPTOTCGP-LBPRGKRZSA-N 346.402 5.271 30 20 EKED C[C@H](N[C@@H]1CCSc2c(Cl)cccc21)c1cccc(C#N)c1 610830292 KBMYTADKCSGKOL-YVEFUNNKSA-N 328.868 5.099 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(C)c1 612303430 LYRQZRQWUUVRGT-HNAYVOBHSA-N 345.512 5.043 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H]3CCc4cc(C#N)ccc43)oc12 618801425 AUZUJSXBBMVKMV-IFXJQAMLSA-N 346.430 5.041 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 675207159 ABGZITVATFZRKK-UHFFFAOYSA-N 333.300 5.048 30 20 EKED Cc1cc(F)ccc1CNCc1cccc(-c2ccc(C#N)s2)c1 740014071 MDBUXYBSMOQDBK-UHFFFAOYSA-N 336.435 5.024 30 20 EKED O=C(/C=C/c1cccc(OCc2ccccc2Cl)c1)c1cccnc1 747003668 LLNCXWMZOMXJGZ-ZHACJKMWSA-N 349.817 5.210 30 20 EKED Cc1nn(-c2ccccc2)c(C)c1C=NNc1cccc2ccccc12 747060564 XRDHUZPBERHXRW-UHFFFAOYSA-N 340.430 5.088 30 20 EKED Cc1cc(NC(=O)c2c(F)cc(C#N)cc2F)ccc1-c1ccccc1 762514740 VDFLBWSQIKTBLG-UHFFFAOYSA-N 348.352 5.064 30 20 EKED C#CCCCCC(=O)Nc1ccccc1Oc1ccccc1Cl 773204730 JMFWQVFRPFCEPG-UHFFFAOYSA-N 327.811 5.264 30 20 EKED O=C(/C=C/c1ccc(OC(F)F)c(Cl)c1)c1cccc(F)c1F 776267894 IOIDDLJSSWURPJ-GQCTYLIASA-N 344.691 5.116 30 20 EKED COCCC1(C=NOc2ccccc2C(F)(F)F)CCCCC1 780237502 RELNSDXZZQMKOZ-UHFFFAOYSA-N 329.362 5.057 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(C)cc1 792092554 CXJIBRVYXYPLNL-UTKZUKDTSA-N 342.442 5.303 30 20 EKED Cc1cccc([C@@H](NCc2cc(C#N)ccc2F)c2cccc(F)c2)c1 800975270 ZKADDPDWMCMKJJ-JOCHJYFZSA-N 348.396 5.024 30 20 EKED O=C(O)c1ccc(NN=C2CCCC[C@H](c3ccccc3)C2)cc1F 1776074652 MBIKDWSYDISOCT-HNNXBMFYSA-N 340.398 5.040 30 20 EKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 47376208 ZNRCUZOZYPUDQN-HNNXBMFYSA-N 341.197 5.032 30 20 EKED Cc1cc(/C=C/C(=O)c2cnn(C(C)C)c2)c(C)n1C1CCCCC1 58465343 VYPHKVTZKWUFQD-ZHACJKMWSA-N 339.483 5.284 30 20 EKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(CC#N)cc1 77672590 WOWAYSWLNLRLHN-KRWDZBQOSA-N 347.462 5.148 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2CCCC[C@@H]2C1 191508310 IWJNALBXOVVPNF-QZTJIDSGSA-N 326.484 5.192 30 20 EKED C[C@@H](c1ccccc1)N(C)C(=O)c1ccccc1-c1ccccc1C#N 216819972 SCGZOUHENCNRIY-KRWDZBQOSA-N 340.426 5.058 30 20 EKED COC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340446644 GSAWYTGMKFNISJ-VQTJNVASSA-N 342.870 5.052 30 20 EKED CC[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 426303439 YBBDLNIILIWQSM-HOTGVXAUSA-N 330.884 5.391 30 20 EKED CC(C)(C#N)CCCOc1ccccc1OCc1cccc(F)c1 433608663 OIOGYDCBYOWZKB-UHFFFAOYSA-N 327.399 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)[nH]1 451329113 JLVOSOHQOWBKLW-UHFFFAOYSA-N 336.357 5.138 30 20 EKED CC[C@H](C)c1ccc([C@H](NC(=O)CCCC#N)c2cccs2)cc1 461757939 UCMHOJPWPPPBET-YWZLYKJASA-N 340.492 5.161 30 20 EKED C[C@H](CC1CCCCC1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487156036 LSYDUUKKMHVRJW-XLIONFOSSA-N 326.484 5.144 30 20 EKED Cc1cc(CNCc2ccc(C#N)cc2)ccc1Oc1ccc(F)cc1 500889064 NETIVUJNVBMZTN-UHFFFAOYSA-N 346.405 5.088 30 20 EKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)(C)C 521812583 YXZPOXYAYKQFLY-XJKSGUPXSA-N 333.501 5.027 30 20 EKED C=CCCC[C@@H](C)NC(=O)N(Cc1ccco1)Cc1ccc(C)s1 537184777 DEEIOCJCBNKNCA-OAHLLOKOSA-N 346.496 5.106 30 20 EKED N#CCC[C@H](N[C@H]1CCc2c(Cl)cc(Cl)cc21)c1ccccc1 537946750 RXYWDCLQWDQNEE-OALUTQOASA-N 345.273 5.615 30 20 EKED C=CCCCC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1 543297460 JYYMYWFJKMCIKS-FYYLOGMGSA-N 349.474 5.109 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@H]2CCc3ccc(C#N)cc32)cc1 582211091 VZYMURJDQMNHFY-VFNWGFHPSA-N 336.504 5.397 30 20 EKED CN(Cc1ccccc1C(C)(C)C#N)[C@H]1CC[C@@H](C(F)(F)F)CC1 588982468 IJICUONQWWSKEX-IYBDPMFKSA-N 338.417 5.041 30 20 EKED C=CCCSCc1csc(-c2ccc(OCC)c(OC)c2)n1 610091968 BDLUUTGRZFGNMU-UHFFFAOYSA-N 335.494 5.027 30 20 EKED CC(C)CCc1ccccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610323053 PEOBQOXLHOLWPD-MRXNPFEDSA-N 335.451 5.030 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H](c1cccnc1)C1CCCCC1 611391845 BKPNYWAQCAJMAA-PKTZIBPZSA-N 345.490 5.242 30 20 EKED C#Cc1cccc(NC(=S)N(CCC)[C@H](CC)c2ccccc2)c1 726484048 BCRHXFAILDNBGE-HXUWFJFHSA-N 336.504 5.228 30 20 EKED COc1cc(CON=C(C)c2cc3ccccc3o2)ccc1SC 731663979 LGZRGQWCDWQTJJ-UHFFFAOYSA-N 341.432 5.104 30 20 EKED N#Cc1cnc(Oc2cc(Cl)c(Cl)cc2Cl)c(Cl)c1 734142129 QLVDUDJDZZPJPR-UHFFFAOYSA-N 333.989 5.359 30 20 EKED COc1cc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)ccc1SC 736433559 GRPVOULARDMQQM-BQYQJAHWSA-N 347.505 5.067 30 20 EKED CCOc1cccc(C=Nc2cccc(CCC(F)(F)F)c2)c1O 753562297 CSWJWSPDMYDRRJ-UHFFFAOYSA-N 337.341 5.036 30 20 EKED CC[C@@H](C)c1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1 755199307 CSNHRYYZDPLQHY-MRXNPFEDSA-N 336.435 5.135 30 20 EKED C=CCC[C@H](NCc1ccc2c(c1)COC(C)(C)O2)c1ccccc1 768706542 PNDZVJBGZISQAJ-FQEVSTJZSA-N 337.463 5.129 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2C[C@@H](C)c3c(C)cccc32)c1 772982279 BNIWPQKJNXQFDX-BLIXFSHQSA-N 334.463 5.014 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1 793372207 ZSCKQTAGDGWAMW-CQSZACIVSA-N 346.402 5.027 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(Br)nc1)c1ccccc1 810228765 YRFDZFYOSNUFTN-PBHICJAKSA-N 345.284 5.202 30 20 EKED CC1(C)CCc2cc(CN[C@@H](CCCC#N)c3ccccc3)ccc2O1 814305072 WRZBMBJRHKYIAM-NRFANRHFSA-N 348.490 5.315 30 20 EKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1C(F)(F)CC 880775941 RHOWYQVBOUXSAT-UHFFFAOYSA-N 348.393 5.044 30 20 EKED Oc1ccc(Cl)cc1C=Nc1cccc(COCc2ccco2)c1 915981880 YOEOKOXEUFIXDN-UHFFFAOYSA-N 341.794 5.106 30 20 EKED COc1cc(C(=O)O)ccc1NN=C1CCCCCCCCCCC1 1776049548 AOMWASNFCZIBDH-UHFFFAOYSA-N 346.471 5.466 30 20 EKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)ccc1F 1776784618 RRFQNRXPIPVGLI-UHFFFAOYSA-N 337.479 5.487 30 20 EKED CCCc1ccc([C@@H](NCc2cccc(C#N)c2)c2cccs2)cc1 22817854 WDFHUASVIXCCTK-JOCHJYFZSA-N 346.499 5.451 30 20 EKED COc1cc([C@H](C)N[C@@H](CCC#N)c2ccccc2)ccc1SC 90665789 ZLFGUKZXGVYQKY-YJBOKZPZSA-N 340.492 5.113 30 20 EKED CCCCCCCC(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 154956418 MFGOCCKSLKOHRR-UHFFFAOYSA-N 342.439 5.139 30 20 EKED N#CCC[C@@H](NCc1ccc(SC(F)F)cc1)c1ccccc1 181938470 WTHRULKJIAYRJT-QGZVFWFLSA-N 332.419 5.136 30 20 EKED Cc1ccccc1CNc1cccc(OCc2cccc(C#N)c2)c1 302956843 LIMYYHDMDSFZAX-UHFFFAOYSA-N 328.415 5.058 30 20 EKED CCn1c2ccccc2c2cc(N=C(O)[C@H]3CCC(=O)[C@H](C)C3)ccc21 328925577 WABNMBDXFTTZIV-CABCVRRESA-N 348.446 5.408 30 20 EKED Cc1c(C(=O)Nc2sc(C(C)(C)C)cc2C#N)cnc2ccccc12 411007624 OOUSCIAIJOYTKR-UHFFFAOYSA-N 349.459 5.026 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 435617435 NKDAGXHVYKHPTO-QGZVFWFLSA-N 330.378 5.453 30 20 EKED CCSc1ccc(Cl)cc1NC(=O)[C@H](C)c1cccc(C#N)c1 463945834 BVILCMFTRCBWKA-GFCCVEGCSA-N 344.867 5.066 30 20 EKED Cc1cccnc1[C@H]1CCC[C@@H](Nc2cccc(OCCCC#N)c2)C1 467330025 FPEPFEOTSNDLJF-RBUKOAKNSA-N 349.478 5.211 30 20 EKED N#CC1(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CCC1 471487384 HHLDXDMBJZYEOY-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C=CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 474544824 RCGNMFVFICORCV-ACRUOGEOSA-N 332.447 5.295 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(C(C)(C)C#N)cc1 475365966 CTDWXCNNDZMZNR-FQEVSTJZSA-N 334.463 5.101 30 20 EKED C=CCC[C@@H](C(=O)Nc1cc(-c2ncc[nH]2)ccc1C)c1ccccc1 477981532 HBODBSHDQNEGMH-LJQANCHMSA-N 345.446 5.074 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(CC)c1CC 489667424 RBHDTDSBXPCNSZ-UHFFFAOYSA-N 325.477 5.342 30 20 EKED C=CCC[C@@H](N[C@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 526982213 WFQGAVJMNIBYPP-RDTXWAMCSA-N 341.417 5.117 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(CC#N)cc1 536187320 SIFUFGCMSMXBIL-UHFFFAOYSA-N 344.867 5.159 30 20 EKED C=CCC[C@H](NC(=O)Nc1ccccc1CSC)c1ccccc1 546843372 IDXWXWJLLHDUKN-SFHVURJKSA-N 340.492 5.379 30 20 EKED C=CCC(C)(C)C(=O)N[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 559643682 KLFGAWDAPOPVFW-HNNXBMFYSA-N 342.508 5.206 30 20 EKED C=CCC[C@@H](Nc1cccc(OCc2cccnc2)c1)c1ccco1 560544087 OBYHTFYLGUTZAL-HXUWFJFHSA-N 334.419 5.373 30 20 EKED Cc1csc(NC(=O)CCCc2csc3ccccc23)c1C#N 583167865 DFQQXNNEEMGQTG-UHFFFAOYSA-N 340.473 5.104 30 20 EKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1 590354465 YGERGLKVOKQTKP-UHFFFAOYSA-N 345.229 5.293 30 20 EKED Cc1cccc2sc(C(=O)N(C)c3cccc(C#N)c3)c(Cl)c12 604433894 FSLRIACLBRFDSE-UHFFFAOYSA-N 340.835 5.011 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCc2c1ccc(Cl)c2Cl 618806973 UKOHDLIFAOXZHN-ZWKOTPCHSA-N 343.257 5.129 30 20 EKED CCOc1cccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)c1 727266783 FUIMFQJRFMGMHN-VAWYXSNFSA-N 335.428 5.105 30 20 EKED CCCCC[C@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 742648754 AZHTYQYWGJRBLS-JKSUJKDBSA-N 332.513 5.483 30 20 EKED C[C@@H]1CCC[C@@H](CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C1 750667160 CHBBSXHSHUADHC-INMHGKMJSA-N 338.476 5.203 30 20 EKED C#CCCCC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 758161912 YMKNZRHLQYZSBE-UHFFFAOYSA-N 348.471 5.381 30 20 EKED C=C[C@@H](CC(=O)O[C@H](c1ccccc1)c1cccnc1)c1ccccc1 759315104 NHQVXKZPZWXIBW-FDDCHVKYSA-N 343.426 5.074 30 20 EKED CCN(Cc1ccc(O[C@@H](C)C#N)cc1)[C@@H](C)c1cc2ccccc2o1 769081613 LFJKJEAPPKQBQJ-IRXDYDNUSA-N 348.446 5.307 30 20 EKED CC(C)(C#N)CCCOC(=O)c1sc2cc(F)ccc2c1Cl 781969006 ISOOHRYVMZFVBG-UHFFFAOYSA-N 339.819 5.181 30 20 EKED C=CC[C@H](NCc1ccc(-c2cccc(F)c2F)o1)c1ccncc1 790965006 YNZGJUTUIVOVIJ-SFHVURJKSA-N 340.373 5.027 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2c(Cl)nccc2o1 866309176 MHGSPIRVXYDABU-BBRMVZONSA-N 339.826 5.177 30 20 EKED CC(C)[C@@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 236739237 ZEFYOXMYRTXOFT-GOSISDBHSA-N 332.369 5.064 30 20 EKED CCCc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)sc1C 352174023 JDORRONYPLZSCW-GOSISDBHSA-N 340.492 5.174 30 20 EKED CC(C)(C)[C@H](NCc1ccc(C#N)cc1OC(F)F)c1ccccc1 437404014 ISIXIWOGHMFXEL-GOSISDBHSA-N 344.405 5.037 30 20 EKED CC[C@@H]1C[C@H](CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542946667 XNTUBDNELAEQOQ-LYHRCORUSA-N 348.490 5.081 30 20 EKED Cc1ccc([C@@H](NCc2ccc(C#N)s2)c2ccccc2)c(C)c1 561437627 MMFGVTRHPRHOKS-NRFANRHFSA-N 332.472 5.116 30 20 EKED N#CCCCCC(=O)N(Cc1ccccc1Cl)c1ccc(F)cc1 593998882 QCJPZKSZNLHBMP-UHFFFAOYSA-N 344.817 5.096 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 604906951 GPILISZQTFCKTO-IAGOWNOFSA-N 338.451 5.221 30 20 EKED C=C(C)COc1cccc(NC(=O)[C@H](C)c2cccc(Cl)c2)c1 607821874 OASDUWSVTDDQGR-CQSZACIVSA-N 329.827 5.037 30 20 EKED Cc1oc(-c2ccsc2)nc1CSc1ccc(Cl)cc1C#N 610655135 QOWKLSJWTMIENN-UHFFFAOYSA-N 346.864 5.529 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)F)nc1 653760236 MQHFMUYFVONSAV-UHFFFAOYSA-N 330.378 5.123 30 20 EKED C=CCC1(NC(=O)Nc2c(C(C)C)cccc2C(C)C)CCOCC1 665133199 ZVAVQFARWLZIIA-UHFFFAOYSA-N 344.499 5.180 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2nccn2Cc2ccccc2)cc1 734097022 WNOKQGZGUFFKOT-SEYXRHQNSA-N 344.458 5.026 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](CCC)c2ccccn2)cc1 765734714 CQBYJULYZPDASI-JXFKEZNVSA-N 344.886 5.405 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815635854 KFBMQKXVLZJMRI-KBXCAEBGSA-N 328.843 5.131 30 20 EKED COc1ccc(C(=O)/C=C/c2ccc3ncccc3c2)c2ccccc12 916547049 ZLACLBQDRWNZNH-FMIVXFBMSA-N 339.394 5.293 30 20 EKED O=C(/C=C/c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2)cc1 1776131102 HRYAQRQTGNNULH-NTUHNPAUSA-N 346.357 5.087 30 20 EKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)CC(C)C)cc1 1776788436 FXZRCRWLBNWEEW-IBGZPJMESA-N 349.515 5.015 30 20 EKED Cc1ccc(Cl)cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 131862434 LIIDDDZDJCYADO-CYBMUJFWSA-N 344.867 5.295 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccc(F)c(F)c1 186449967 MWEOEHREDZLURA-SJCJKPOMSA-N 336.451 5.513 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1cccs1 191513959 SJQNBKPITPBMGK-HNNXBMFYSA-N 342.508 5.825 30 20 EKED Cc1ccc(-c2ccc(CNCc3ccc(C#N)cc3F)s2)cc1 237722956 OSPROBAOOYWEFY-UHFFFAOYSA-N 336.435 5.024 30 20 EKED C[C@@H](Nc1ccc(C#N)cc1C(F)(F)F)c1c(F)cccc1F 320139263 VNTQAWFVOZETEM-SECBINFHSA-N 326.268 5.028 30 20 EKED CC(O)=Nc1ccc(C)c(/C(O)=N/[C@@H]2CCCCC23CCCC3)c1 329599679 DPFZXDDWGAVTMO-GOSISDBHSA-N 328.456 5.411 30 20 EKED CC(C)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H](C)c1ccccc1 410894868 WGBXMCTZWFWOJA-RXVVDRJESA-N 334.463 5.072 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1ccc(Cl)c2cccnc12 482822323 AJFVQGDZYKGMKC-UHFFFAOYSA-N 342.870 5.097 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 512668545 VPCFNPZYGIOORK-NWDGAFQWSA-N 336.332 5.128 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc3ccccc3c2)o1 538404222 DEYGBJOTOKEDMW-QHCPKHFHSA-N 338.410 5.184 30 20 EKED C=CCC[C@@H](NCc1ccncc1OCc1ccccc1)c1ccco1 552317448 AVGOJLSEEKPXFX-HXUWFJFHSA-N 348.446 5.051 30 20 EKED C[C@H](NC(=O)CCCCCC#N)c1ccc(Oc2ccccc2)cc1 588155568 LJEKWXJUGMKAOM-KRWDZBQOSA-N 336.435 5.130 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)CCCCCC#N)c1 588759991 MWZSORJJHJCJDT-UHFFFAOYSA-N 340.854 5.728 30 20 EKED N#CCCCCCC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 588815905 FZZVAPQZBXZRFT-UHFFFAOYSA-N 342.826 5.545 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)s1 675644044 SRBNAUAFGAMNHQ-AWEZNQCLSA-N 334.444 5.084 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccsc3)s2)cc1 727973870 ATTITHVQYQFPQV-FPYGCLRLSA-N 341.457 5.085 30 20 EKED COCc1ccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)cc1 741843107 YJLOHZCFFMZNAB-OUKQBFOZSA-N 349.455 5.161 30 20 EKED O=C(/C=C/c1cn[nH]c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 751525586 XOKBZRDUJLSYSS-LZCJLJQNSA-N 348.349 5.053 30 20 EKED CC(/C=C/C(=O)c1ccc(OCC#N)cc1)=C\c1ccc(Cl)cc1 753714772 POTIPAUFODGPJH-IYCILVLZSA-N 337.806 5.085 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C3\CC[C@@H](C)C3)n2)cc1 753801721 LFAMEAMZVKYENQ-YLJPPSQVSA-N 336.460 5.041 30 20 EKED CC[C@@H](CC#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 762721896 FMCYNVVETBZSHA-LBPRGKRZSA-N 334.872 5.100 30 20 EKED Cc1nc(F)ccc1/C=C1\CCc2cc(SC(F)F)ccc2C1=O 782330114 XUUYJBDYBXDLBM-MDWZMJQESA-N 349.377 5.056 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792096524 PKPDTDQCUHGLBD-FFWXCITRSA-N 346.817 5.168 30 20 EKED Cc1nc(-c2cccnc2)sc1[C@H](C)Nc1ccc(CCC#N)cc1 903297319 DMQGDXCFWJPUDL-AWEZNQCLSA-N 348.475 5.143 30 20 EKED O=C(O)c1cc(NN=C2CCC[C@@H](C3CCCCC3)C2)ccc1F 1776064286 GURHTALOHYORJX-CQSZACIVSA-N 332.419 5.062 30 20 EKED O=C(/C=C\c1csc(C(=O)O)c1)c1ccc(-c2ccccc2)cc1 1776131059 GEEGBRJSWJQRPX-WDZFZDKYSA-N 334.396 5.009 30 20 EKED COc1ccc(Cl)cc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 90665060 KNAGMYFFAVFPIX-RDTXWAMCSA-N 328.843 5.044 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](CC)c2c(C)noc2C)cc1 90886209 VTYFCMTXSSYSBJ-ACJLOTCBSA-N 348.874 5.225 30 20 EKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(Cl)c1Cl 117951264 RXZMAGFJBWDDML-OLZOCXBDSA-N 349.261 5.135 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nc(C)cs1 191458415 GJKAAPQOULKKDD-AWEZNQCLSA-N 343.496 5.186 30 20 EKED CC[C@@H](C)c1ccc([C@H](Nc2ccc(C#N)nn2)c2cccs2)cc1 301931043 OORPVSAIARSOKE-VLIAUNLRSA-N 348.475 5.125 30 20 EKED Cc1nnc(-c2cccc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)c2)o1 329168468 JCBMPDLEEMCBRZ-JCGIZDLHSA-N 339.439 5.240 30 20 EKED C[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1F 426288408 JEKMYPYXEVCQQW-ZUZCIYMTSA-N 334.847 5.140 30 20 EKED CC(C)c1nc2ccc(NC(=O)[C@H](C)c3cccc(C#N)c3)cc2s1 461927148 HHPJDYPZXGUYMW-CYBMUJFWSA-N 349.459 5.034 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)C2CCC(c3ccccc3)CC2)cc1 463415178 PGLKBMQTFWRIHV-UHFFFAOYSA-N 346.474 5.400 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 466641599 KNWXVFODJLEKMP-HUUCEWRRSA-N 342.508 5.206 30 20 EKED Cc1nc(C(F)(F)F)c(CS[C@@H](C)c2ccc(C#N)cc2)s1 546754010 AWKIHZFSWIKYAS-VIFPVBQESA-N 342.411 5.336 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 553305229 KIOMBQXVPVVNGU-DJJJIMSYSA-N 344.380 5.305 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)c(C)c1 555336943 MALNHVVFJXEJON-ZFWWWQNUSA-N 345.512 5.042 30 20 EKED CC(C)c1ccoc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 555868964 IILAIKLRHGLHMH-UHFFFAOYSA-N 346.386 5.319 30 20 EKED N#Cc1ccc(CNCc2ccc3sccc3c2)c(C(F)(F)F)c1 564406959 ANSOGUIMCKSGNV-UHFFFAOYSA-N 346.377 5.082 30 20 EKED COc1ccc(CC[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 568891746 XYAXRDFXKOUFNN-GCJKJVERSA-N 336.479 5.041 30 20 EKED Cc1c(C(=O)Nc2cccc(C(F)F)c2)sc2ccc(C#N)cc12 576006702 NCWGRGLRITVHAH-UHFFFAOYSA-N 342.370 5.271 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2occc2s1 682803901 YLEXSJONGJPNQX-UHFFFAOYSA-N 325.433 5.599 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1cnc(C(C)(C)C)s1)C2=O 736433360 DNWDCCGZGABRHV-JLHYYAGUSA-N 343.517 5.375 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccncc1 766018707 INHTUMZDNFNFQD-DYVFJYSZSA-N 334.435 5.364 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1ccccc1 773118177 YRAQNGDXNJCXNS-FDDCHVKYSA-N 326.443 5.164 30 20 EKED CC(/C=C/C(=O)c1ccnc(F)c1)=C\c1cccc(C(F)(F)F)c1 806574404 ONXAUAHCQHPINH-HFACTSAFSA-N 335.300 5.082 30 20 EKED CCCCCCCCCCNC(=O)Nc1ccc2c(c1)COC(=O)N2 861469309 IOGUKWJNDDNINO-UHFFFAOYSA-N 347.459 5.011 30 20 EKED CC[C@H](C)Cc1c(C)sc2nc(S[C@H](C)CCC#N)nc(O)c12 1643608386 LNMQARPAWDOUFR-WDEREUQCSA-N 349.525 5.078 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)C(C)(C)C)c1 1776788100 RUFHAYOVBJFZJP-IBGZPJMESA-N 349.515 5.015 30 20 EKED Cc1cc(CN[C@H](CCC#N)c2ccccc2)cc(C)c1OC(F)F 130446702 SUSMHIFONXSNEJ-GOSISDBHSA-N 344.405 5.040 30 20 EKED COc1ccc(CNc2cccc3ccccc23)cc1OCCCC#N 157713376 CCSSHBPUMPWTRN-UHFFFAOYSA-N 346.430 5.143 30 20 EKED CC(C)Oc1ccc(NCc2ccc(O[C@H](C)C#N)cc2)cc1Cl 178802984 QCXJZEMGXDBTKI-CQSZACIVSA-N 344.842 5.030 30 20 EKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2o1 191863559 AFSOUWVUUPOOQR-AWEZNQCLSA-N 347.418 5.117 30 20 EKED N#CCCCCNCc1cccc(Oc2cccc(C(F)(F)F)c2)c1 237850857 KGFPDLDRUOKZMJ-UHFFFAOYSA-N 348.368 5.281 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)c(OC)c1 276500328 WWQZNTWLENVTSY-UHFFFAOYSA-N 337.463 5.037 30 20 EKED Cc1ccc(Cl)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 429850050 UDDSRMSOWQQTEY-UHFFFAOYSA-N 340.835 5.296 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430590331 KPNLAVBAYWKSBG-HNNXBMFYSA-N 340.492 5.228 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(Cl)cc1F)c1ccccc1 432503437 FKZZINFBYPVBSM-INIZCTEOSA-N 345.805 5.036 30 20 EKED CC(C)(C#N)CCCCSCc1ccc(C#N)cc1OC(F)F 435892079 JDYDMDJWKVJFHJ-UHFFFAOYSA-N 338.423 5.113 30 20 EKED C=CCC[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 438850571 HVHHULSGPHYCEL-RTWAWAEBSA-N 347.462 5.038 30 20 EKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccccc1OC(F)F 447527721 GZVCFFLOBQJBSI-MSOLQXFVSA-N 344.405 5.352 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 474071070 CECRJYUFBFBYCF-ZDUSSCGKSA-N 333.218 5.019 30 20 EKED CC(C)(C#N)CCCCN[C@H](c1c[nH]c2ccccc12)C(F)(F)F 513158433 HRBGGWUDBUCMCW-MRXNPFEDSA-N 337.389 5.081 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC(CC#N)CC1 541969717 JQXCQQQKQVQZJQ-UHFFFAOYSA-N 327.472 5.091 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1cc(C#N)ccc1F 609237890 BWVKYTRQQIMALH-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CC(C)CN(C(=O)CC/C=C/c1ccccc1)c1ccc(C#N)cc1 609967765 FEXDNQITNBCDGT-UXBLZVDNSA-N 332.447 5.041 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc2ccccc2c1 610078492 PRGOYZXFXXWNMX-INIZCTEOSA-N 332.472 5.704 30 20 EKED CC[C@@H](NCc1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 610812769 PHURHTUVLNEQOS-QGZVFWFLSA-N 337.225 5.245 30 20 EKED CCOc1ccccc1[C@@H](CC)N[C@@H]1CCCc2cc(C#N)ccc21 611392382 PQYMZKGPLLYDTP-NHCUHLMSSA-N 334.463 5.075 30 20 EKED CC(C)C[C@@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727664625 XLNMAXHSWJPMAA-UTKZUKDTSA-N 334.463 5.353 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cn1 732713788 HDHFQZILKWSQIM-BQYQJAHWSA-N 340.423 5.228 30 20 EKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)(C)C 734706673 QXQSQFNBARFOON-SMDDNHRTSA-N 346.883 5.322 30 20 EKED CCCCCCCCC(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1 742957857 AMBQBTASKCUCFH-IRLDBZIGSA-N 345.527 5.330 30 20 EKED CCSc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)cc1 755603180 CMDWCAMUGRZLIM-JYRVWZFOSA-N 346.455 5.152 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1ccc(-c2cccs2)cc1 773030880 WTYBHHBQAIFRQZ-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 916846187 KJISPIHQAZTLRZ-QGZVFWFLSA-N 348.471 5.229 30 20 EKED O=C(/C=C/c1cccc2c1OCCCO2)c1cc(Cl)ccc1Cl 917143146 CQIOBIMQSLAFBP-VMPITWQZSA-N 349.213 5.051 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1ccccc1C(=O)O 1776031371 CPWKLHMGVYALMK-PBHICJAKSA-N 330.472 5.415 30 20 EKED CCCCCCCCC[C@@H](C)CC=NNc1cccc(C(=O)O)c1C 1776087944 GNMJNSZRFJYWPE-QGZVFWFLSA-N 346.515 6.258 30 20 EKED Cc1ccc(C)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c1 1776133415 WJHBMOACOBPHCM-PKNBQFBNSA-N 346.382 5.158 30 20 EKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc2oc(C(=O)O)cc2c1 1777559853 MOWFEOIHGSHFFI-SOFGYWHQSA-N 346.338 5.082 30 20 EKED C=CCOc1cccc(NC(=O)c2ccc(SC(C)C)cc2)c1 65749530 IVLYDSRRVHAOFA-UHFFFAOYSA-N 327.449 5.004 30 20 EKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 151709785 GUDACISLQGKTDJ-UTKZUKDTSA-N 347.462 5.066 30 20 EKED CC(C)(C#N)CCC[S@](=O)[C@@H]1CCc2c(Cl)cc(Cl)cc21 153768776 NBEMHKCNYUTKHV-QVKFZJNVSA-N 344.307 5.059 30 20 EKED C[C@H](Nc1cccc(SC(F)F)c1)c1ccc(OCC#N)cc1 183117694 ZHMWCNBNGASASE-LBPRGKRZSA-N 334.391 5.077 30 20 EKED C[C@H](/N=C(/O)C1CCCCC1)/C(O)=N/[C@H](c1cccs1)C1CC1 328940017 SFSQBMNFZJUYAI-LRDDRELGSA-N 334.485 5.081 30 20 EKED OC(=Nc1cccc(C/N=C(/O)C[C@@H]2C[C@H]3CC[C@H]2C3)c1)C1CCC1 329537075 MCROUURRENKPJW-WBAXXEDZSA-N 340.467 5.358 30 20 EKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccc(C#N)cc2Cl)c1 426122401 IDPOXLAYQUHYBX-AWEZNQCLSA-N 341.842 5.053 30 20 EKED CO[C@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 433028464 ZOFZIVQZSIBNEC-VQTJNVASSA-N 342.870 5.052 30 20 EKED C=CCC[C@@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1ccccc1 435092959 AXIMGPDSXYKIQS-MOPGFXCFSA-N 340.492 5.302 30 20 EKED Cc1c(-c2noc(-c3cccc(SCC#N)c3)n2)oc2ccccc12 445507564 VRIWCXUWHPMYBJ-UHFFFAOYSA-N 347.399 5.074 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(C)c(O)cc1C 446265907 HXSZWXMRUQIQEQ-UHFFFAOYSA-N 338.451 5.505 30 20 EKED Cc1ccc([C@@H](Nc2cc(Cl)ccc2C#N)c2ccccn2)cc1 480575379 FWKIRTWXWMADOM-HXUWFJFHSA-N 333.822 5.117 30 20 EKED C=CCCC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 522571170 LQFIQLDPRYRHCE-UHFFFAOYSA-N 335.325 5.402 30 20 EKED C=CCCC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 524386822 YBFGIRMAMOZCFT-UHFFFAOYSA-N 349.352 5.189 30 20 EKED C=CCC[C@@H](NCc1coc(-c2cccc(F)c2)n1)c1ccccc1 537158589 IQNGMZBZYRVOHG-HXUWFJFHSA-N 336.410 5.278 30 20 EKED C=CCOc1ccccc1CNC(=O)Nc1c(C)cccc1C(C)C 601082521 YZDDVUXKXYTVPI-UHFFFAOYSA-N 338.451 5.005 30 20 EKED N#C[C@@H](C(=O)c1cccc(Cl)c1)c1nc2cc(Cl)ccc2s1 613403102 MCKCAJGGVDABEE-LBPRGKRZSA-N 347.226 5.093 30 20 EKED Cc1nc(/C=C/c2cccs2)sc1C(=O)/C=C/c1cccs1 726847477 BARTVXASIDYNPL-CDJQDVQCSA-N 343.498 5.641 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccccc3)s2)cc1 727974081 FMQMRDICWZZWKT-JYRVWZFOSA-N 335.428 5.023 30 20 EKED N#CC1(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)CCC1 736006986 XPGDDZAVYITEOB-UHFFFAOYSA-N 345.229 5.293 30 20 EKED CCc1ccc(C(=O)/C=C/c2ccc(Br)s2)s1 747200786 JSBFONZESHGFFB-ZZXKWVIFSA-N 327.268 5.031 30 20 EKED Oc1ccc2ccccc2c1/C=N\[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 753996977 ZNOCLJUFCKMQMM-CZRJJODGSA-N 349.405 5.024 30 20 EKED CCC(CC)[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 762033787 DXYLKIKSJTUSTL-CJNGLKHVSA-N 326.465 5.059 30 20 EKED COc1c(Cl)cc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1Cl 777671776 PIJXZLREUKRRBR-SECBINFHSA-N 339.197 5.186 30 20 EKED C=C(C)[C@@H](N[C@H](CC)c1ccc(C)cc1O)c1ccc(F)c(F)c1 794815825 PNIMYKGIIYPKSF-UYAOXDASSA-N 331.406 5.337 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797572183 ZWCZFRLAJWQKIO-LSDHHAIUSA-N 332.513 5.223 30 20 EKED CC[C@@H](C#N)[C@H](OC(=O)c1cscc1C(F)F)c1cccs1 893272152 JGYFWFXJRRVYRO-ZANVPECISA-N 341.404 5.195 30 20 EKED CC(=NNc1nc2ccccc2s1)c1sc(C(C)(C)C)nc1C 915110052 LZFYUPDHIVBDLV-UHFFFAOYSA-N 344.509 5.195 30 20 EKED CC(CCc1ccc(O)cc1)=NNc1ccnc2cc(Cl)ccc12 916269296 DYOKUPOPRLDYRA-UHFFFAOYSA-N 339.826 5.014 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cccc2ccccc12 920062883 BAJGGRASXMALCK-HJWRWDBZSA-N 347.464 5.921 30 20 EKED C=CCN(CC1CCCCC1)[C@@H](C(=O)O)c1cccc2ccccc12 1776177468 DEDJIRFPHOEYBH-OAQYLSRUSA-N 337.463 5.034 30 20 EKED Cc1cc(C)c(C#N)c(SCc2ccccc2Oc2cccnc2)n1 63436506 MDTBCERBIGUAOX-UHFFFAOYSA-N 347.443 5.050 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)s1 66802017 KDCAVMRYZBZAKV-LLVKDONJSA-N 330.478 5.012 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 417361604 JDGVUFJCVSBHQR-SCLBCKFNSA-N 339.508 5.175 30 20 EKED C[C@@H]1CC[C@H](N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 429748837 CADUTCQGGIMVDR-QAPCUYQASA-N 349.434 5.003 30 20 EKED C[C@H](N[C@@H]1CCCc2occc21)c1ccc(-c2cccc(C#N)c2)cc1 447593275 QUQBDWVBROWMKT-KSFYIVLOSA-N 342.442 5.546 30 20 EKED CCC(CC)[C@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1cccs1 463454549 AUQONLOXHQUMCQ-KUHUBIRLSA-N 340.492 5.017 30 20 EKED CC(C)(C)c1nc2ccc(NC(=O)C3(C#N)CCCCC3)cc2s1 464152663 PVXANFZMNYXUKY-UHFFFAOYSA-N 341.480 5.006 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc2[nH]ccc2cc1C 470252942 YKOYKYOIQHZKKT-UHFFFAOYSA-N 333.435 5.087 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC(C)C)C1CC1 475543704 FNSZMFMWAXLQIS-UHFFFAOYSA-N 328.500 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCc2ccccc21 475573313 RVUJCBYFBKMELI-HXUWFJFHSA-N 334.463 5.348 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc2ccccc2c1 476141538 IERDUGMKVCMAOR-UHFFFAOYSA-N 343.470 5.873 30 20 EKED N#Cc1cc(NCc2cnc(-c3cccs3)s2)ccc1Cl 508642444 XGRLASQELVYYND-UHFFFAOYSA-N 331.853 5.009 30 20 EKED CCN(C(=O)c1cc2sccc2s1)[C@@H](C)c1ccc(C#N)cc1 517420098 AAONIRUTQNAIES-LBPRGKRZSA-N 340.473 5.058 30 20 EKED C=CCCC(=O)N(Cc1ccccc1)c1nc2c(C)cccc2s1 523956250 HIIHSOMZYIDQHG-UHFFFAOYSA-N 336.460 5.104 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2cccnc2)cc1 539609763 LVEIDEAZTTVSBH-HZPDHXFCSA-N 345.421 5.171 30 20 EKED C=CCC[C@H](C)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 542668681 QAXSEDHZYJTPNY-IBGZPJMESA-N 345.490 5.043 30 20 EKED N#CCCC[C@@H](N[C@H](CCc1ccccc1)C(F)F)c1ccccc1 556203267 IXIUWIZXEHZDOT-WOJBJXKFSA-N 342.433 5.278 30 20 EKED N#CCCC[C@@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1 575079081 JTZPHZCVXJBCSB-GOSISDBHSA-N 333.262 5.518 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(C(F)F)ccc2Cl)cc1 582629369 DAJXAKCXTIPULN-UHFFFAOYSA-N 348.780 5.331 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1 591504544 MXDYGPARSSUPSL-YLJYHZDGSA-N 344.499 5.212 30 20 EKED CC(C)c1ccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c(C(C)C)c1 610318629 CQLQHLAALLEWTG-MRXNPFEDSA-N 349.478 5.688 30 20 EKED Cc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1-c1ncco1 611483251 SWYMEZQMXCTAEI-FQEVSTJZSA-N 329.403 5.011 30 20 EKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 614184081 ZKGCNUWUYGYFMC-HNNXBMFYSA-N 332.900 5.444 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCCC2)cc1)c1ccc2ccccc2n1 685782618 VHLVKRQNRPJLFY-HXUWFJFHSA-N 340.426 5.382 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cc1 728695578 ZLXYXBRWTFCELK-OXFRDRNISA-N 346.213 5.180 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(OCc2ccccc2)cc1 728695947 ISTIWCBIFSPOQQ-JLHYYAGUSA-N 349.817 5.210 30 20 EKED O=C(/C=C\c1cc(C(F)(F)F)ccc1F)c1ccc(F)cc1F 733206701 PGLSNPPPJDHBQB-BHQIHCQQSA-N 330.227 5.019 30 20 EKED COc1ccccc1-c1ccc(C=NN[C@@H](C)c2ccccc2)cc1 741462161 ZBGNABFABHXEQK-KRWDZBQOSA-N 330.431 5.047 30 20 EKED N#Cc1cccc(/C=C(\Cl)c2nc3cc(C(F)(F)F)ccc3o2)c1 764431754 FFAAPEBWBCRWER-QPEQYQDCSA-N 348.711 5.455 30 20 EKED N#C[C@@H](C(=O)C1=CCCCCC1)c1nc2cc(Cl)ccc2s1 773984187 SCHIFKUQLJEMIY-ZDUSSCGKSA-N 330.840 5.016 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N 780148937 NBVYLMFZOAUWSH-OXJNMPFZSA-N 330.472 5.303 30 20 EKED COc1ccc(/C=C/C(=O)c2c(F)cccc2Cl)cc1Cl 809159207 KILRNVSPTNBYNV-FNORWQNLSA-N 325.166 5.037 30 20 EKED CCC[C@@H](CC(C)C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 835074376 RIJMSXJZWMLFFO-KBPBESRZSA-N 347.409 5.070 30 20 EKED CCSc1cccc(NCc2cc(C#N)ccc2Br)c1 864011598 LFPDGRBCIPYCPR-UHFFFAOYSA-N 347.281 5.045 30 20 EKED Fc1ccccc1NC(=S)Nc1cccc(C#Cc2ccccc2)c1 909548005 QNYHCYJBVBESTG-UHFFFAOYSA-N 346.430 5.034 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc2ccccc2c1 63275078 HIZBDOLLVHBHTH-BQYQJAHWSA-N 347.464 5.921 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cn1ccc(=S)c2ccccc21 68614276 OLAIFLFKXRBZGV-UHFFFAOYSA-N 347.487 5.112 30 20 EKED N#CCC[C@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccccc1 90664648 AVCJMSBSBKHJCE-ZWKOTPCHSA-N 342.895 5.512 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cccc3ccccc23)c1 113952575 IAUALLHGPYMQJR-YLJYHZDGSA-N 344.458 5.372 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccccc1S[C@H](C)CC#N 283900166 JYDQZIVBDKOEMX-CYBMUJFWSA-N 328.437 5.050 30 20 EKED Cc1cccc([C@H](Nc2ccc(Cl)cc2C#N)c2ccccn2)c1 301890606 NXEINPHGWQBKRL-FQEVSTJZSA-N 333.822 5.117 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)S[C@@H](C)c3ccc(C#N)cc3)o2)cc1 419425800 PSQAGVKDIDDDIF-LSDHHAIUSA-N 349.459 5.472 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2ccc(C#N)cc2)o1 477896189 MIEOQYNQOYRAPW-UHFFFAOYSA-N 336.778 5.032 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(Oc2ccncc2)cc1)c1ccccc1 488714946 ORDDSUYMWXTERW-OAQYLSRUSA-N 344.414 5.172 30 20 EKED N#Cc1ccc(N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1 507027242 LINZXQKNSFIKKC-NRFANRHFSA-N 326.399 5.161 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C(CC)CC)[C@H]1CCCc2cccnc21 511301935 BZITUJGIARTOTQ-APWZRJJASA-N 328.500 5.079 30 20 EKED Cc1nc(C)c(C#N)c(S[C@H](C)c2ccc(Cl)c(Cl)c2)n1 515851379 YFENRPFHOYQWOF-SECBINFHSA-N 338.263 5.125 30 20 EKED N#C[C@@H](C(=O)c1cscc1-c1ccccc1)c1nc2ccccc2o1 519847411 JIXOAJBCWHRKHS-AWEZNQCLSA-N 344.395 5.046 30 20 EKED CC(C)Sc1c(Cl)cccc1NC(=O)c1sccc1C#N 524982825 BJLPQBBCUUZSAD-UHFFFAOYSA-N 336.869 5.026 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(F)ccc1Cl 526081810 BXJHOYRFHHMKNW-UHFFFAOYSA-N 332.806 5.089 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2ccccc2)o1 551805922 ZYGVOJFWHNMKMD-INIZCTEOSA-N 328.415 5.158 30 20 EKED Cc1cc(F)ccc1-c1ccc(CNC2(c3cccc(C#N)c3)CC2)o1 560072313 UFLQNDSKTPBOMY-UHFFFAOYSA-N 346.405 5.045 30 20 EKED CCSc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 561129977 DPIJIKYHQOQEBV-VFNWGFHPSA-N 336.504 5.398 30 20 EKED C[C@@H](Nc1ccccc1COCc1ccccc1)c1ccc(C#N)cc1 609824981 FDQZIRVYPJPXES-GOSISDBHSA-N 342.442 5.448 30 20 EKED FC(F)(F)CCCCNc1ccc(C(F)(F)C(F)(F)F)cc1 676868003 XNMAUBDEOQEDMA-UHFFFAOYSA-N 335.238 5.485 30 20 EKED N#CCOc1ccc(CN2CCC[C@@H]2c2cccc3ccccc23)cc1 731212196 YKRGWKAEKAZKIG-HSZRJFAPSA-N 342.442 5.079 30 20 EKED C[C@@H](c1ccccc1Cl)N(C)Cc1cc(Cl)ccc1OCC#N 735308333 HUKOCLPTWNGOGX-ZDUSSCGKSA-N 349.261 5.089 30 20 EKED O=C1/C(=C\c2csc(-c3cccs3)n2)Cc2cc(Cl)ccc21 742438206 TZHDFZHMSBKYPI-FLIBITNWSA-N 343.860 5.347 30 20 EKED O=C(/C=C/c1ccc(Cl)nc1)c1ccc(Cl)c(C(F)(F)F)c1 754689511 HVLKQTNVXZCFBW-ORCRQEGFSA-N 346.135 5.303 30 20 EKED Cc1ccoc1C(=O)/C=C\c1ccc(/C=C/C(=O)c2occc2C)cc1 769784487 XDJVGVPSIVCUDN-FKJILZIQSA-N 346.382 5.282 30 20 EKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc(-c2ccncc2)cc1 794941607 SGZRGTRRRWDVER-XCVCLJGOSA-N 335.353 5.582 30 20 EKED CC(C)c1ccccc1NC(=O)C[C@@H](C)Nc1ccc(CCC#N)cc1 903298422 SULCFALHTVCEPJ-QGZVFWFLSA-N 349.478 5.095 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 106141841 RCLRRAUWDVRJRS-KRWDZBQOSA-N 342.483 5.284 30 20 EKED N#CCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 301786371 LXXVXJZPYVYGBH-OAHLLOKOSA-N 349.312 5.071 30 20 EKED CC(C)Oc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 326570279 ASIMVVGAFAZMOT-KRWDZBQOSA-N 338.451 5.329 30 20 EKED CC(O)=Nc1cccc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329024502 UWSFMHPYTRXGPH-JKTDJZPLSA-N 342.483 5.919 30 20 EKED Cc1ccc(Cl)cc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330001735 YGWPHHDUJRLYRC-UHFFFAOYSA-N 334.847 5.162 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(SC)cc1 471185953 LAMCSRDCNTYIHH-UHFFFAOYSA-N 326.465 5.019 30 20 EKED CC[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)s1 476052324 OUAMGCLLITWABX-LSDHHAIUSA-N 346.883 5.056 30 20 EKED CC(C)[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 482414876 NIBJDMRZTRMMML-QFIPXVFZSA-N 348.490 5.125 30 20 EKED C=CCN(C(=O)c1sc2cccc(F)c2c1C)c1ccccc1 484223062 SNZLPSYOYAXNEC-UHFFFAOYSA-N 325.408 5.182 30 20 EKED CC[C@H](CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 504329828 VONNMRBUPUPUQS-PKOBYXMFSA-N 334.463 5.052 30 20 EKED Cc1c(C#N)cccc1C(=O)Nc1c(F)cccc1Oc1ccccc1 509524377 DSEPDZQXQILZJA-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(O[C@H](C)CC)c1 513547856 GVFFXBLDEQGNMR-OAHLLOKOSA-N 344.480 5.146 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1cc(Cl)cc2cccnc12 521194973 HOLGMVCTMDKCAK-UHFFFAOYSA-N 349.865 5.170 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCC1CCCCC1 521327182 VDRBMMWCTOOJDI-INIZCTEOSA-N 344.524 5.770 30 20 EKED C=CCC[C@@H](NC1CCSCC1)c1ccc(C(F)(F)F)cc1 539051308 DYTIZVYTIZMGER-MRXNPFEDSA-N 329.431 5.198 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 553398216 PPTJOSPZVLJVJD-OPAMFIHVSA-N 346.861 5.652 30 20 EKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(C4CCCC4)cc3)[nH]c12 685788299 KDFCOVZVIQPMJZ-SFHVURJKSA-N 343.430 5.019 30 20 EKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(SC(C)C)cc1 728429776 PLAJECWQPVDKIA-UHFFFAOYSA-N 342.468 5.006 30 20 EKED CCc1c(C(=O)/C=C/c2nccc3ccccc23)oc2ccccc12 740765427 ZFLPPEHCYJRGAH-VAWYXSNFSA-N 327.383 5.440 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccccc2Cl)s1 742433238 UMVJVGSQARQHAP-VOTSOKGWSA-N 345.876 5.730 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3scnc3C)s2)cc1 742434554 KSYRSPMQADXPAI-HJWRWDBZSA-N 340.473 5.088 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2=CCCCCC2)cc1 775786590 ZBARYHLCQKNGDT-OAQYLSRUSA-N 330.431 5.171 30 20 EKED C[C@@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1ccc(C#N)cc1 782783916 QUGCMCYSHQXZQS-GFCCVEGCSA-N 330.378 5.187 30 20 EKED N#CCCSc1ccccc1NC(=O)/C(F)=C\C1CCCCC1 798245849 QPCHFHLFSCHVNX-FYWRMAATSA-N 332.444 5.065 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)oc2c(Cl)cccc12 15568333 BGJNBHKQGBLSHF-UHFFFAOYSA-N 345.185 5.172 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC1=CCCCC1 66955112 WXDDLHBSVIBOBZ-OAHLLOKOSA-N 343.496 5.093 30 20 EKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1cccc(O)c1 96792725 IQBREVGZOLXSTI-HJWRWDBZSA-N 341.819 5.065 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 131155098 VKAGENUEJISLLF-BLMSOEDDSA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(Cl)s1 189905564 NZRPKGBDQSPERX-UHFFFAOYSA-N 347.911 5.825 30 20 EKED OC(=Nc1scnc1C1CC1)c1cccc2c3c([nH]c12)CCCC3 328943663 UMGBIJUEIMMPBX-UHFFFAOYSA-N 337.448 5.017 30 20 EKED CC(O)=Nc1ccc(Cl)c(N/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@H]3C2)c1 329819752 XWBUSACQOPWQPA-MELADBBJSA-N 349.862 5.243 30 20 EKED N#CC[C@@H](CC(=O)N[C@@H](CC1CCC1)c1ccccc1)c1ccccc1 356650082 HPWJIMDUYBXYCL-VXKWHMMOSA-N 346.474 5.122 30 20 EKED N#CCCCC(=O)Nc1ccc(Cl)cc1-c1cccc2ccccc12 464522227 IKSHXWJHXFTAQK-UHFFFAOYSA-N 348.833 5.793 30 20 EKED C=CC[C@@H](C(=O)N(CC)Cc1ccc(Cl)s1)c1ccccc1 487646614 BAAHKDHOGAZXCR-MRXNPFEDSA-N 333.884 5.110 30 20 EKED N#CCCCCNC(c1ccccc1Cl)c1ccccc1Cl 491013265 ZIICUZMNNTUIAR-UHFFFAOYSA-N 333.262 5.366 30 20 EKED N#CCCCOc1ccc(-c2nc3ccccc3s2)cc1Cl 508596380 BZKHXOCVNUXPSO-UHFFFAOYSA-N 328.824 5.299 30 20 EKED CCN(C(=O)c1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 509589310 VYKNYUDEZQAHBU-GFCCVEGCSA-N 347.245 5.088 30 20 EKED CC(C)CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1 519987439 YBRVXKCSQQDSHW-UHFFFAOYSA-N 349.434 5.003 30 20 EKED Cc1ccc(Oc2ccccc2CNCc2ccc(C#N)s2)cc1 538404793 OXWSYOMSSPPXMC-UHFFFAOYSA-N 334.444 5.010 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCCc2c(Cl)sc(Cl)c21 554363887 RYVVCSMNUPBQNI-LLVKDONJSA-N 331.312 5.352 30 20 EKED C/C=C/c1ccc(NCc2ccc(OC)c(OCCCC#N)c2)cc1 584373174 BHAFIXWJOHTTAN-ZZXKWVIFSA-N 336.435 5.023 30 20 EKED C[C@@H](c1ccccc1Cl)N(Cc1ccc(C#N)cc1F)C1CC1 603934188 NCDFGTYRAJYPCN-ZDUSSCGKSA-N 328.818 5.076 30 20 EKED Cc1nc(-c2ccc(CNc3cccc(Cl)c3C#N)s2)cs1 610337583 IBQNVVBMRASTNI-UHFFFAOYSA-N 345.880 5.317 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(C)c3ccc(C#N)cc3)sc2c1 610982864 NBPZYDVEJISWMQ-UHFFFAOYSA-N 340.835 5.011 30 20 EKED Cc1ccc(-c2ncc(/C=C3\CCc4sccc4C3=O)s2)cc1 734304793 WPNPFVCONCHIQB-GXDHUFHOSA-N 337.469 5.393 30 20 EKED COc1ccc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cc1F 747003738 NFCRJPSSKAWCLP-QHHAFSJGSA-N 325.166 5.037 30 20 EKED C#CCCCCCC(=O)Nc1ccccc1-c1c(F)cccc1F 778141262 JEEWMHHRTSOMAJ-UHFFFAOYSA-N 327.374 5.154 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1ccc(F)cc1 789721310 ZOVFRXGBFNYWNK-JQIJEIRASA-N 337.438 5.720 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1cccs1 857611903 QFSCVLRBEOUFAI-FYWRMAATSA-N 325.477 5.642 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(C2CCCC2)c1 1776783835 PDIBPFATGNHAND-OAQYLSRUSA-N 345.527 5.638 30 20 EKED COc1ccccc1-c1ccc(CNc2ccc(CC#N)cc2)cc1 185148756 JEBBZMJZQOUVRX-UHFFFAOYSA-N 328.415 5.040 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccccn1 188058006 OZGZNDRPWCGQGD-OAHLLOKOSA-N 340.492 5.053 30 20 EKED O=C(/C=C\c1cccc(O)c1)c1ccc(Cl)c(Cl)c1Cl 211795002 FALLFSXVTMEEOL-DAXSKMNVSA-N 327.594 5.249 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2ccc(OC3CCCC3)c(Cl)c2)CCC1=O 328905569 AWIXTEPUYYDXPG-OLZOCXBDSA-N 349.858 5.255 30 20 EKED Cc1ccc2c(C(=O)N[C@H](CCCC#N)c3ccccc3)csc2c1 352179718 AYVCPKFSAQGLJE-LJQANCHMSA-N 348.471 5.375 30 20 EKED C[C@@H](SCC1(C#N)CCC1)c1ncc(-c2ccc(Cl)cc2)o1 419589993 WBBQAPIADHFBAK-GFCCVEGCSA-N 332.856 5.483 30 20 EKED C[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)c1ccc2ccccc2c1 439767268 JGRICZZAPJJWJO-ZDUSSCGKSA-N 346.455 5.004 30 20 EKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 445616606 QZXDEBJSKLVVAS-HNAYVOBHSA-N 335.513 5.053 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(S[C@H](C)CC)cc1C 488380207 ORPLOAXDIONXEC-CVEARBPZSA-N 332.513 5.458 30 20 EKED C[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1F 512637473 WEXIWBPEWXPRTG-DIFFPNOSSA-N 346.858 5.238 30 20 EKED CC(C)CC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518255118 GBBGCZKCSPYPNJ-LSDHHAIUSA-N 333.501 5.027 30 20 EKED CC(C)COc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 540148536 SASNIUDWLLJKDW-PGRDOPGGSA-N 336.479 5.417 30 20 EKED CCc1ncc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541256877 FHJURDUCUZFROC-OAHLLOKOSA-N 347.487 5.095 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccccc1SC1CCCC1 568055081 JFWYKLQNCQNNRX-UHFFFAOYSA-N 345.512 5.173 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 588308197 IFUHZCJLCQIKJO-SFHVURJKSA-N 346.883 5.081 30 20 EKED C[C@]1(Cc2cccc3ccccc23)CCCN1C(=O)CCCCCC#N 598457299 KTYKRETWMORYET-HSZRJFAPSA-N 348.490 5.237 30 20 EKED C=CC1CCN(C(=O)c2ccc(SCc3ccccc3)cc2)CC1 599687675 LWWFTBQJNNPUEH-UHFFFAOYSA-N 337.488 5.017 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(CCC(F)(F)F)cc1 611480972 PFQVQCDFEVODBN-IBGZPJMESA-N 344.380 5.543 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)c1cncc(F)c1 737446322 QIBQYQRIUFWNEF-FNORWQNLSA-N 343.810 5.499 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(C#N)cc2)cc1 741470477 RAVKSPCNYPUUCQ-XNTDXEJSSA-N 339.394 5.130 30 20 EKED CCC(CC)[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 762033791 DXYLKIKSJTUSTL-XJKSGUPXSA-N 326.465 5.059 30 20 EKED CC[C@H](C)c1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)cc1 764272615 NBCLDTDVQCAZMW-ZDUSSCGKSA-N 326.827 5.002 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(OCC(=C)Cl)cc1)c1ccncc1 766022533 WTQVTBSHQLVYRV-UZLBHIALSA-N 342.870 5.181 30 20 EKED COc1c(C)cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1Cl 796838787 ZLSUVKGIMPTENJ-BEFAXECRSA-N 342.870 5.353 30 20 EKED CCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211267 GZEUTGZOEPANHU-RHSMWYFYSA-N 340.389 5.273 30 20 EKED C=CCN(Cc1ccccc1F)C(=S)Nc1ccc(C(C)C)cc1 918162934 DKBVCPJJJWVZFY-UHFFFAOYSA-N 342.483 5.334 30 20 EKED O=C(/C=C\c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2)cc1 1776131103 HRYAQRQTGNNULH-QPEQYQDCSA-N 346.357 5.087 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)[C@H](C)CC#N 86284773 VOYGHCUFZYXLOM-OAHLLOKOSA-N 345.512 5.186 30 20 EKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)c1cc2ccccc2o1 98024880 NCIMYKBBWQPCEJ-HNNXBMFYSA-N 347.418 5.114 30 20 EKED CCCCCCCCC(=O)Nc1c(C)nn(-c2ccccc2)c1C 104984109 FQXVKZHSXZYMJB-UHFFFAOYSA-N 327.472 5.178 30 20 EKED Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1NC(=O)C(C)(C)C 174077477 MPIQEBLAEQEEHS-OAHLLOKOSA-N 335.451 5.024 30 20 EKED N#Cc1ccc(N2CCC[C@@H]2c2nc3ccccc3s2)cc1Cl 301236694 KRBPJWCSDJFCKI-MRXNPFEDSA-N 339.851 5.163 30 20 EKED N#Cc1cc(NCc2ccc(C(F)F)cc2)ccc1C(F)(F)F 302182019 FIZHUGDDCJIPOQ-UHFFFAOYSA-N 326.268 5.127 30 20 EKED Cc1sc(N=C(O)C2CC(C)(C)C2)nc1-c1c[nH]c2ncccc12 329179928 NOWLXXDISPGDSO-UHFFFAOYSA-N 340.452 5.019 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2nc3c(ccc4ccccc43)s2)CCC1=O 329386131 POCZWEMTWARQAO-DGCLKSJQSA-N 338.432 5.043 30 20 EKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1 329943143 DITQBWIANMDICC-MKQDKFQKSA-N 348.874 5.283 30 20 EKED C=CCCc1ccccc1NC(=O)c1sc2nccc(C)c2c1C 410345100 OOMVLTPBUBXSKW-UHFFFAOYSA-N 336.460 5.284 30 20 EKED C[C@@H](SCCCC1(C#N)CCOCC1)c1ccc2c(c1)CCC2 419581831 DNDSNEQRIBHLDF-MRXNPFEDSA-N 329.509 5.070 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(-c2ccccc2)cc1 426616484 WJWWSTAUBLVVSQ-UHFFFAOYSA-N 335.451 5.147 30 20 EKED Cc1ccc2c(C(=O)N(C)c3cc(Cl)ccc3C#N)csc2c1 483779018 SXYLXAFHUMWGHI-UHFFFAOYSA-N 340.835 5.011 30 20 EKED C=CCC[C@@H](NCc1ccc(CN2CCCCC2)cc1)c1ccco1 513762343 QPKDDTYPKDTWNZ-OAQYLSRUSA-N 338.495 5.063 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 524567229 KDESFBAFBRQVKC-SFTDATJTSA-N 347.483 5.220 30 20 EKED C[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)c(F)c1 537406840 JKZISSMKPYGEFP-DIFFPNOSSA-N 346.858 5.238 30 20 EKED Cc1cc(C#N)ccc1CNC1(c2cccc(C(F)(F)F)c2)CCC1 614406909 GDQBENKJVRBJSF-UHFFFAOYSA-N 344.380 5.055 30 20 EKED COc1ccc(Cl)cc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745989980 IUUURUDOBJSTKU-SOFGYWHQSA-N 349.817 5.307 30 20 EKED C=CCN(C(=O)Nc1cccc(COC(C)(C)CC)c1C)C(C)C 750626373 PBQIXGAMVWKAGJ-UHFFFAOYSA-N 332.488 5.129 30 20 EKED CSc1ccccc1[C@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 800010927 CPMFOZAYYRXZNW-DOTOQJQBSA-N 339.460 5.100 30 20 EKED CCc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccn2)s1 819843420 ZOQOTOZEQCRUSB-BENRWUELSA-N 349.455 5.181 30 20 EKED CCC1(C(=O)N(O)Cc2cccc3ccccc23)CCC(F)(F)CC1 901371308 RLCHSCWAWQOLLY-UHFFFAOYSA-N 347.405 5.163 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cc(Cl)sc1Cl 921266602 ZPTVWSOPVQQIIT-IWQZZHSRSA-N 333.623 5.310 30 20 EKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(CCC#N)cc1 932581492 OVDDIVVTOMFERZ-CQSZACIVSA-N 341.842 5.021 30 20 EKED CC(C)(C)[C@@H]1CCCC(=NNc2ccc(Cl)c(C(=O)O)c2)CC1 1776033562 ADXJABMFUPQHMW-GFCCVEGCSA-N 336.863 5.433 30 20 EKED CC(C)[C@H](NCc1cc(C#N)cs1)c1cccc(C(F)(F)F)c1 177694670 FCUGXJIYMGGEOB-INIZCTEOSA-N 338.398 5.125 30 20 EKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(SC)cc1 410246944 OVLSILRKMRXGMC-AWEZNQCLSA-N 343.517 5.178 30 20 EKED CC(C)c1cccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431467874 AWHBETHSPWROSU-NRFANRHFSA-N 349.478 5.044 30 20 EKED C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 467997478 BWDSDCQPCULZMQ-DJJJIMSYSA-N 346.471 5.037 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1cc(F)ccc1C#N 469159813 ZXGDXYGCYNWCGL-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C=CCC[C@H](NC(=O)Nc1ccc(-c2ncco2)cc1)c1ccccc1 501381078 JPAAIHNJCJBCDT-IBGZPJMESA-N 347.418 5.171 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCCC(C)(C)C1 535155221 AOJZOEMDZGZROD-CABCVRRESA-N 330.497 5.093 30 20 EKED N#Cc1cccc(CN[C@H](CCc2ccccc2)c2ccccc2)c1F 539277316 XIRYILLEBSDCLT-JOCHJYFZSA-N 344.433 5.161 30 20 EKED CCC(C)(C)OCc1cccc(NCc2ccc(CC#N)cc2)c1C 544086018 VAMPFPBVNAUYJQ-UHFFFAOYSA-N 336.479 5.378 30 20 EKED N#CCCC[C@H](NCc1ccc(Cl)cc1Cl)c1ccccc1 560565633 WPINHRIAUUNTIO-SFHVURJKSA-N 333.262 5.518 30 20 EKED Cc1cscc1-c1noc(-c2cn(CCCC#N)c3ccccc23)n1 572919988 JQBUSUHGQLEKPX-UHFFFAOYSA-N 348.431 5.032 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCC[C@@H]1C#N 602761042 UXHQLYUNFLOALB-CRAIPNDOSA-N 327.472 5.089 30 20 EKED CC(C)c1ccc(C[S@@](=O)CCCC(C)(C)C#N)c(C(C)C)c1 610482198 FLQQRTWPXQDSKN-QHCPKHFHSA-N 333.541 5.512 30 20 EKED COc1ccc([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)c2ccccc12 618807876 XVVRJGNZEZQNLP-NYHFZMIOSA-N 342.442 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COCc1ccc(C)cc1 622852090 SXAPTWHBUSFSOD-UHFFFAOYSA-N 337.463 5.002 30 20 EKED CCC(CC)(C(=O)OCCCCC#N)c1ccc(Cl)c(Cl)c1 729003062 ISLPARLRUYXJHF-UHFFFAOYSA-N 342.266 5.288 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccccc2F)s1 765008441 CLGDDKIGHAUXFG-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CCCOc1ccc(Cl)cc1NCc1ccc(O[C@@H](C)C#N)cc1 770527845 AXJRKDZTPASFHS-AWEZNQCLSA-N 344.842 5.032 30 20 EKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccnc1 771836815 FJTBZXWODMQOKY-ONEGZZNKSA-N 345.242 5.015 30 20 EKED 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C[C@H](N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 765330316 JROLNVFLMIEGCK-MEDUHNTESA-N 347.245 5.039 30 20 EKED Fc1ccc(/C=C/C=NOc2ccccc2C(F)(F)F)cc1F 794923920 SNWJKTUUVZLTMM-PAZVYRNFSA-N 327.252 5.062 30 20 EKED CC(C)CC(Cc1cccc(Cl)c1)=NNc1ccccc1C(=O)O 1776030192 OYIMHSIVZVBSSO-UHFFFAOYSA-N 344.842 5.095 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2c(F)cc(C(=O)O)cc2F)cc1 1776700071 UMTCXJAHBMKHLV-LAUAKBEESA-N 344.357 5.073 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)ccc1F 66800507 VKNWMISQXKSHGT-LLVKDONJSA-N 348.830 5.126 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 90665746 JMGSODLKEOHSLW-RDTXWAMCSA-N 332.369 5.401 30 20 EKED CC(C)(CCC#N)CN1CCc2sccc2[C@@H]1c1cccs1 121141426 FQKSQIKVAZRVDI-QGZVFWFLSA-N 330.522 5.087 30 20 EKED CC(C)(C)c1ccc(C(=O)Nc2ccc(CC#N)cc2Cl)s1 452644296 LLBYCXOVTGMERC-UHFFFAOYSA-N 332.856 5.017 30 20 EKED CCC[C@]1(C)CCCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458797814 GWWRYTAPQNOLTR-PZJWPPBQSA-N 341.499 5.033 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)C1 463237700 WYVGNRAHQRSSOK-YQYZPQCESA-N 336.401 5.013 30 20 EKED C=CCCCN(C)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473837313 QKAQCSLXRILTEQ-UHFFFAOYSA-N 337.341 5.004 30 20 EKED CC(C)CC(CC(C)C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 509623088 QDLCFKSIYRKZGD-UHFFFAOYSA-N 329.488 5.070 30 20 EKED CN(CC1CCCC1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519196075 XZCCXTHWAYWWSC-UHFFFAOYSA-N 349.434 5.004 30 20 EKED N#Cc1cccc(CNc2ccccc2COCc2ccccc2)c1F 544094834 DEIMRICEIKDWPU-UHFFFAOYSA-N 346.405 5.026 30 20 EKED CC(C)(CCC#N)CN[C@H](c1cccc(F)c1)c1cccc(Cl)c1 554364088 YLMSCRXYAHCSBA-IBGZPJMESA-N 344.861 5.488 30 20 EKED CC(C)COc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 556906876 DNUPQQLWKOVASI-JOCHJYFZSA-N 336.479 5.246 30 20 EKED Cc1nc(-c2ccc(NCc3ccc(C(C)(C)C#N)cc3)cc2)oc1C 594505159 PQIYAECSHCGGHD-UHFFFAOYSA-N 345.446 5.372 30 20 EKED C=C(C)COc1cc(CN[C@H](C)c2cccc(C)c2C)ccc1OC 604418235 NKBJONZOTRZBJB-GOSISDBHSA-N 339.479 5.118 30 20 EKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 606915883 FKUDFBJNKSSXTO-AWEZNQCLSA-N 342.405 5.154 30 20 EKED CCC[C@@H](C(=O)Nc1sc(C)c(CC)c1C#N)c1ccccc1 609033082 LFOMFFBOVBWKEM-MRXNPFEDSA-N 326.465 5.013 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc(C)c1O 734982023 VICFOPONPVXXPX-FPYGCLRLSA-N 334.387 5.220 30 20 EKED FC(F)(F)c1cccc(NN=Cc2ccccc2-c2ccccc2)n1 739420946 BGXQHWCAYBFSEN-UHFFFAOYSA-N 341.336 5.213 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1cccc(C(F)(F)F)c1 772800742 AWVLMUDOLOTSHK-HJWRWDBZSA-N 327.305 5.150 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(COC)c1)c1ccccc1 773074429 FYKFVXKBALFSIA-UWJYYQICSA-N 339.479 5.200 30 20 EKED CC(C)Oc1ccc(NCc2ccc(O[C@@H](C)C#N)cc2)c(Cl)c1 780583227 OAHVYHCITVVGRD-AWEZNQCLSA-N 344.842 5.030 30 20 EKED C=C(C)[C@@H](N[C@H](CC)c1ccc(F)cc1O)c1ccc(F)c(F)c1 796949255 PHMZTKGZQDEVQN-IEBWSBKVSA-N 335.369 5.168 30 20 EKED C[C@H](ON=CC1CC1)c1ncc(-c2ccc(Cl)cc2Cl)o1 853734316 ABLWDDAWBOTRBT-VIFPVBQESA-N 325.195 5.122 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1cccc(NC(C)=O)c1 918722277 ALHBMAUKXQXEOH-UHFFFAOYSA-N 349.544 5.024 30 20 EKED N#C[C@@H](C(=O)CC1=CCCCC1)c1nc2cc(Cl)ccc2s1 106985531 IRERFDZVBNNGFH-ZDUSSCGKSA-N 330.840 5.016 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C(C)C)c1C 188059587 NVCUILCPUAMTOP-UHFFFAOYSA-N 338.495 5.790 30 20 EKED CC(C)(C#N)CCCCN[C@@H](CC(F)(F)F)c1ccc(F)cc1 278661973 HUEMJBUXMOQPAV-HNNXBMFYSA-N 330.369 5.129 30 20 EKED C[C@H](N[C@H](CC(C)(C)C)c1ccccc1)c1ccc(OCC#N)cc1 392270328 LADIAKOBQZYVGC-LAUBAEHRSA-N 336.479 5.417 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@@H](CCCC#N)c1ccccc1 433032263 RGYSTOORWATLRY-NRFANRHFSA-N 331.463 5.013 30 20 EKED C=C[C@](C)(CC)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 467979771 MGTRZDGMOLOLSO-GOSISDBHSA-N 339.401 5.014 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1F 512614951 XTFAXCHVATUVER-OYHNWAKOSA-N 348.396 5.277 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)NCC(C)(C)CCC#N)c(C)c1 515354032 HSWKWLBWOGWTQA-HNNXBMFYSA-N 347.528 5.337 30 20 EKED CSc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 572924310 JOXXHOWEDVOZTD-UHFFFAOYSA-N 347.443 5.080 30 20 EKED CC(C)(C1=CCCCC1)c1noc(C[C@@H](CC#N)c2ccccc2)n1 577102310 RQLKAQVXSDHEJK-QGZVFWFLSA-N 335.451 5.088 30 20 EKED N#CCc1ccc(CN[C@H]2CCCSc3ccc(Cl)cc32)cc1 584590126 MIZLZPAEOCRAFW-SFHVURJKSA-N 342.895 5.123 30 20 EKED CC[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1S[C@H](C)CC#N 609438600 MFFANHVHYMOKHM-BZUAXINKSA-N 345.512 5.171 30 20 EKED C#Cc1cccc(NC(=S)N[C@H](c2ccc(Cl)cc2)C(C)C)c1 726452612 XIHWNVJHYWFDMZ-SFHVURJKSA-N 342.895 5.005 30 20 EKED O=C(/C=C\c1cnn2ccccc12)c1cc2c(ccc3ccccc32)o1 729643838 ITTJMFRRJREUSY-NTMALXAHSA-N 338.366 5.130 30 20 EKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744037576 YLLDGHVZPKPBEU-RDJZCZTQSA-N 340.492 5.593 30 20 EKED CCCCCCCC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1 744045607 KBTBNQJROOBVSP-UHFFFAOYSA-N 326.484 5.234 30 20 EKED Cc1ccc(-c2nc(CON=Cc3ccc(C(C)C)cc3)cs2)o1 744180148 NDBRTIWIESTDAB-UHFFFAOYSA-N 340.448 5.386 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc2cccc(OCC)c2o1)c1ccccc1 776170272 IZFVBUXJULXWAU-QFBILLFUSA-N 333.431 5.247 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1C 916847259 BFZDORPENJOTHK-IJDCCNJMSA-N 346.455 5.111 30 20 EKED CCCCCCCCCCC(=O)CCCCCCCCC(=O)O 2113930880 XGULYRJPOSBOQH-UHFFFAOYSA-N 326.521 6.292 30 20 EKED CC(C)(C)c1cnc(CNc2cccc(Oc3ccc(C#N)cc3)c2)o1 154876746 FUVJPVZFZQIXEM-UHFFFAOYSA-N 347.418 5.248 30 20 EKED C=C[C@H](CC(=O)Nc1ncccc1-c1ccccc1)c1ccccc1 181436274 FDMKFVRQAYQEPT-QGZVFWFLSA-N 328.415 5.047 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](CC)c1ccccc1 248173951 UOOFYGXFWZHPEK-MRXNPFEDSA-N 333.884 5.110 30 20 EKED C[C@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)cc1 311227855 YESSSAMMNHNGRQ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1C 328979270 CTYHNHLKOMUBBI-GVDBMIGSSA-N 328.456 5.797 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCCC1(C)C 467492053 KQISTZJVILDTIS-YOEHRIQHSA-N 345.512 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCCC[C@H]1C 475552544 WILLPOSRFONLCH-VQIMIIECSA-N 328.500 5.581 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(C)c1 505023798 OSMVYZIIRFMEFX-NRFANRHFSA-N 334.463 5.483 30 20 EKED N#CCc1ccc(C[S@](=O)c2ccc(C3CCCCC3)cc2)cc1 541268148 BOBDNWBICWFFPH-DEOSSOPVSA-N 337.488 5.108 30 20 EKED C[C@H](NCc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 542944301 JOHBQNNOEAOBBC-INIZCTEOSA-N 330.406 5.215 30 20 EKED C=CCCCC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 543297465 JYYMYWFJKMCIKS-GMAHTHKFSA-N 349.474 5.109 30 20 EKED C[C@H](NCc1ccc(C(C)(F)F)cc1)c1ccc(C#N)cc1Cl 559878766 VIZSQCZHWMHDEY-LBPRGKRZSA-N 334.797 5.174 30 20 EKED C[C@H]1CCCC[C@H]1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609436687 CTWGEKSPRFYZJE-XHSDSOJGSA-N 345.512 5.029 30 20 EKED Cc1ncccc1/C=C/C(=O)c1ccc(OCc2ccc(F)cc2)cc1 728787651 QSPUBFOEGVMKNB-MDWZMJQESA-N 347.389 5.004 30 20 EKED Cc1cc(/C=C\C(=O)c2ccc(F)cc2)ccc1Oc1cccnc1 732713854 MSYOPEZJFHYIEK-WMZJFQQLSA-N 333.362 5.218 30 20 EKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1ccc(F)cc1 735233373 UICFIYVZNUKZMZ-LBPRGKRZSA-N 335.831 5.376 30 20 EKED O=C(/C=C/c1sc2ccccc2c1Cl)c1ccc2c(c1)COC2 742435865 BERGMOVJUTVQFZ-BQYQJAHWSA-N 340.831 5.481 30 20 EKED CCCc1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1 743056752 LASVHOTYNWMHDZ-JYRVWZFOSA-N 344.414 5.118 30 20 EKED N#CCC[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1 747690007 CUZUUHTVHJHWAG-BTZNOAQDSA-N 333.218 5.163 30 20 EKED C=C[C@@H](CC(=O)Oc1ccccc1Oc1ccccn1)c1ccccc1 759295763 MSIYASUOEYIAOA-KRWDZBQOSA-N 345.398 5.139 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(Cl)c(Cl)c1 779712333 FERCNWWADANMGJ-NWDGAFQWSA-N 335.234 5.457 30 20 EKED Cc1nn(Cc2ccccc2)c(Cl)c1CSCCC(C)(C)C#N 790561241 ZKFSFSKZTKGAAE-UHFFFAOYSA-N 347.915 5.066 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)CCc1ccc(C#N)cc1 914733741 SGKRRCCWSYQJNS-UHFFFAOYSA-N 340.426 5.105 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1csc(C(F)(F)F)c1 925601013 JGDRKXQVKUPEIM-IUODEOHRSA-N 338.398 5.463 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(C(C)(C)C)cc1 1776033263 UZJVBRRSGHFJSS-UHFFFAOYSA-N 344.842 5.172 30 20 EKED C[C@@H](S[C@H](C)c1nc(Cc2ccccc2)no1)c1ccc(C#N)cc1 173829747 JBUALKHNTDVZJW-HUUCEWRRSA-N 349.459 5.087 30 20 EKED CC(C)Oc1cccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)c1 179680190 GWBCUSOCZVOGID-QGZVFWFLSA-N 336.479 5.126 30 20 EKED C=CCCS[C@@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 339089960 FBXLUAQMYGVIOW-JTQLQIEISA-N 332.450 5.027 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccccc1C(F)(F)F 439429513 HXCUMNVSZHHGCV-LLVKDONJSA-N 338.760 5.081 30 20 EKED C=CCOc1ccc(CN[C@@H](CC(F)(F)F)c2ccccc2C)cc1 444009109 IOZTUXRSAJBTCL-IBGZPJMESA-N 349.396 5.343 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCC#Cc1cccc(Cl)c1 448066311 DEIQKTGGTMSJDW-HNNXBMFYSA-N 340.879 5.198 30 20 EKED N#CCc1cccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 471444796 SDKFMTRSQFJTGP-UHFFFAOYSA-N 346.817 5.325 30 20 EKED C[C@@H](CCCC(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 480163085 VZMYPXDKAIVBNG-CABZTGNLSA-N 331.275 5.140 30 20 EKED N#Cc1ccc(CNCc2ccccc2-c2ccc(Cl)cc2)s1 538396728 WMTOOBQPQHMCTA-UHFFFAOYSA-N 338.863 5.230 30 20 EKED CC1CCC(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 609435161 UBZJCUSLPDPIJO-HWOWSKLDSA-N 345.512 5.029 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(-c2cccs2)cc1 610812846 WTJQTYZHEKXEPE-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C=CCN(C(=O)Nc1cccc(CO[C@H]2CCC[C@H](C)C2)c1)C(C)C 745277789 USJPPCJLCWCRFK-PXNSSMCTSA-N 344.499 5.210 30 20 EKED CC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 757196980 CDMRVEFLQJUEGS-HBGVWJBISA-N 347.462 5.042 30 20 EKED C=CCC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 761528340 RBZDYTGCBCZKPX-QGZVFWFLSA-N 330.815 5.045 30 20 EKED C[C@H](CCC1CC1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 769223597 SRHJNXTYSQRVFY-IERDGZPVSA-N 347.462 5.042 30 20 EKED C#Cc1cccc(NC(=S)Nc2cc(-c3ccc(C)o3)ccc2C)c1 795010969 BDUOHTFLGUMAFR-UHFFFAOYSA-N 346.455 5.354 30 20 EKED C=CCCC1(C(=O)O)CCN([C@H](C)c2cccc3ccccc23)CC1 1776167960 JTLPVWQXCPTRGV-QGZVFWFLSA-N 337.463 5.034 30 20 EKED CCN(C(=O)c1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 71868115 LOJWWBCPLIOCSM-LBPRGKRZSA-N 347.245 5.088 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 90664893 LWTVLGXPBXNPOU-KBXCAEBGSA-N 348.368 5.281 30 20 EKED Cc1cc2occ(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2cc1C 187522558 ILFVVIKNNOGRDN-AWEZNQCLSA-N 338.432 5.120 30 20 EKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2ccccc2)C2CC2)CC1)C1CC1 329983969 BRTBMEBOLZUKKC-CTWPCTMYSA-N 340.467 5.020 30 20 EKED CC[C@H](C)c1ccc([C@H](/N=C(/O)N2CCC(C#N)CC2)C(C)C)cc1 330536402 PVGMOFOHHFPOGU-OXJNMPFZSA-N 341.499 5.047 30 20 EKED N#CCCC[C@@H](NC(=O)c1csc2ccccc12)c1ccccc1 352207284 VXYCMVWLYWZDMB-GOSISDBHSA-N 334.444 5.066 30 20 EKED N#CCCC[C@H](NCCSc1ccc(Cl)cc1)c1ccccc1 433017476 CIDZFMWHFFYUEX-IBGZPJMESA-N 344.911 5.457 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(C)C)c(C)c1 438407006 GUIHJPWAWQZCEA-UHFFFAOYSA-N 344.480 5.064 30 20 EKED Cc1ccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 440785547 QZTRRSDVHOAPGD-UHFFFAOYSA-N 349.415 5.365 30 20 EKED CC[C@H](N[C@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 447579357 KHAPLQFJDCTCIC-LEWJYISDSA-N 346.499 5.644 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(Cl)c1F 464484537 SKPJASNCXRYQHU-UHFFFAOYSA-N 345.845 5.512 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc2ccccc2[nH]1 475577435 DRTOSXXXXGIZCG-UHFFFAOYSA-N 347.462 5.342 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 520135836 QQAXPQWGUMUQPO-INIZCTEOSA-N 349.434 5.004 30 20 EKED C=CCCOCCCCC(=O)N1CCCCC[C@@H]1c1ccc(CC)o1 539402304 GGUNTOLSCUIEDG-LJQANCHMSA-N 347.499 5.049 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(Oc2cccnc2)cc1 570719232 LYFNKQJPSFNPSA-KRWDZBQOSA-N 337.467 5.245 30 20 EKED Cc1ccccc1N(C(=O)CCCCC#N)c1nc2ccccc2s1 593941812 NDRDRMFDMKSPTE-UHFFFAOYSA-N 349.459 5.353 30 20 EKED Cc1nc(-c2cccc(NCc3ccc(C4(C#N)CC4)cc3)c2)oc1C 594933848 KVUKGHWEOGEKNN-UHFFFAOYSA-N 343.430 5.126 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C2CC2)cc1 597180539 QSQXZGQAIIKKDP-AWEZNQCLSA-N 336.460 5.068 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H](c2ccc3ccccc3c2)C(F)(F)F)C1 599049121 SSQLNFCYJJAQCC-KKXDTOCCSA-N 332.369 5.115 30 20 EKED N#CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)c1 730151698 PNYQKUNYHSXLLU-MDZDMXLPSA-N 345.423 5.214 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1cnc(C(C)(C)C)s1 736434245 RGEVYNUCRRWLFR-HJWRWDBZSA-N 348.537 5.399 30 20 EKED CCCCCCCCCC(=O)Nc1cc(N2CCOC2=O)ccc1C 743779744 LXDUMDXRTQQBTG-UHFFFAOYSA-N 346.471 5.031 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)o2)cc1 761804893 UIQQPYLJPQDHOG-CKDIWJPDSA-N 343.382 5.134 30 20 EKED C=CC[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccncc1 766022502 WJMXBQPARISACH-SJORKVTESA-N 330.884 5.179 30 20 EKED CCCCCC[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 786955927 AXRMXLAXKZEAFD-KRWDZBQOSA-N 341.499 5.040 30 20 EKED CC(C)c1ccc(NC(=S)N(C)[C@@H](C)c2cccc(C#N)c2)cc1 819028726 PCDRGYLSSBMSPM-HNNXBMFYSA-N 337.492 5.071 30 20 EKED Cc1c(C=NNc2ccccc2C(=O)O)sc2c(Cl)cccc12 1776030688 FWAIVIHFUNFVSE-UHFFFAOYSA-N 344.823 5.007 30 20 EKED Cc1ccc(-c2ncco2)cc1NCc1ccccc1C(C)(C)C#N 134957333 CRWVCUPLSHPGSK-UHFFFAOYSA-N 331.419 5.063 30 20 EKED Cc1cc(C(C)(C)C)cc(C)c1C[S@@](=O)CCCC(C)(C)C#N 177943504 YFDBPHFKWDZLKP-QHCPKHFHSA-N 333.541 5.180 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1cccc(OC)c1 189894377 LAZSVANCTHYRLZ-RTWAWAEBSA-N 349.474 5.289 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ncc(C)s1 191508238 JQDRCBMAMRNJEF-AWEZNQCLSA-N 343.496 5.186 30 20 EKED C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1 286924842 HLMXBVXZSAUNKZ-JXFKEZNVSA-N 347.462 5.103 30 20 EKED O=C1/C(=C\c2cccs2)CCc2nc(-c3ccc(F)cc3)sc21 303182174 KYMRBQNXHKHYKR-BENRWUELSA-N 341.432 5.223 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 358329202 OVOOUKZDLLJECQ-AVRDEDQJSA-N 331.463 5.230 30 20 EKED Cc1c(-c2noc(-c3ccc(C4(C#N)CC4)cc3)n2)oc2ccccc12 445494833 RVZBXCLBJCXQTI-UHFFFAOYSA-N 341.370 5.013 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(Cl)c1F 471128941 IUMVSJIORYIIDH-UHFFFAOYSA-N 332.806 5.089 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(-c2ccco2)cc1F)c1ccccc1 477083776 DPICIMRRJKLGQM-INIZCTEOSA-N 348.377 5.112 30 20 EKED C[C@H](CCCC(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 480163074 VZMYPXDKAIVBNG-BXKDBHETSA-N 331.275 5.140 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(Cl)c1OC)c1ccccc1 488690132 SOCNCPGYQFGGMF-OAHLLOKOSA-N 329.827 5.037 30 20 EKED C=CCn1c(S[C@@H](C)c2ccc(C(C)(C)C)cc2)nnc1C1CC1 499348681 HYTOSKJVKBAQOF-AWEZNQCLSA-N 341.524 5.492 30 20 EKED Cc1nc(-c2ccc([C@@H](C)Nc3cccc(F)c3C#N)cc2)cs1 506825223 PHGNNVUPKUPEAE-GFCCVEGCSA-N 337.423 5.302 30 20 EKED CCSc1ccccc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 565764204 XUXMEBNRVDUHEC-PXNSSMCTSA-N 338.520 5.884 30 20 EKED Cc1ccc2oc(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)cc2c1 609415310 QCOCEWSTMJMSKB-SFHVURJKSA-N 346.430 5.033 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(C#N)cc3)s2)cc1 727654004 DZFMUOOVRBFXHL-XFXZXTDPSA-N 344.439 5.195 30 20 EKED Cc1ccc([C@H](C)N(C)Cc2cc(Cl)ccc2OCC#N)c(C)c1 735308178 DKVSLPRNMSPLTR-INIZCTEOSA-N 342.870 5.052 30 20 EKED C[C@H](ON=C(c1ccccc1)C(F)(F)F)c1ncc(C(C)(C)C)o1 751965213 JVPNXAIRKAUFCX-NSHDSACASA-N 340.345 5.016 30 20 EKED C[C@H](NC[C@@H]1CC1(Cl)Cl)c1ccc(-c2cccc(C#N)c2)cc1 782522940 HKIFEFCCGXCDKL-UGSOOPFHSA-N 345.273 5.070 30 20 EKED CCCC[C@H](CC)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916627192 DPPVYCDRNVTJGP-RDJZCZTQSA-N 340.492 5.511 30 20 EKED C=C(C)[C@@H](NCc1cc(F)cc2cccnc12)c1ccc(F)c(F)c1 187776299 MCIFSJFSTQBHCM-LJQANCHMSA-N 342.364 5.059 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C=C)c1ccccc1 189913180 UWMSCNZSZVPPTR-SFHVURJKSA-N 333.475 5.837 30 20 EKED CC[C@@H](NCc1cc(Cl)sc1Cl)c1ccc(C#N)cc1 447574208 LVYJEKQHXVSKFN-CYBMUJFWSA-N 325.264 5.167 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1ccc(Cl)c2ccccc12 462646334 WIIMNADISOXGQH-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 467741205 QFJGPSXWOTYMSO-UHFFFAOYSA-N 349.434 5.038 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Cl)cc1-c1ccccc1 468295180 OCEHURLMEPWDIQ-UHFFFAOYSA-N 346.817 5.439 30 20 EKED C=CCC(C)(C)C(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 498771585 TXWQWNNTMZNDHF-UHFFFAOYSA-N 338.278 5.211 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC(C)C)c1ccccc1 504203299 HECGDLSHFZHLTI-IBGZPJMESA-N 342.508 5.233 30 20 EKED C[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(F)c(Cl)c1 507695244 QXRGLZMZWDFNQB-CYBMUJFWSA-N 341.879 5.374 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)cc1 508065136 ZQXZFGOWEOYJFD-KRWDZBQOSA-N 328.415 5.201 30 20 EKED CCc1ccc([C@H](C)CC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 523110889 LHCQOCAKPKUPNS-GOSISDBHSA-N 348.490 5.051 30 20 EKED CC(C)CCOc1ccc(CN[C@@H](CCC#N)c2ccccc2)cc1 532669933 PSKZAIDVQJPZAM-QFIPXVFZSA-N 336.479 5.246 30 20 EKED CC[C@@H](C)Oc1cccc(N[C@H](CCC#N)c2ccc(OC)cc2)c1 550855700 CQFKOSJSPSOEFD-IIBYNOLFSA-N 338.451 5.329 30 20 EKED N#CC[C@H](Cc1nc(-c2ccc3ccccc3c2)no1)c1ccccc1 582149025 RUTDEIYBUYWTOS-LJQANCHMSA-N 339.398 5.130 30 20 EKED C[C@H](c1ccc(Oc2ccccc2)cc1)[S@@](=O)CCC(C)(C)C#N 583073972 QJHAOJWAINBNKS-GYCJOSAFSA-N 341.476 5.228 30 20 EKED C=CC[C@@H](C)NC(=O)c1ccccc1-c1ncc(-c2ccc(C)cc2)o1 604881105 UKMGLRXCOHCOAG-MRXNPFEDSA-N 346.430 5.011 30 20 EKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(O)c(F)c1 728438702 LNENWJMSLICOQS-DJWKRKHSSA-N 344.691 5.100 30 20 EKED Cc1cc(C)cc(NC(=S)Nc2ccccc2SCCC#N)c1 730953196 SPOGXCGVNQQRIR-UHFFFAOYSA-N 341.505 5.118 30 20 EKED C[C@H]1CC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 731110003 VTENGDIQUSBKRD-LRQRDZAKSA-N 347.462 5.042 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(OC(F)(F)F)cc1 740765186 RPOYAAYVAZBOMN-MDZDMXLPSA-N 343.304 5.030 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 741450754 ABJBDGPKGKWAAN-UHFFFAOYSA-N 337.426 5.276 30 20 EKED Fc1nc(F)c(F)c(Oc2ccc(Cl)c(C(F)(F)F)c2)c1F 756956210 MAYBIJCFXJLGRL-UHFFFAOYSA-N 345.601 5.103 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(SC(F)F)cc1)c1ccccc1 773118445 ZRHQBHHLTBIODT-KBXCAEBGSA-N 331.431 5.417 30 20 EKED Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1ccc(C#N)c(F)c1 777132161 XWQOATZPMUCWBJ-OAHLLOKOSA-N 340.442 5.494 30 20 EKED C[C@H](OC(=O)CCCCCC#N)c1ccc(Cl)c(C(F)(F)F)c1 805902359 PGMFJSHEXODHLX-NSHDSACASA-N 347.764 5.437 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217092 BPGXOUHAXJUEBE-ZFWWWQNUSA-N 340.389 5.273 30 20 EKED C=CCc1ccccc1/C=C/c1nc2ccccc2c(C(=O)O)c1C 1776189170 ZJMHMKCOOPXDKN-BUHFOSPRSA-N 329.399 5.140 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccc(C)cc2[nH]1 188070388 ZQYKHJSCKXRVMI-UHFFFAOYSA-N 332.447 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccccc2)C1 191514161 HPEYXVHSTMWQLG-FQEVSTJZSA-N 348.490 5.560 30 20 EKED C[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(OCC#N)cc1 192923069 KEPQKBKKYPKNRI-QWHCGFSZSA-N 349.261 5.308 30 20 EKED C[C@@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccsc2S1 340450302 MDNRCZHJYVSMCT-OLMNPRSZSA-N 342.533 5.698 30 20 EKED N#C[C@H]1CC[C@H](Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 442860818 SRCJVBLUFXFAQW-YJBOKZPZSA-N 326.827 5.023 30 20 EKED C[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1F 447568241 IHSOTMYCCZNDKK-MNOVXSKESA-N 337.225 5.416 30 20 EKED N#CC[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 474083430 VVXUEWXWNRFYHH-CYBMUJFWSA-N 333.218 5.019 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474888151 NTDTXMMUZOYASX-XLNGHYISSA-N 344.911 5.528 30 20 EKED CC(C)Sc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 476351580 DNWYURFCPYTWSS-KRWDZBQOSA-N 338.476 5.213 30 20 EKED C=CCC[C@@H](NCc1ccc(C)nc1C)c1ccc(C(F)(F)F)cc1 480881623 AXVOMWJBLPZGMO-LJQANCHMSA-N 348.412 5.514 30 20 EKED C=CCCCCCSCC(=O)Nc1c(Cl)cccc1Cl 485589794 NXAIVKNEESPQRF-UHFFFAOYSA-N 332.296 5.412 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc3sccc3c2)s1 562379869 ZFLPNJOXHFLAMW-CYBMUJFWSA-N 340.473 5.145 30 20 EKED Cc1csc(-c2cccc(N[C@H]3CCc4ccc(C#N)cc43)c2)n1 575371624 SWHONXWMHZIELT-IBGZPJMESA-N 331.444 5.090 30 20 EKED COc1cccc(CNc2ccccc2S[C@H](C)CC#N)c1Cl 594706412 XZTZPXULZPGVAM-CYBMUJFWSA-N 346.883 5.355 30 20 EKED CCC(C)(C)[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 596732806 OMBYRHCYUAVOPN-KGLIPLIRSA-N 333.501 5.027 30 20 EKED C=CCOc1cccc(NC(=O)[C@H](C)c2ccccc2C(F)(F)F)c1 607807173 GTRAEVUBIHTYET-CYBMUJFWSA-N 349.352 5.012 30 20 EKED N#Cc1cc(Cl)ccc1SCc1ncc(-c2cccs2)o1 610654728 BTZZOOKYTCOGKL-UHFFFAOYSA-N 332.837 5.220 30 20 EKED Cc1c(Cl)cccc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611093307 XHGYJKIABRAIIC-UHFFFAOYSA-N 339.609 5.079 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](OC)C1CCCCC1 613901078 NDLUQGSEOVZMIC-FQEVSTJZSA-N 329.484 5.072 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 755610357 NIVCRYKRHLDJQU-QWHCGFSZSA-N 347.409 5.070 30 20 EKED CCC[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 764563263 XMHCVZGFMSQKDV-QWHCGFSZSA-N 334.872 5.198 30 20 EKED N#Cc1sc(Oc2ccc(Cl)c(C(F)(F)F)c2)nc1Cl 804328820 XVYIMALGLMZNOZ-UHFFFAOYSA-N 339.125 5.133 30 20 EKED O=C(/C=C/c1ccc(OC(F)F)c(F)c1)c1c(F)cccc1Cl 809159141 JBAHFTLSGQQGDP-GQCTYLIASA-N 344.691 5.116 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(Br)nc1)c1ccccc1 810228768 YRFDZFYOSNUFTN-WMLDXEAASA-N 345.284 5.202 30 20 EKED N#Cc1ccccc1Sc1ccc(-c2nc(C3CCC3)no2)cc1 904869696 ZFSBBTCVCRBUIG-UHFFFAOYSA-N 333.416 5.027 30 20 EKED O=C(O)c1ccc(NN=CCCc2ccc(-c3ccccc3)cc2)cc1 1776012910 VZEQCQDJNQUHRX-UHFFFAOYSA-N 344.414 5.082 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(F)c(C(=O)O)c1 1776064315 HXPPOLKPZKLVAI-CXAGYDPISA-N 348.462 5.554 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2c(F)ccc(C(=O)O)c2F)cc1 1776699997 MMGARCAAZLPOIC-ZKQHCESOSA-N 344.357 5.073 30 20 EKED C=C(C)CN(CC)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 60624957 FFJMINXOKOKEOG-UHFFFAOYSA-N 348.421 5.079 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 105018504 REMXPHDTKMHHPW-UHFFFAOYSA-N 349.434 5.089 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(C)cc1 188065701 CFIYUQLITAFPRJ-UHFFFAOYSA-N 349.474 5.449 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)OCc1ccccc1 191517633 JEDFWPSJYMZCRV-UHFFFAOYSA-N 338.451 5.134 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C(/Cl)c2nc3ccccc3s2)cc1 255445448 HZNZKYHAOWPDCG-JXCQQFQQSA-N 340.835 5.324 30 20 EKED CC1(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CCCCCC1 330029678 QLLLNNWPCZXBLU-UHFFFAOYSA-N 334.504 5.229 30 20 EKED N#CCCCSCc1cn(-c2ccccc2)nc1-c1ccccc1 359063787 GAMQZGLQPBUPOF-UHFFFAOYSA-N 333.460 5.076 30 20 EKED N#Cc1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)c(Cl)c1 430362499 FAUAOCYKURGYRJ-QZTJIDSGSA-N 346.817 5.107 30 20 EKED CC[C@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccc(C#N)cc1 447527729 GZVCFFLOBQJBSI-ZWKOTPCHSA-N 344.405 5.352 30 20 EKED CCc1ccc(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)o2)cc1 465017509 TXBUBSLARYMTPD-INIZCTEOSA-N 330.431 5.231 30 20 EKED Cc1cncc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 467636210 PCJYZEYTEGOKCG-MSOLQXFVSA-N 341.458 5.341 30 20 EKED C=CCC1(C(=O)Nc2ccccc2COCc2ccccc2)CCC1 485577231 IZNWCKYWTWUQRD-UHFFFAOYSA-N 335.447 5.088 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2C)C1 505036128 SXDOEWYBPXOHRM-IBGZPJMESA-N 334.463 5.135 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2ccccc2c1 521725432 CXHAVIRKPKEDMR-OAHLLOKOSA-N 346.455 5.344 30 20 EKED CN(Cc1ccc(C#N)s1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 537724974 JEJJYQAJTDVXCS-AWEZNQCLSA-N 344.789 5.009 30 20 EKED Cc1nc(-c2ccccc2)oc1CN[C@H](CCCC#N)c1ccccc1 602838626 GGLKBWNXZHVZKY-HXUWFJFHSA-N 345.446 5.175 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 606813990 GCGXBMAEAPIPAN-IAGOWNOFSA-N 339.401 5.014 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc2ccccc12 609431806 UGRDGDBNGXNGJK-INIZCTEOSA-N 332.472 5.846 30 20 EKED Cc1cccc2sc(C(=O)N[C@@]3(C#N)CCC[C@H](C)C3)c(Cl)c12 609736982 VMCBAMDENYGRFP-VOJFVSQTSA-N 346.883 5.065 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1ccc(Cl)cc1 727263544 CXNCLHDCESMKMW-KHPPLWFESA-N 325.820 5.360 30 20 EKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2ccccc2)CC3)cc1 727780314 KPQUZAQAEQNJEM-SSZFMOIBSA-N 347.439 5.031 30 20 EKED O=C1/C(=C\c2csc(-c3cccs3)n2)CSc2ccccc21 728439552 MOHKMCLOYSPXCG-FLIBITNWSA-N 341.482 5.244 30 20 EKED Cc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733621015 GPKDEDAAWZELHJ-FQEVSTJZSA-N 341.414 5.295 30 20 EKED C/C=C(/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC 764841757 YHPZQUGIVQORNH-LBZPCRRWSA-N 330.431 5.193 30 20 EKED C#CCCCCC(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 773626812 ZHPYCQGFDLQITM-AWEZNQCLSA-N 345.826 5.101 30 20 EKED O=C1/C(=C\c2scnc2C2CC2)CSc2ccc(Cl)cc21 782323370 NEAGOWQJRGUTTI-YHYXMXQVSA-N 333.865 5.046 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1cccc(-c2ccncc2)c1 782341412 JAFYPZMDZPRKAG-ALCCZGGFSA-N 336.394 5.193 30 20 EKED N#Cc1ccc(CSC2=Nc3ccccc3CS2)c(Cl)c1 783981356 UCVQMCMUESAJGS-UHFFFAOYSA-N 330.865 5.379 30 20 EKED C=CCC1(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)CCCC1 825472640 STYILXYWSUHNNU-UHFFFAOYSA-N 336.479 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccnc1C(F)F 890165859 OZXCCPIUUOOITR-UHFFFAOYSA-N 330.378 5.123 30 20 EKED CCCCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 915350188 KVHZDXIHYCMNTE-NRFANRHFSA-N 347.462 5.138 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C=C(C2CC2)C2CC2)cc1 917668661 DOLTWPLWHFWRIP-QFIPXVFZSA-N 342.442 5.027 30 20 EKED CC[C@H](C)Cc1c(C)sc2nc(S[C@@H](C)CCC#N)nc(O)c12 1643608385 LNMQARPAWDOUFR-QWRGUYRKSA-N 349.525 5.078 30 20 EKED O=C(O)c1ccccc1NN=C1CC=C(c2ccc(Cl)cc2)CC1 1776030814 SWOYGNWTLVKSIB-UHFFFAOYSA-N 340.810 5.074 30 20 EKED C[C@@H]1C/C(=C/c2csc3ccc(C(=O)O)cc23)C(=O)c2ccccc21 1776589530 JBACELPZQSPKRK-OJLMPMFISA-N 348.423 5.373 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(-c2nccs2)c1 56777437 NTYJAXUCOBXDME-UHFFFAOYSA-N 349.459 5.030 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccnc2)cc1 181851026 VXKYZGPYZRSBED-DLBZAZTESA-N 327.431 5.032 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(Cl)c1 191607550 YGDXKWYEGPINAS-CYBMUJFWSA-N 344.867 5.295 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(C(F)F)c1 195425472 ZWHORIDEWCXSBE-UHFFFAOYSA-N 348.352 5.415 30 20 EKED N#Cc1cc(Cl)ccc1N1CCC(c2c[nH]c3ccccc23)CC1 303222397 SBJQAGQNIPGDGS-UHFFFAOYSA-N 335.838 5.077 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(OCc2ccccc2)cc1C 303850903 NKMYRKUQEHWARH-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C/N=C(/O)c1cc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)ccc1Cl 329028510 WJHWVKDXOCMSOP-NWANDNLSSA-N 348.874 5.469 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 439571899 OEABIQABOSCMIV-QZTJIDSGSA-N 342.442 5.762 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCC1CCC(C#N)CC1 442862448 AJLOKKSWEOYWGU-OOHWJJMZSA-N 339.508 5.099 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)sc1Cl)c1ccccc1 449338990 IGJRXOITSHZHOV-CQSZACIVSA-N 339.291 5.580 30 20 EKED CC(C)(C#N)CCCSc1nnc(-c2ccc3ccccc3c2)o1 476527718 XZKYAWUGWJHMEL-UHFFFAOYSA-N 337.448 5.312 30 20 EKED C[C@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 480584566 GKGJCDLOWLAADK-INIZCTEOSA-N 349.434 5.004 30 20 EKED Cc1ccc(C(C)(C)CC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487519344 ZHCXVSWBQZEWBZ-OAQYLSRUSA-N 348.490 5.214 30 20 EKED C=CCC[C@@H](NC(=O)N[C@H](C)CCCC(F)(F)F)c1ccccc1 494793013 IBFHNIKSUTWIIS-GDBMZVCRSA-N 342.405 5.114 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(SCC)c1 506860312 TUNCHTATGKLALC-UHFFFAOYSA-N 332.494 5.080 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cncc2ccccc12 534743709 SGPAGEAOYKXQKF-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 536196681 HAXUALMHMGGXCM-KRWDZBQOSA-N 344.414 5.172 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)c(F)c1 553791264 QAXOSQNOIPHGOJ-RNODOKPDSA-N 326.390 5.028 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(F)c2ccccc12 588975525 ARCILYRSSHIULG-CYBMUJFWSA-N 338.813 5.355 30 20 EKED C[C@@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)CC(C)(C)C 603956463 OYTZLBJQLYAJKT-INIZCTEOSA-N 338.451 5.147 30 20 EKED C=CCC[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CC1 676637744 QTRMZQNRMMLEQI-ZOBORPQBSA-N 343.355 5.230 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)s1 758424265 TXYBQMJLXCXAQC-VOTSOKGWSA-N 325.355 5.181 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cccc(-c2ccncc2)c1)c1ccncc1 766023009 ZEEOVUQTJZNYEX-HTAPYJJXSA-N 329.447 5.112 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(OCC(F)(F)F)cc1)c1ccccc1 773118048 YJWJXZYXGJXWNI-DNVCBOLYSA-N 347.380 5.043 30 20 EKED CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2ccccc2SCC#N)CC1 781461092 WMWCCAIIWGHHJM-HZPDHXFCSA-N 344.524 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](O)CC[C@H](C)CC 793950025 WHJOHWCTIXCUNL-AEFFLSMTSA-N 331.500 5.054 30 20 EKED CC(/C=C\C(=O)c1ccccc1C#N)=C\c1ccccc1OC(F)F 811690353 BHSGYVKRLNOOLX-HSINTONASA-N 339.341 5.002 30 20 EKED CCCC[C@@](C)(F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 850770895 DKXYXLCOEVABIR-BDJLRTHQSA-N 338.835 5.044 30 20 EKED C=CCCCCCCCNc1nc2ccccc2c(C)c1C(=O)O 1776172864 UZEAAEGPKCNWJR-UHFFFAOYSA-N 326.440 5.180 30 20 EKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 90664582 IAPTZIOTMPMNFX-ROUUACIJSA-N 344.405 5.374 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)c1cccc(C#N)c1 181971796 JAEILOUQENAVIZ-JXFKEZNVSA-N 332.472 5.254 30 20 EKED C[C@@H](Nc1ccc(SC(F)F)cc1)c1ccc(OCC#N)cc1 192967925 CKLWEGNMOWBXDU-GFCCVEGCSA-N 334.391 5.077 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1F 359386839 CYBOZSAVXITIJG-MSOLQXFVSA-N 330.834 5.565 30 20 EKED Cc1cc(Cl)ccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432462830 LHTROFQCTKKMBF-SFHVURJKSA-N 341.842 5.205 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1cc2c(ccc3ccccc32)o1 442864060 BNFBYXKHBCTNOZ-KLAILNCOSA-N 332.447 5.567 30 20 EKED Cc1nc(CSc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 464915597 XUANNDQEZLEUTL-UHFFFAOYSA-N 340.835 5.467 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C 483776629 URMLSEZERXORBV-GOSISDBHSA-N 328.456 5.046 30 20 EKED C=CCC[C@H](C(=O)Nc1cncc(Cl)c1Cl)c1ccccc1 489400360 HOMFDAJKVBMYIY-ZDUSSCGKSA-N 335.234 5.077 30 20 EKED CCC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 538508713 ZXINPMVJGXWNDE-BLVKFPJESA-N 332.369 5.168 30 20 EKED CCC[C@H]1CCc2ccccc2N1C(=O)c1ccc(C2(C#N)CC2)cc1 539658856 RAVKLCVEYSYIAO-FQEVSTJZSA-N 344.458 5.003 30 20 EKED Cc1ccnc(Oc2cc(NCc3cccc(C#N)c3F)ccc2C)c1 544084614 ILBVXCIHTMFUCG-UHFFFAOYSA-N 347.393 5.114 30 20 EKED C=CCC[C@H](Nc1ccc(NC(=O)CC(C)C)cc1)c1ccco1 560544888 KHCWFYXYWJMRTD-SFHVURJKSA-N 326.440 5.384 30 20 EKED Cc1cc2cc(CN[C@@H](CCCC#N)c3ccccc3)oc2cc1C 581840531 NOHFZSAWRMLLDW-NRFANRHFSA-N 332.447 5.574 30 20 EKED C=C(C)[C@@H](NCc1ccc(C(C)C)nc1C)c1ccc(F)c(F)c1 584733893 YGZPHSOWIFZXBD-HXUWFJFHSA-N 330.422 5.199 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2nc3cc(Cl)ccc3o2)cc1 588790578 MDQDBKYIZYCKMC-AWEZNQCLSA-N 328.824 5.017 30 20 EKED CCC(C#N)(CC)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 599251648 HYMGXNYHKPPXLE-MRXNPFEDSA-N 335.451 5.128 30 20 EKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392128 IVKOOGTUDANQDG-GOSISDBHSA-N 346.455 5.424 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 727974233 JFPBWYKDYLXDMM-ZHACJKMWSA-N 330.412 5.188 30 20 EKED C[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 734079640 FCVSLNSNUFUUMB-RISCZKNCSA-N 346.883 5.342 30 20 EKED CCCCCCCCCC(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1 735791683 BJHILPLTPCNRSK-MRXNPFEDSA-N 325.456 5.188 30 20 EKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 795992914 RXOAYELKSLHWQD-PBHICJAKSA-N 327.811 5.032 30 20 EKED Cc1cccnc1[C@@H]1CCCC(=NNc2cccc3ncccc23)C1 799109085 UXTKNYRQODSUNP-MRXNPFEDSA-N 330.435 5.064 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1O 806152072 ULWOBZUDAVUAOQ-SFHVURJKSA-N 344.842 5.291 30 20 EKED CCCCCCCOc1cccc(CN[C@@](C)(CCCC)C(=O)O)c1 1776787923 GHTFYXPBDVLWQK-NRFANRHFSA-N 349.515 5.159 30 20 EKED CC(C)(CCC#N)COC(=O)c1ccc(C2SCCCS2)cc1 195054027 LKRKUYVCVYAWNF-UHFFFAOYSA-N 349.521 5.042 30 20 EKED N#Cc1c(Cl)nsc1Oc1ccc(Sc2ccncc2)cc1 301964931 UJTKNSDSYLLJLB-UHFFFAOYSA-N 345.836 5.007 30 20 EKED Cc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1C(F)(F)F 391892229 AQVMILFPEPZGLP-ZDUSSCGKSA-N 334.341 5.089 30 20 EKED CC(C)CN(C(=O)[C@H](C)c1ccc(Cl)s1)c1ccc(C#N)cc1 426103675 WAVMXQURCAHJJX-CYBMUJFWSA-N 346.883 5.066 30 20 EKED CCSCc1ccccc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 434558541 KVFIYRRVTSQQSZ-OAHLLOKOSA-N 344.505 5.010 30 20 EKED C=CCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccsc1)c1ccccc1 435092962 AXIMGPDSXYKIQS-RTBURBONSA-N 340.492 5.302 30 20 EKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H]1c1nc2ccccc2s1 442683564 VRKFPFGITVAGOD-KBXCAEBGSA-N 333.460 5.066 30 20 EKED C[C@H](SCC(=O)Nc1cccc2ccccc12)c1cccc(C#N)c1 443161435 TYUIGGNBLZLEOL-HNNXBMFYSA-N 346.455 5.144 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(-c2ccc(F)cc2)s1 471164233 FEMQCXSOMUAVDA-UHFFFAOYSA-N 344.455 5.099 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C2(CCC2)C1 475582642 LEBBWVYPKQFJTB-KRWDZBQOSA-N 340.511 5.583 30 20 EKED CCN(C(=O)C[C@H](c1ccccc1)C(C)C)[C@H](C)c1ccc(C#N)cc1 482411354 XCLQLLLRTDNMRN-GCJKJVERSA-N 348.490 5.298 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-c3ccccc3F)o2)cc1 499413403 UHEYYLSELJWVQD-UHFFFAOYSA-N 348.377 5.139 30 20 EKED C[C@H]1CCC[C@@H](CC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 520824912 HWKRMJXNBMJTHD-ARFHVFGLSA-N 330.497 5.093 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1OC 520951999 BFIWSQDMUPHVHD-NRFANRHFSA-N 339.479 5.137 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 530593806 ADLKVFNOHRVMEB-CYBMUJFWSA-N 346.352 5.018 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(F)c(C(F)(F)F)c2)cc1 600847421 DERCRUPBQZKGAT-UHFFFAOYSA-N 336.332 5.258 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCC1CCCCC1 609403087 RUTJSUMNZPWLFC-HNNXBMFYSA-N 345.512 5.030 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(CC(F)(F)F)cc1 611474752 ISIVWOWNPQVDEP-SFHVURJKSA-N 330.353 5.153 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Cl)sc1Cl 618807395 UHVOCYPIEHRRFQ-YMTOWFKASA-N 337.275 5.265 30 20 EKED COc1cc(C)ccc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 727264040 MJJAVQUKVMGNRQ-PKNBQFBNSA-N 335.428 5.023 30 20 EKED CSc1ccc(C(=O)/C=C/c2ccc(OC(F)F)cc2)cc1F 741847209 LXUVLKOSIVHNIP-XBXARRHUSA-N 338.350 5.045 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 750683397 SVCUQPJBVFDSRO-DEQJRXDXSA-N 346.817 5.168 30 20 EKED C=C(C)CCc1noc([C@H](C)Sc2nc3ccccc3s2)n1 795767365 MOIVWTDKWJITKR-NSHDSACASA-N 331.466 5.041 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1C 820845093 TZBIHAYNHHKISE-HNNXBMFYSA-N 332.488 5.279 30 20 EKED CC(=NNc1ccccc1C(=O)O)[C@@H](C)c1ccc(CC(C)C)cc1 1776031090 LWDLHQWADUANIT-OAHLLOKOSA-N 338.451 5.175 30 20 EKED Cc1ccc(Cl)cc1NN=Cc1csc2ccc(C(=O)O)cc12 1776106860 ZOPYTYOKDYXPJQ-UHFFFAOYSA-N 344.823 5.007 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1coc(-c2ccccc2)n1 159562421 UWIPDKGEZXPUBB-OAHLLOKOSA-N 349.459 5.348 30 20 EKED C=CCC[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C1CC1 180036201 XUYUBPPXQOLVLO-INIZCTEOSA-N 344.842 5.342 30 20 EKED CC[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 447573958 JYBXYYRSXWLAAT-PKTZIBPZSA-N 344.433 5.528 30 20 EKED CCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](CC)c1ccccc1 461990354 XBVOYDWWBWGIJI-UTKZUKDTSA-N 334.463 5.052 30 20 EKED C=C(C)C[C@H](C)C(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 464558352 GEZNLVSYAIMTON-KBPBESRZSA-N 327.390 5.217 30 20 EKED C=C(C)C[C@@H](C)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 464573055 XBVPDQXGUAQBHX-YLJYHZDGSA-N 346.474 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)COc1ccccc1 476122876 SIZXIWZYYHRDCF-KRWDZBQOSA-N 337.463 5.192 30 20 EKED C[C@@H](c1cccc(C#N)c1)N1CCC(c2nc3ccccc3s2)CC1 487498615 LEYUCCXFBYPDAZ-HNNXBMFYSA-N 347.487 5.109 30 20 EKED C[C@@H](SCc1ccc(Oc2ccccc2)nn1)c1ccc(C#N)cc1 498416684 FAQRMQOALUPXIJ-OAHLLOKOSA-N 347.443 5.135 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1SC[C@H](C)C#N 510869748 YEGKTRLHFGUKCQ-WBVHZDCISA-N 344.524 5.483 30 20 EKED CSc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1C 577789641 BIMKPJSNHXOXGD-UHFFFAOYSA-N 336.382 5.220 30 20 EKED C[C@H](NC(=O)CCCCC#N)c1ccccc1-c1ccc(Cl)cc1 593981978 AGUDUWYBSPEQCN-HNNXBMFYSA-N 340.854 5.268 30 20 EKED CC(C)(C#N)c1ccc(CNC(C)(C)c2nc3ccccc3s2)cc1 598986049 FGIOMYSEMVODMG-UHFFFAOYSA-N 349.503 5.122 30 20 EKED Cc1cccc2sc(C(=O)N(C)c3ccc(C#N)cc3)c(Cl)c12 610982852 AIZKMEQFGBTGJU-UHFFFAOYSA-N 340.835 5.011 30 20 EKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1sc(C)nc1C 726737505 SHSNWLDNHFFUCJ-UHFFFAOYSA-N 344.871 5.106 30 20 EKED CCC/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 729320496 ZKBRFGOTUCVHBK-DNXKIMQPSA-N 338.838 5.290 30 20 EKED CC(C)(C#N)CCSc1nc2cc(C(F)(F)F)ccc2s1 742452030 DNEREJXLQLFDHM-UHFFFAOYSA-N 330.400 5.347 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 776073832 ANBJMQFBOUQIMP-WBVHZDCISA-N 348.471 5.132 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccccc2C#N)cc1 799499061 HMYIDRDBPZIVNI-QINSGFPZSA-N 339.394 5.130 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(Cl)cc1Cl 916137609 WKBFJXGVTAVEOV-XBXARRHUSA-N 328.198 5.438 30 20 EKED C=CCCC1(C(=O)O)CCN([C@H](C)c2ccc3ccccc3c2)CC1 1776168026 PJTSZTVITVBHIV-QGZVFWFLSA-N 337.463 5.034 30 20 EKED Cc1nnc(Oc2ccc(-c3ccccc3)cc2Cl)c(C#N)c1C 29373770 QROQPDPILNWKTA-UHFFFAOYSA-N 335.794 5.078 30 20 EKED C=CCOc1cccc(NC(=O)c2sc3cccc(F)c3c2C)c1 65749526 VXKQFMYQWCMJPM-UHFFFAOYSA-N 341.407 5.166 30 20 EKED CC[C@@H](C#N)Sc1nnc(SCc2ccc(C(C)C)cc2)s1 127222469 XWAADICFZNQWPS-AWEZNQCLSA-N 349.550 5.348 30 20 EKED C[C@@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccc(OCC#N)cc1 182006022 BNJAYKAVBKKEPN-IERDGZPVSA-N 334.463 5.052 30 20 EKED C=CC[C@H](C(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 188563868 HLBJLIFPTPKLPP-IBGZPJMESA-N 346.430 5.257 30 20 EKED C=C[C@H](CC(=O)N(c1cnc2ccccc2c1)C(C)C)c1ccccc1 448459618 PNLXHCBXEZQRLI-GOSISDBHSA-N 344.458 5.336 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2cccc(F)c2C1 459518990 FMXSXROENQCGGU-UHFFFAOYSA-N 338.426 5.225 30 20 EKED C[C@H](Nc1cccc(Cl)c1OCC(F)F)c1ccc(C#N)cc1 487499357 HKYYXEVVTOGLKD-NSHDSACASA-N 336.769 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccsc1 529137735 RYRIKGKEDMHXHN-ZWKOTPCHSA-N 325.477 5.342 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(C)ccc1Br)c1ccccc1 534161434 VGDIZLPWBQUFPW-AWEZNQCLSA-N 344.252 5.056 30 20 EKED CC(F)(F)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 550845688 BEUUUGQNYNWSJW-UHFFFAOYSA-N 346.402 5.056 30 20 EKED N#CCCCCCC(=O)Nc1cc(Cl)ccc1OC1CCCC1 588968634 UHQXWZIAHDWXLQ-UHFFFAOYSA-N 334.847 5.074 30 20 EKED C=C[C@@H](CC(=O)N1CCCC[C@H]1c1ccccc1OC)c1ccccc1 677541093 NEDYDCHGLIBWPY-RXVVDRJESA-N 349.474 5.109 30 20 EKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1cc2ccccc2o1 741840215 KPWRVDGSDQYLDW-MDZDMXLPSA-N 346.304 5.270 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 742430764 AUDMREKSMOLFND-SREVYHEPSA-N 329.421 5.215 30 20 EKED C#CC[C@H](NC(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1 757770665 FMBJZQMNJTWVGO-NRFANRHFSA-N 348.490 5.820 30 20 EKED C#CCCCCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 773328265 JJVMIPPWWSBHHL-UHFFFAOYSA-N 329.802 5.278 30 20 EKED Cc1ccc(CCC(=O)[C@H](C#N)c2nccc3ccccc23)cc1Cl 792100266 DIBDADTWYFWESA-SFHVURJKSA-N 348.833 5.006 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2c(cc1O)CCCC2 815636351 TTZMKNSKYMVHDD-VGOFRKELSA-N 348.490 5.357 30 20 EKED CC(C)=CCC[C@@H](C)CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 842803017 LOAXFLGYXRLFQT-UKRRQHHQSA-N 338.373 5.049 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2cccs2)cc1 915180968 UKSMTKCZFRNLHY-GHYICZDASA-N 344.439 5.055 30 20 EKED C[C@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)c1cccc(C#N)c1 189796713 ZFNFCKLVDUYUBT-CABCVRRESA-N 349.459 5.141 30 20 EKED C[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 315389160 FHYCOWMVRWEGCL-QWRGUYRKSA-N 337.225 5.416 30 20 EKED CC(C)c1ccccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 329989149 HUVGITDUDVFQCY-UHFFFAOYSA-N 328.456 5.323 30 20 EKED C=CCC[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 438850570 HVHHULSGPHYCEL-NHCUHLMSSA-N 347.462 5.038 30 20 EKED C[C@@H](Sc1nnc(CCC2CCCCC2)o1)c1cccc(C#N)c1 442915395 WVQJQTAYTBOEMP-CQSZACIVSA-N 341.480 5.307 30 20 EKED Cc1oc(-c2ccccc2)nc1CS[C@H](C)c1cccc(C#N)c1 443156972 PWLGQBHVXKUTQJ-OAHLLOKOSA-N 334.444 5.516 30 20 EKED C[C@@H](SCc1ncc(-c2ccccc2F)o1)c1cccc(C#N)c1 443161064 RJWHWUNUMVUNIM-CYBMUJFWSA-N 338.407 5.347 30 20 EKED Cc1cc(CNc2ccc(-c3cnc(C4CC4)o3)cc2)ccc1C#N 443995138 MTIYXGAZMAXJSN-UHFFFAOYSA-N 329.403 5.011 30 20 EKED C=CCC1(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)CCCCC1 450489878 RLFXYQJANXROSO-OAHLLOKOSA-N 329.488 5.197 30 20 EKED CCCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](C)c1ccccc1 462014729 ICQLVCBXYIFZDY-MSOLQXFVSA-N 334.463 5.052 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1sccc1C 475558732 AAWHRBKQVFMDOX-UHFFFAOYSA-N 342.508 5.273 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 504171648 LVWSTRWUSUAEDG-LJQANCHMSA-N 342.870 5.037 30 20 EKED C=CCC[C@@H](NCc1cccc(NC(=O)[C@@H](C)CC)c1)c1ccco1 513678534 OQMZHHJBEZYANH-QFBILLFUSA-N 340.467 5.061 30 20 EKED CC(C)CC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518255117 GBBGCZKCSPYPNJ-HUUCEWRRSA-N 333.501 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc(CC)c1 530401801 OAXYMGGYKDATMB-UHFFFAOYSA-N 337.463 5.118 30 20 EKED CC(C)c1ccc(-c2ncc(CN(C[C@H](C)C#N)C3CC3)s2)cc1 533138829 XHQURMQSXMNCAV-OAHLLOKOSA-N 339.508 5.058 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(-c2cccc(F)c2)o1 537847721 WIZQMKLZSWDDIA-UHFFFAOYSA-N 344.798 5.298 30 20 EKED N#CCC[C@@H](NCc1c(Cl)ccc2cccnc12)c1ccccc1 611406957 IMLYQGAYXREVID-LJQANCHMSA-N 335.838 5.023 30 20 EKED CCCCc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1 682993847 BOXDSUACYILUTF-HXUWFJFHSA-N 328.415 5.067 30 20 EKED C=CC[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccncc1 734680480 SYUGRSXOHOLZHL-OAQYLSRUSA-N 343.430 5.188 30 20 EKED CC(C)(C)/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 735208542 ZEDWHUFPOCBRMR-QIAWRQBBSA-N 344.867 5.242 30 20 EKED CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749050113 ZXFPUCCVEGHVTP-GDBMZVCRSA-N 326.465 5.121 30 20 EKED CC1CCN(c2ccc(N[C@H](C)c3ccc(C#N)cc3F)cc2)CC1 781423450 VSWIDIQAGVWAGI-MRXNPFEDSA-N 337.442 5.107 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1Cl 792108780 YZMZAHXPRFYKPJ-RXXLQFRUSA-N 346.817 5.168 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=S)Nc3ccccc3C#N)c2)o1 795012335 LNHMMSISNUFWDT-UHFFFAOYSA-N 347.443 5.244 30 20 EKED CC(C)[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797569676 UVPKFFDSARSEPN-DOTOQJQBSA-N 340.492 5.057 30 20 EKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1ccccc1F 916135719 KVVAGXNIQSMACY-KTKRTIGZSA-N 343.810 5.499 30 20 EKED N#C[C@H](C(=O)CC1CCCCC1)c1nc2cc(Cl)ccc2s1 917043001 FPHHYEAGEYPGMQ-CYBMUJFWSA-N 332.856 5.096 30 20 EKED N#C[C@@H](C(=O)c1cc2ccccc2s1)c1nc2ccccc2s1 41502795 BVKMFIKPWBTLOZ-LBPRGKRZSA-N 334.425 5.001 30 20 EKED C=CCn1c(S[C@H](C)c2ccc3ccccc3c2)nnc1C1CC1 59832554 XJAGIVMFOQKRLB-CQSZACIVSA-N 335.476 5.348 30 20 EKED CCC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 72591328 VNWQBCOAHWJNIW-SMDDNHRTSA-N 332.856 5.076 30 20 EKED N#CCC[C@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccccc1 90664651 AVCJMSBSBKHJCE-ROUUACIJSA-N 342.895 5.512 30 20 EKED N#Cc1cc(Cl)ccc1CNc1cccc(Oc2ccccn2)c1 184476587 MHRUNWVTNPDMDC-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCOc2ccccc21 189911400 LSQZFPCJNUKJSU-LJQANCHMSA-N 335.447 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccco1 191500543 GOVHHJFELSCDEP-HNNXBMFYSA-N 326.440 5.356 30 20 EKED Cc1ccc2nc(/C=C\c3cccc(OCCCC#N)c3)ccc2c1 207588916 IPIUQERKYVHMPI-NTMALXAHSA-N 328.415 5.396 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2ccc(C#N)cc2)n1 303715531 QSIUDVOQCJVSSM-NSHDSACASA-N 347.365 5.005 30 20 EKED CC(C)(C/N=C(/O)[C@@H]1CC12CCCC2)C/N=C(/O)[C@@H]1CC12CCCC2 329988666 HJTXPMXTPSJQNU-HOTGVXAUSA-N 346.515 5.086 30 20 EKED CCN(C(=O)Nc1cccc(C#N)c1C)[C@H](C)c1cc2ccccc2o1 431728169 WPWRGIQRHOFPBK-OAHLLOKOSA-N 347.418 5.228 30 20 EKED N#CCCC[C@@H](NCCOc1cccc2ccccc12)c1ccccc1 433016183 OJFVAIPOCXAFQQ-JOCHJYFZSA-N 344.458 5.243 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 466254392 PSJBPIYCWCPLHW-ZDUSSCGKSA-N 338.278 5.211 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C(C)(C)C)cc2)n1 474441464 NRVRLAAYDOUERL-HNNXBMFYSA-N 326.465 5.054 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474478449 LQNYFACSYFDPTD-GUYJKWIASA-N 330.884 5.116 30 20 EKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480807788 XIJXGENTZLCXRO-YWZLYKJASA-N 349.434 5.003 30 20 EKED Cc1c([C@@H](NCc2ccc(C#N)c(F)c2)C(C)C)oc2ccccc12 484085363 SMLGGMNETDHDSK-FQEVSTJZSA-N 336.410 5.239 30 20 EKED CCCCCN(CCCCC)C(=O)N[C@@H](C)c1ccc(C#N)cc1 505324107 CTTBIRHVRRCBFL-KRWDZBQOSA-N 329.488 5.011 30 20 EKED N#Cc1cc(NCc2ccc(-c3ccncc3)cc2F)ccc1Cl 508650378 TWJZGNGGYAMGSL-UHFFFAOYSA-N 337.785 5.025 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cccc(-c3ccncc3)c2)cc1 552317818 IJAYDZSLMMWNBF-GOSISDBHSA-N 344.458 5.164 30 20 EKED N#CCc1ccnc(NCc2ccc(-c3ccc(Cl)cc3)s2)c1 562295555 OGJTXNUWZXBKLS-UHFFFAOYSA-N 339.851 5.142 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 563643130 UBLPEWKZOPIDAL-GCJKJVERSA-N 336.479 5.560 30 20 EKED N#Cc1cccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c1F 565862246 XHHVLSBWJFLICJ-SFHVURJKSA-N 349.236 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)C(=O)c1ccccc1 682822985 ZDEUKWASKXTTRZ-KRWDZBQOSA-N 349.474 5.386 30 20 EKED CCCCCCCC(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1 733244522 KEAQMMSEYKZTAE-UHFFFAOYSA-N 347.846 5.221 30 20 EKED C=CCN(C(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)C(C)C 745277790 USJPPCJLCWCRFK-XLIONFOSSA-N 344.499 5.210 30 20 EKED CC1(C)C/C(=C\c2csc(-c3ccccn3)n2)C(=O)c2ccccc21 794967914 JEGFZMXCLLBULC-SDNWHVSQSA-N 346.455 5.153 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C/c1ccc2ccccc2n1 800155913 BAKDCQUJOTUEBT-FOCLMDBBSA-N 328.415 5.005 30 20 EKED CC(C)(C#N)c1ccc(-c2nc(-c3cccc(C(F)F)c3)no2)cc1 809480722 YMPJXHHTCIJJFM-UHFFFAOYSA-N 339.345 5.142 30 20 EKED C=CC[C@H](N[C@@H](c1cccc(OC(C)C)c1)C(F)F)c1ccncc1 848531967 YJYZAZHAVZKESE-OALUTQOASA-N 346.421 5.082 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1F 1776130914 ADWAAGNXUJLFOJ-SDNWHVSQSA-N 346.357 5.087 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2sccc2C#N)cc1)c1ccccc1 52148217 RGRLJTLNXGIKNS-AWEZNQCLSA-N 347.443 5.045 30 20 EKED Cc1sc(C(=O)Nc2sccc2C#N)cc1-c1ccc(F)cc1 87034917 AATPFQKLOPMCCO-UHFFFAOYSA-N 342.420 5.048 30 20 EKED COc1ccc(Cl)cc1[C@H](C)N[C@H](CCC#N)c1ccccc1 90665059 KNAGMYFFAVFPIX-KBXCAEBGSA-N 328.843 5.044 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(C)s3)cs2)cc1 303055701 ZABUKFXCWNNYBD-CMDGGOBGSA-N 325.458 5.385 30 20 EKED Cc1cc(C)cc(C(=O)/C=C/c2ccccc2OCc2cccnc2)c1 303333570 UCCMOBOQSVIYCK-MDZDMXLPSA-N 343.426 5.174 30 20 EKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@H](C)OC1CCCCCC1 330128690 NVQFLWNYBKBSLK-HNNXBMFYSA-N 341.455 5.101 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@H](CCC#N)c1ccccc1 353314790 NJYLXAQNECYXLB-NHCUHLMSSA-N 334.463 5.052 30 20 EKED CCCN(Cc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458793921 AEJFKICNZKHCEF-NRFANRHFSA-N 349.478 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n([C@H](C)CC)n1 476090823 MSVNJHZBJWSACU-OAHLLOKOSA-N 339.483 5.267 30 20 EKED CCN(Cc1cccc(-c2ccncc2)c1)[C@H](C)c1ccc(C#N)cc1 508604171 MCJCYPRRMQEVAU-GOSISDBHSA-N 341.458 5.203 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1S[C@H](C)CC#N 513436834 KCLMRXQCEGOFMJ-WBVHZDCISA-N 344.524 5.626 30 20 EKED C[C@@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(Cl)cc1 521608172 OWMNMKCUMYZGIM-CYBMUJFWSA-N 344.867 5.035 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1ccco1 604498396 SDZVMQXLQVBTLN-UHFFFAOYSA-N 348.427 5.004 30 20 EKED C[C@H](NC(=O)Nc1ccccc1-c1ccccc1)c1cccc(C#N)c1 610317528 SELWAJFOWBSAPV-INIZCTEOSA-N 341.414 5.108 30 20 EKED COc1cccc(NN=C(C)c2csc(-c3csc(C)n3)c2)c1 729143895 UPCDPDHUBJTLQS-UHFFFAOYSA-N 343.477 5.025 30 20 EKED N#Cc1cc(Cl)ccc1N1CCC(c2cc3ccccc3[nH]2)CC1 729181362 CIXJEIYWKSMJQQ-UHFFFAOYSA-N 335.838 5.077 30 20 EKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(C)s3)cs2)cc1 797157777 SQTAIHNDMCNYCY-TWGQIWQCSA-N 341.457 5.085 30 20 EKED CC(=NNc1ccccc1)c1sc(-c2ccccc2F)nc1C 814684098 DFGDGYLKOVOFND-UHFFFAOYSA-N 325.412 5.094 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NOCc1ccccc1 853286352 HMKVWICAXFJBBW-UHFFFAOYSA-N 327.268 5.244 30 20 EKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2ccc(C(C)C)cc2)CC1 1776167941 HRNPZRZNVGFHRU-KRWDZBQOSA-N 329.484 5.004 30 20 EKED CC[C@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccccc1 6118507 GFGXDPAZANFFRO-HNNXBMFYSA-N 338.476 5.021 30 20 EKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 59337554 IFFZBTYABSFELE-LLVKDONJSA-N 348.233 5.090 30 20 EKED CCc1ccsc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65680415 ONROIWUYHMQDGD-UHFFFAOYSA-N 348.427 5.227 30 20 EKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccsc1 118678336 OLCXJISTLHUARX-UHFFFAOYSA-N 336.441 5.023 30 20 EKED N#Cc1ccc(-c2nnc(CSc3ccc4ccccc4c3)o2)cc1 133088243 HOHGIJFMVSBLRJ-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C=CCCCN(C)C(=O)Nc1cc2oc3ccccc3c2cc1OC 303932394 XKERQEGWPMXZAA-UHFFFAOYSA-N 338.407 5.025 30 20 EKED CC(O)=Nc1ccc(C)c(N=C(O)N[C@H]2CCCCC23CCCC3)c1 329627940 PPUGYOJSRXFNSB-SFHVURJKSA-N 343.471 5.241 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1sccc1C#N 464363909 LLYQZNFTOAJDCT-HNNXBMFYSA-N 346.455 5.120 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 488647925 TWYHTBVORYACPK-GOSISDBHSA-N 334.444 5.109 30 20 EKED C[C@H](CCc1ccc(Cl)s1)N[C@H](CCCC#N)c1ccccc1 522018817 GEXJIGUJRJNJFR-CRAIPNDOSA-N 346.927 5.747 30 20 EKED C=CC[C@H](C)NC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 523960889 MNQUDZIZDQAVJJ-KBXCAEBGSA-N 345.895 5.254 30 20 EKED C[C@H](NCc1ccc(C#N)o1)c1ccccc1-c1ccc(Cl)cc1 540613577 GAHYVEPBSOAGLW-AWEZNQCLSA-N 336.822 5.322 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1 581840558 PPICVVMGWYHOBF-DEOSSOPVSA-N 340.470 5.878 30 20 EKED CCC(C)(C)OCc1ccccc1NC(=O)CC1(C#N)CCCCC1 597500993 QAASVSQQAABYCO-UHFFFAOYSA-N 342.483 5.194 30 20 EKED CC[C@H](C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 609378028 OTGDYZGDFKZROI-RDJZCZTQSA-N 338.476 5.071 30 20 EKED CC(C)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1 745989831 BXWLHSUSDIVIKZ-XGICHPGQSA-N 343.426 5.432 30 20 EKED N#C[C@H](C(=O)CCCc1ccccc1Cl)c1ccc2ccccc2n1 810522175 YIYAFAPOJCOMQX-KRWDZBQOSA-N 348.833 5.087 30 20 EKED CC[C@@H](Cc1ccccc1C)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 820183678 DCTHMDMTVIXPTB-DOTOQJQBSA-N 340.492 5.020 30 20 EKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCC1 838787814 KAYIIDWFTKGFPE-XHDPSFHLSA-N 344.867 5.076 30 20 EKED N#CCc1ccsc1C(=O)Nc1ccccc1SC1CCCC1 875155075 RLHFCGNPMZWSBS-UHFFFAOYSA-N 342.489 5.101 30 20 EKED Clc1ccc(CNN=Cc2c(Cl)cccc2Cl)c(Cl)c1 914696869 SGLRCYLLWUAUKT-UHFFFAOYSA-N 348.060 5.424 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C(F)F)c(F)c1 1776784192 MUYABTCKCFLKKC-CQSZACIVSA-N 345.405 5.057 30 20 EKED COc1cc(C(=O)/C=C/c2cnc(C3CCC3)s2)ccc1SC 157246462 FNWRKEKOQZTLLF-BQYQJAHWSA-N 345.489 5.037 30 20 EKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C#N)c1 182102925 LXMVGXVDBACJSI-SJKOYZFVSA-N 336.332 5.042 30 20 EKED Cc1ccc(-c2csc3ncnc(SCCCCC#N)c23)cc1 195570982 MNSJOPAGSNIJCQ-UHFFFAOYSA-N 339.489 5.453 30 20 EKED CCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 302979493 CRZUYWWQQMQHFP-DOMZBBRYSA-N 346.883 5.466 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@H]3CCC(=O)C[C@@H]3C)n2)s1 328909062 DKEQNLBQXWQIKY-GWCFXTLKSA-N 348.493 5.027 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc2sccc2c1)c1ccccc1 352207587 ZVYQJKBZXSWPTI-SFHVURJKSA-N 334.444 5.066 30 20 EKED N#CC1CCC(CN[C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 442860436 WQHNKTGYPMSNPT-QLOJAFMTSA-N 338.495 5.133 30 20 EKED N#CC[C@@H](CC(=O)N1CCC[C@H]1CC1CCCCC1)c1ccccc1 475394323 XKKXANZJNKIANX-SFTDATJTSA-N 338.495 5.035 30 20 EKED CC(C)[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 497798869 IWCOSKGVKGTYOP-KSSFIOAISA-N 340.854 5.226 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1/C=C\c1ccccc1)c1ccccc1 505366194 KTZUNMANTNCZSX-GHINXCGLSA-N 331.459 5.051 30 20 EKED C=C(C)CCS[C@@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 507095020 XRNRFVABRYWRRJ-NSHDSACASA-N 346.477 5.417 30 20 EKED N#C[C@H](Sc1nnc(CCC2CCCCC2)o1)C1CCCCC1 523712348 PZHRKOISLPGUDT-INIZCTEOSA-N 333.501 5.147 30 20 EKED C=C[C@@H](CC(=O)N1CCCCC[C@H]1c1ccc(C)o1)c1ccccc1 533946002 GXVMJNZHPJGFEM-ICSRJNTNSA-N 337.463 5.392 30 20 EKED C=C[C@@H](CC(=O)N(CC)[C@@H](C)c1ccc(F)cc1)c1ccccc1 534623908 SPMMIQHVVYYJGD-IRXDYDNUSA-N 325.427 5.095 30 20 EKED C=CCCCSc1nc(O)c2c(-c3ccc(F)cc3)csc2n1 574116912 IRPBAXBEMJHRGJ-UHFFFAOYSA-N 346.452 5.261 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1)c1nc2ccccc2n1C(F)F 585732102 HMCYVTPPRKHNQI-LLVKDONJSA-N 329.375 5.156 30 20 EKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CCCCC#N)c1ccccc1 593987068 FSWVXURBXJWITJ-MRXNPFEDSA-N 340.854 5.518 30 20 EKED Cc1cc(C)cc(Oc2cccc(Cl)c2NC(=O)[C@@H](C)CC#N)c1 598843712 IMSLVYYHUPNSOW-AWEZNQCLSA-N 342.826 5.237 30 20 EKED Cc1nc2ccc(C=NOc3ccccc3C(F)(F)F)cc2s1 754959925 AGJCADFYZCUFTI-UHFFFAOYSA-N 336.338 5.036 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1ccncc1 766019574 MNSUEZDOTADXNI-UZLBHIALSA-N 334.488 5.778 30 20 EKED CC(C)(C)C1CCC(CC(=O)[C@H](C#N)c2cnc3ccccc3n2)CC1 792111086 QGIATMHJXPKILI-OFLPRAFFSA-N 349.478 5.049 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)CCCCCC#N 805881219 SAPHBFFOCBKRTG-OAHLLOKOSA-N 342.464 5.197 30 20 EKED CCCCCCCOc1ccc([C@@H](C)N[C@H]2CCn3ccnc32)cc1 834836099 LIKVAXFZEWKLBG-XLIONFOSSA-N 341.499 5.028 30 20 EKED N#CC1(CCCC[S@](=O)Cc2ccc(Cl)cc2Cl)CCC1 899381934 ULUNJLQUQMURRL-NRFANRHFSA-N 344.307 5.106 30 20 EKED COc1ccc2oc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)c(C)c2c1 154335846 CRWFXPVPSVJCTL-GJZGRUSLSA-N 334.419 5.033 30 20 EKED C[C@@H](Nc1ccc(COCc2ccccc2)cc1)c1cccc(C#N)c1 179929456 HEVZVBSEAFBFCE-GOSISDBHSA-N 342.442 5.448 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCc2c(O)cccc21 188070326 PTMAKJCTHLUDHZ-HXUWFJFHSA-N 349.474 5.303 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccoc3C3CC3)n2)cc1 342637220 MISSXJDIGAVWJV-MRXNPFEDSA-N 348.427 5.079 30 20 EKED CC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(OC)cc1 360822285 PPRAOJZHXQZAKG-FGZHOGPDSA-N 334.463 5.075 30 20 EKED CC(C)(C)c1cc(NC(=O)Cc2cccc(C(F)F)c2)c(C#N)s1 448189451 LZGXXMLLTANFDK-UHFFFAOYSA-N 348.418 5.036 30 20 EKED C[C@@H](c1cccc(C#N)c1)c1nc(-c2c(Cl)cccc2Cl)no1 461800456 IIVICRKZONCOCM-JTQLQIEISA-N 344.201 5.067 30 20 EKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CCCC#N)c1ccccc1 464026921 AVDFMRSIQDIENC-OAHLLOKOSA-N 326.827 5.128 30 20 EKED N#C[C@H](C(=O)c1cc(F)c2ccccc2c1)c1nccc2ccccc12 498978264 JSIPMNHPIFQPAQ-IBGZPJMESA-N 340.357 5.017 30 20 EKED C=CCN(Cc1ccccc1)Cc1csc(-c2cccs2)n1 502329114 YJAFICUDZALIOV-UHFFFAOYSA-N 326.490 5.060 30 20 EKED C=C(C)CN(CC)C(=O)Nc1c(F)cccc1Oc1ccccc1 504176467 GLCLMHYZQKKZHK-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2sccc2[C@H]1C 505061013 IKDPUANKTNCFBW-CQSZACIVSA-N 326.465 5.018 30 20 EKED C=CCCOCCCCC(=O)N1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 539404524 UMOYZYJOYSRLSN-KNQAVFIVSA-N 343.511 5.058 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cc(Cl)sc1Cl 553314611 QXGLYZPDDDVGLK-AWEZNQCLSA-N 337.275 5.094 30 20 EKED N#CC[C@@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 554778871 AOALOJAOCAKUTL-ZDUSSCGKSA-N 348.780 5.304 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(Cl)c1Cl 574979663 XMLBWIIUUPQCFR-APPDUMDISA-N 331.246 5.203 30 20 EKED N#CCCCOc1cccc(NCc2csc(C(F)(F)F)c2)c1 598956717 MKKIYEDYUAFCNJ-UHFFFAOYSA-N 340.370 5.062 30 20 EKED Cc1ccccc1[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)C(C)C 609670136 OFFBMHYVLLGCNO-INIZCTEOSA-N 333.357 5.090 30 20 EKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1csc(C(=O)O)c1 730148932 QBDCMRYIMZJBPS-SREVYHEPSA-N 340.425 5.071 30 20 EKED CCCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCC1 759143764 JLCKUCKGCZFACO-HXUWFJFHSA-N 332.447 5.251 30 20 EKED CCc1nc2ccccc2n1N=Cc1ccc(SC(F)(F)F)cc1 767374850 VZTSBPFOSRBSNV-UHFFFAOYSA-N 349.381 5.093 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccc(C)cc2)C2CCC2)c1 779033771 ZNUYENODOIEVTM-GMAHTHKFSA-N 348.490 5.307 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(C2CCC2)c1 931060950 ZROZOJYRYNVJJP-UHFFFAOYSA-N 338.455 5.104 30 20 EKED Cc1c(NN=C2CCCC[C@@H]2C2CCCCC2)cccc1C(=O)O 1776088048 MIIJOJQYZHMMEQ-QGZVFWFLSA-N 328.456 5.232 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)c1 1776341428 HLCKXCNFAZTUOQ-VURMDHGXSA-N 348.398 5.226 30 20 EKED COc1ccc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)cc1O 7716429 DNFPCUVEPRBMCA-RMKNXTFCSA-N 344.366 5.196 30 20 EKED COc1ccc(CNc2ccccc2S[C@@H](C)CC#N)cc1Cl 179211065 RTLATOVYFFSHJG-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 340437975 XFXKEZSQEFFBGZ-UXHICEINSA-N 326.871 5.816 30 20 EKED COc1ccc([C@@H](N[C@H]2CCCCc3cc(C#N)ccc32)C2CC2)cc1 481636255 ATFSUXACGAPQMR-GOTSBHOMSA-N 346.474 5.075 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 505052560 VFWXPOSHJTXDEW-JOCHJYFZSA-N 334.463 5.001 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C 505058689 YYMIUFVLUGCKHK-PXNSSMCTSA-N 334.463 5.215 30 20 EKED CC1CCC(C)(NC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 520856479 GWLKWFGONYCKSF-XAUUPUKJSA-N 345.512 5.029 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)N(CCC#N)CCC(C)C 530704500 VGOJRDJCTSXUGU-UHFFFAOYSA-N 349.478 5.456 30 20 EKED CC(C)CN(C(=O)c1cccc(-c2ccoc2)c1)c1ccc(C#N)cc1 535532358 JGMHYQWVQLVQFR-UHFFFAOYSA-N 344.414 5.121 30 20 EKED N#Cc1c(Cl)cccc1SCc1csc(-c2ccoc2)n1 537844430 GAFLCICYIUMANM-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 556208579 WGGCIGREEVVQNJ-IFXJQAMLSA-N 347.289 6.079 30 20 EKED CC[C@@H](N[C@H]1COc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 570243277 POGPPCQYOCAAAI-CVEARBPZSA-N 347.245 5.039 30 20 EKED C=CCCCCCN(C)C(=O)c1ccc(COc2ccccc2)cc1 606815862 FWAZPWZVXZQOIT-UHFFFAOYSA-N 337.463 5.084 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1c(C)cc(C)cc1Cl 642419746 PGFZFXQTGNXGEP-UHFFFAOYSA-N 334.872 5.238 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C2CCC2)C1 669367350 DLWLIFXXBGOQTP-GOSISDBHSA-N 326.484 5.192 30 20 EKED CCCN(Cc1ccc(OCC#N)cc1)[C@@H](C)c1cc2ccccc2o1 731211835 DGKGRQZKNWPNBG-KRWDZBQOSA-N 348.446 5.308 30 20 EKED Cc1ccc(SCc2cccc(C(=O)O[C@H](C)CC#N)c2)c(C)c1 733711819 NJVWMKROLILCTP-MRXNPFEDSA-N 339.460 5.055 30 20 EKED C/C(=C\C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)C(C)(C)C 742541116 XKROLAOVSVPIOJ-LFIBNONCSA-N 348.446 5.068 30 20 EKED CCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCC1 759541272 WGFSHYIAVANCHT-MRXNPFEDSA-N 338.476 5.265 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@H]1c1cn(C)nc1C 775183491 VROZJBPABJVJBK-XLIONFOSSA-N 347.547 5.169 30 20 EKED CC1(C)CCCC[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 789404811 FVUGFJGRVOSXBI-CVEARBPZSA-N 338.476 5.203 30 20 EKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc2ccccc2c1 793298881 YPAMMJAPYQCELI-OAQYLSRUSA-N 342.442 5.280 30 20 EKED CC(C)(CCC#N)COC(=O)CCCc1csc2ccccc12 798876094 DZUJNQJPGGLRHR-UHFFFAOYSA-N 329.465 5.097 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(NC(C)=O)c(Cl)c1 886880596 VPZKYARATSVCKJ-UHFFFAOYSA-N 338.879 5.378 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)nc1)c1cccc2ccccc12 917143473 FWJHPYASQSCTIU-BUHFOSPRSA-N 336.394 5.193 30 20 EKED CCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443501 SJVPPZJXTIEFEZ-AWEZNQCLSA-N 332.856 5.220 30 20 EKED Cc1cc(C(=O)Nc2sccc2C#N)sc1-c1ccc(F)cc1 102216575 VIRYXYZTAACWNR-UHFFFAOYSA-N 342.420 5.048 30 20 EKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Cl 118445700 KTXQHMLWVQTYGD-CHWSQXEVSA-N 344.867 5.033 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)C1CCCC1 131008616 ZLRWYLZODQVJLW-AWEZNQCLSA-N 330.497 5.093 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(F)F)c1 170974566 QDEQNCGUBVROHT-GFCCVEGCSA-N 346.402 5.128 30 20 EKED C[C@@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(C#N)cc1 181901574 IRYNMGVMYGDXCL-QVKFZJNVSA-N 347.849 5.047 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2)nnc1-c1ccccc1F 195568983 YXFCGFZFNCMBCL-CQSZACIVSA-N 339.439 5.124 30 20 EKED N#Cc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)c1 215071267 MOCLBJDRNKJKJB-NTMALXAHSA-N 333.774 5.368 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCC1CCC(C#N)CC1 282840458 WEAYHLYVPQZBDM-UHFFFAOYSA-N 341.499 5.385 30 20 EKED CC(O)=Nc1ccc(C)cc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 329086533 UVCRVUSKSJORDY-IXDOHACOSA-N 328.456 5.797 30 20 EKED C=CCC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 435668212 WCWXMCFSQRWIQG-FQEVSTJZSA-N 347.462 5.317 30 20 EKED CCCCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1 480374834 CTNMCGOJDSGRFN-UHFFFAOYSA-N 349.434 5.147 30 20 EKED CC(C)(C#N)CCCSCCOc1c(Cl)cccc1Cl 480391378 ACQSXOISSMBQIM-UHFFFAOYSA-N 332.296 5.435 30 20 EKED N#Cc1ccc(SCc2ccc(C(=O)Nc3ccccc3)cc2)cc1 509631788 DYWVXHOAWDFDRY-UHFFFAOYSA-N 344.439 5.103 30 20 EKED N#Cc1c(NC(=O)c2cc3sccc3s2)sc2c1CCCC2 516481415 YGVDZKCFJYNPKJ-UHFFFAOYSA-N 344.486 5.027 30 20 EKED C=C[C@H](CC(=O)Nc1cnccc1-c1cccc(F)c1)c1ccccc1 536280488 OHPJASYGSJEJOM-MRXNPFEDSA-N 346.405 5.186 30 20 EKED CC(C)(CC#N)CSc1nnc(-c2ccc(C(C)(C)C)cc2)o1 564668523 VFDGCTKLIOYXBM-UHFFFAOYSA-N 329.469 5.066 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc2sccc2s1)c1ccccc1 569254578 QQPPOQCWELSBBX-CQSZACIVSA-N 340.473 5.128 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1sccc1Cl 569959328 SJEVRHBOPPOEIC-UHFFFAOYSA-N 344.848 5.254 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NCc1nc(C#N)cs1 576317201 VIPZNFNJLNQKAF-UHFFFAOYSA-N 343.521 5.360 30 20 EKED CCC1(CC)CCCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 596606772 WDWXRFIFXGUTPJ-LJQANCHMSA-N 341.499 5.033 30 20 EKED N#Cc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 604124751 OJFGIDFJWXPPNH-QFIPXVFZSA-N 346.861 5.285 30 20 EKED C[C@@H](NCc1ccc(N(C)c2ccccc2)cc1)c1cccc(C#N)c1 610346057 JGJGDSCOXGUHLH-GOSISDBHSA-N 341.458 5.177 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C/c2csc([N+](=O)[O-])c2)cc1 728442109 WGWHQFHKBGYGER-FPYGCLRLSA-N 333.434 5.053 30 20 EKED CCOc1cc(/C=C\C(=O)c2ccc(SC(C)C)cc2)ccc1O 728442111 WIJDUMYTQQFRRZ-WZUFQYTHSA-N 342.460 5.188 30 20 EKED C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 758473377 LWCGZNOFZXNMFO-KRWDZBQOSA-N 337.385 5.137 30 20 EKED CCCCCCC[S@@](=O)Cc1csc(-c2ccc(F)cc2)n1 764438375 NVHVXJKUMJQKPQ-JOCHJYFZSA-N 339.501 5.168 30 20 EKED C=CC[C@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccncc1 766017785 DDLANPHBNWMRSH-QAPCUYQASA-N 335.476 5.173 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCSC(C)(C)C 789451165 ISWGSHBRBZXSFL-UHFFFAOYSA-N 334.529 5.192 30 20 EKED CC(=NNc1cccc(F)c1)c1sc(Cc2ccccc2)nc1C 814814998 IIVQBZNFEYKEDY-UHFFFAOYSA-N 339.439 5.018 30 20 EKED CC(=NOCc1ncc(-c2ccccc2)o1)c1cc2ccccc2o1 852754701 KABJRLVBUSXRTF-UHFFFAOYSA-N 332.359 5.029 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CC(C)(C)CC(F)F 878786152 CPOODDNJKOZENT-GFCCVEGCSA-N 340.439 5.091 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1c[nH]c2ccccc12 915271603 FGYGNRFLSPELFS-KHPPLWFESA-N 330.412 5.188 30 20 EKED COc1cc2c(cc1N=Cc1cccc(OC)c1O)oc1ccccc12 920942610 LSLYJMHVAPYCNX-UHFFFAOYSA-N 347.370 5.059 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(Cl)ccc1Cl 62369025 NUFGNCAWWIRMRB-UHFFFAOYSA-N 349.261 5.256 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 90665364 GMQPQDZGKCGLHW-KDOFPFPSSA-N 343.268 5.145 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc2ccccc12 108238219 NSIWYDHLHYDLID-OAHLLOKOSA-N 346.455 5.344 30 20 EKED CC[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 180549219 QERALBVJDJTYHI-GOSISDBHSA-N 349.261 5.137 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1c(C)nn(CC)c1C 191428886 ULAAMILNHPPMSO-UHFFFAOYSA-N 340.471 5.016 30 20 EKED CC(C)Oc1ccc([C@H]2CCC[C@@H]2NCC2CCC(C#N)CC2)cc1 442867708 MCKQOOSRZPCAMV-MEZULJMPSA-N 340.511 5.029 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccccc2)C2CCC2)cc1 517898113 OKPJURHJRBZNCC-HXUWFJFHSA-N 347.462 5.151 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(Cl)cc1Cl 548586911 ZNBPWFKRJHNFDN-UHFFFAOYSA-N 338.259 5.524 30 20 EKED CCCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](CC)c1ccccc1 558352021 YXDHOWDKZKIFCV-FQEVSTJZSA-N 335.451 5.148 30 20 EKED C=C(C)COc1cccc(NC(=O)c2cc3sccc3s2)c1 589383077 WYYVKMCTZIKQMX-UHFFFAOYSA-N 329.446 5.170 30 20 EKED CCOc1ccc(C(F)(F)F)cc1N[C@H](C)c1cccc(C#N)c1 600847168 AXCQWOZHGSYBHM-GFCCVEGCSA-N 334.341 5.149 30 20 EKED CC(=O)Nc1c(C)ccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1C 619508505 FAJLLQSHIYDDES-NRFANRHFSA-N 347.462 5.013 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Cl)c2Cl)cc1 619514802 WHZCAFUVFHKEJA-UHFFFAOYSA-N 333.218 5.047 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC2(CC1)CC2 626534414 KSZWPWAHSQKARA-UHFFFAOYSA-N 326.484 5.337 30 20 EKED C=CCC[C@H](NCc1oc(C)nc1C)c1ccc(C(F)(F)F)cc1 685571481 HLXSILKHYXWCSI-INIZCTEOSA-N 338.373 5.107 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C\c1ccc(OCc2ccncc2)cc1 731321668 NFXFVMCZCPSYSV-WTKPLQERSA-N 347.389 5.004 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(C)cc1 739144470 ZHFHCMRWMMQAPV-NVXWUHKLSA-N 348.471 5.365 30 20 EKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1cccc(Cl)c1 746047703 PWYYSUUBOLPMIX-QUCCMNQESA-N 342.870 5.262 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 757306202 PWYNQLTVIAHBOT-GFCCVEGCSA-N 332.856 5.096 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(OCCC(C)C)cc1)c1ccncc1 766020998 SEIHPFASBWCWQW-XMSQKQJNSA-N 338.495 5.475 30 20 EKED C#CCCCCC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1 773396368 JUYKCYQSHDLLGV-GOSISDBHSA-N 349.474 5.075 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)Cc1ccc(C(F)(F)F)cc1 780743416 BHFBWWMTDSJKDB-KGLIPLIRSA-N 348.368 5.039 30 20 EKED Cc1ccc(Oc2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2)nc1 785530670 VZSCHPDMDQYHMU-INIZCTEOSA-N 329.403 5.227 30 20 EKED CCCCCCC[C@H](C)CNC(=O)Nc1ccc(NC(C)=O)c(C)c1 918031186 WHSSYAVFDATMDV-HNNXBMFYSA-N 347.503 5.072 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)CCc1ccc(C#N)cc1 10406476 NFPKATMGSYQYKE-UHFFFAOYSA-N 334.463 5.376 30 20 EKED N#C[C@@H](C(=O)CCCc1ccccc1)c1nc(-c2ccccc2)cs1 51534061 QTZWDMBEZMUFOM-SFHVURJKSA-N 346.455 5.009 30 20 EKED CC(C)c1noc([C@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)n1 60036137 PDZOCOLODRFTFK-AWEZNQCLSA-N 348.406 5.030 30 20 EKED CCc1cccc(CC)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66157976 PEEKMARYSRDKRJ-UHFFFAOYSA-N 349.478 5.126 30 20 EKED CCc1ccc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)s1 107842379 GDELPNANMQRKHO-WEVVVXLNSA-N 349.455 5.181 30 20 EKED N#C[C@@H](Sc1nn(-c2ccccc2)c(=S)s1)C1CCCCC1 115185336 FCFJUQYVHRCVMK-CQSZACIVSA-N 347.534 5.228 30 20 EKED CN(C)C(=O)Sc1cccc(CSCCCC(C)(C)C#N)c1 161931345 XPWUNKXTOXRHFX-UHFFFAOYSA-N 336.526 5.023 30 20 EKED C[C@@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 174067409 HHTJAXOPIUKPGL-HUUCEWRRSA-N 333.460 5.094 30 20 EKED C=CCC[C@H](NCc1csc([C@@H](C)OCC)n1)c1ccccc1 180043916 IMRWZQLCYGFCHD-QAPCUYQASA-N 330.497 5.038 30 20 EKED N#C[C@@H](C(=O)c1cccc(Oc2ccc(Cl)cc2)c1)c1ccccn1 182060207 OZNOOGKATAJTFI-GOSISDBHSA-N 348.789 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc([N+](=O)[O-])c1C 189880907 ICKQYIXVHJJDIK-UHFFFAOYSA-N 338.407 5.007 30 20 EKED N#Cc1ccc(NCc2ccc(C(F)F)cc2)c(C(F)(F)F)c1 301781763 SITMQRJAHITHPH-UHFFFAOYSA-N 326.268 5.127 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1cccc(OCc2ccccc2)c1 442866050 HIXCVRGOLRMMTF-HDYDNRTBSA-N 348.490 5.246 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC1CC(F)(F)C1 455244411 JXRUSTILUHTTME-UHFFFAOYSA-N 336.426 5.095 30 20 EKED Cc1ccc([C@@H](Nc2ccc(Cl)cc2C#N)c2ccccn2)cc1 480581758 RWNWYYVJYONDQV-HXUWFJFHSA-N 333.822 5.117 30 20 EKED Cc1c(C(=O)Nc2ccc(Cl)c(C#N)c2)oc2c(Cl)cccc12 494737715 IBWVDRCCXXSNPC-UHFFFAOYSA-N 345.185 5.172 30 20 EKED CC(C)[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(F)c1 542846379 JYCMWZGVVFNJNF-HXUWFJFHSA-N 344.405 5.457 30 20 EKED C=C[C@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 556076292 JZGJLJMTEIFIFF-GFCCVEGCSA-N 335.781 5.576 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(C(F)(F)F)c1 557518211 WHHFBYOIXDZDJS-DJJJIMSYSA-N 344.380 5.305 30 20 EKED CCC(CC)[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1ccccc1 610400723 CQSBCUPTEYSRBM-IERDGZPVSA-N 349.478 5.096 30 20 EKED CC(C)Oc1cccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)c1 611390961 XPKGQHSVTXIRNO-AOMKIAJQSA-N 334.463 5.074 30 20 EKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 613402521 CJIYENQBLIVMIP-CQSZACIVSA-N 340.835 5.057 30 20 EKED C#Cc1cccc(NC(=S)N[C@@H](C)c2cccc(Cl)c2Cl)c1 735422793 CQDIXYPLSWBRJS-NSHDSACASA-N 349.286 5.022 30 20 EKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1cccc(-c2ccncc2)c1 741840877 GQCZUJPOVPXOCY-AATRIKPKSA-N 343.357 5.530 30 20 EKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 747194120 TWCCNOKVVPCCLQ-IAGOWNOFSA-N 340.492 5.273 30 20 EKED Cc1cccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)C(C)(C)C)c1 776163480 RZTPYDCPSSRVIO-DYESRHJHSA-N 336.479 5.335 30 20 EKED CSc1ccc(C(=O)/C=C/c2ccc3cnccc3c2)c(Cl)c1 782351737 NQIDSRRDJSPWCJ-XVNBXDOJSA-N 339.847 5.506 30 20 EKED CCCCCC[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 786955928 AXRMXLAXKZEAFD-QGZVFWFLSA-N 341.499 5.040 30 20 EKED C#CC[C@H]1CCCN(C(=O)Nc2ccc(SC(C)(C)C)cc2C)C1 831412295 QMFMSVXWEGDIPH-INIZCTEOSA-N 344.524 5.153 30 20 EKED Cc1cc(/C=C/C(=O)c2ccccc2)cc(C)c1OCc1ccccn1 915114212 GRZBCALALXSVIO-VAWYXSNFSA-N 343.426 5.174 30 20 EKED CSc1ccc(C(=O)/C=C/c2c[nH]nc2-c2ccc(C)cc2)cc1 920063947 MOSKLWUAJBWWTM-FMIVXFBMSA-N 334.444 5.003 30 20 EKED CCCCCCCCC[C@H](C)CC=NNc1ccccc1C(=O)O 1776030541 NJHGOBTZYJTEIR-KRWDZBQOSA-N 332.488 5.949 30 20 EKED CC(CCCCCCC(=O)O)=NNc1cccc(Cl)c1Cl 1776080799 CMHTZCXABROBES-UHFFFAOYSA-N 331.243 5.206 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776114720 YPEBNNHTAXWXKV-UUASQNMZSA-N 342.394 5.256 30 20 EKED Cc1cccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1Cl 179063214 AMWCHHIFJQBCMF-GFCCVEGCSA-N 344.867 5.153 30 20 EKED CC(C)[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 303156891 GKTTYMBCZYADSK-FQEVSTJZSA-N 334.463 5.256 30 20 EKED CC[C@@H](CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)c1ccc(C)cc1 303865194 PPEPBJWQARSEGQ-ICSRJNTNSA-N 348.490 5.360 30 20 EKED C/N=C(/O)c1cc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)ccc1Cl 329028505 WJHWVKDXOCMSOP-AEGPPILISA-N 348.874 5.469 30 20 EKED C/N=C(/O)C[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1ccccc1 329076221 AQHIQJOWDYYMRE-KANFNMMFSA-N 342.483 5.267 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2C)c(C)c1 438912049 MLALIYAKBXFBKF-HNNXBMFYSA-N 338.476 5.318 30 20 EKED CC(C)[C@H]1CN(C(=O)N[C@@H](CCC#N)c2ccccc2)c2ccccc21 447752534 HACUYVCGXQTSAN-UXHICEINSA-N 347.462 5.001 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C)c1C 479751234 IIQNLCALJOFZGA-UHFFFAOYSA-N 334.872 5.238 30 20 EKED CC(C)COc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512641123 DKHBLPDKGPEODG-JKSUJKDBSA-N 340.442 5.144 30 20 EKED C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)c1ccc(C#N)cc1 522822830 WJMGMQIVKLACAN-SECBINFHSA-N 342.773 5.479 30 20 EKED N#CCCSc1ccccc1NCCc1c(F)cccc1Cl 541800130 SWOOWIPGQXWSSC-UHFFFAOYSA-N 334.847 5.139 30 20 EKED C=CCC(C)(C)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 550738420 YFWRIEDOBNJUOG-ZDUSSCGKSA-N 346.471 5.037 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccccc1OCc1ccccc1 554067599 RHNHZMVBKRBTEG-GOSISDBHSA-N 336.479 5.246 30 20 EKED C=CCC[C@@H](NCc1cncc(F)c1)c1ccc(C(F)(F)F)cc1 580057455 LPARQBBSBZWJKN-QGZVFWFLSA-N 338.348 5.037 30 20 EKED Cc1c(COC(C)(C)C)cccc1NC(=O)CC1(C#N)CCCCC1 597338670 RMVOZLMANKUFRP-UHFFFAOYSA-N 342.483 5.113 30 20 EKED Cc1nc(-c2ccc(N[C@@H]3CCCc4cc(C#N)ccc43)cc2)oc1C 611482457 KYSQAPMLAYVOAL-OAQYLSRUSA-N 343.430 5.320 30 20 EKED C=CCC[C@@H](NCc1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 683020733 VWYIIWBYDSSFKJ-GOSISDBHSA-N 334.385 5.206 30 20 EKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(O)c(F)c1 728438703 LNENWJMSLICOQS-GORDUTHDSA-N 344.691 5.100 30 20 EKED CCc1cccc(CC)c1NC(=S)N(CCC#N)CC(CC)CC 729642742 SKGGJUFFRDDSNS-UHFFFAOYSA-N 345.556 5.160 30 20 EKED CCOc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990550 UCDRAAPOHLUTAQ-XGICHPGQSA-N 329.399 5.043 30 20 EKED C=CC[C@H](NC(=O)C/C=C/c1ccc(C(C)C)cc1)c1ccncc1 764242395 HCQHODBDYWTCHT-XYASWCNUSA-N 334.463 5.042 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(SC2CCCC2)cc1 765011403 ALQPQQBVFCRPMN-INIZCTEOSA-N 336.504 5.444 30 20 EKED CC1(C)CC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 768869310 USTUJVLLONQQPR-PMACEKPBSA-N 347.462 5.042 30 20 EKED C[C@@H](CC#N)NC(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 775540401 KREWNICYCPQXLG-NSHDSACASA-N 348.233 5.084 30 20 EKED FC(F)C1CCC(=NNc2nc(Cl)c(Cl)cc2Cl)CC1 799471698 GBLUSIRTFWIYJP-UHFFFAOYSA-N 342.604 5.265 30 20 EKED C=CC[C@H](N[C@@H](C)CC(C)(C)c1c[nH]c2ccccc12)c1ccncc1 812716700 PFCRBSGNQOVCIQ-UWJYYQICSA-N 347.506 5.526 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cccc(C3CC3)c2)c1 815593762 WHUZYTMBHYJNFS-IERDGZPVSA-N 334.463 5.096 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)c1scnc1C1CCCC1 839434659 FHQZEDZTECIEJK-UHFFFAOYSA-N 347.443 5.078 30 20 EKED C[C@@H](C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc2ccccc2c1 842941092 NKVROLNEOJXGAB-ACJLOTCBSA-N 346.455 5.154 30 20 EKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)cc1 845553405 RMLCLSUXHCVUAT-SMDDNHRTSA-N 346.883 5.074 30 20 EKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccccc2)cc1OC 916545475 KGPHEBIHZYLDAC-KTKRTIGZSA-N 330.811 5.034 30 20 EKED CCC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 90664438 KBGLZDLJWOCPDN-WOJBJXKFSA-N 337.423 5.071 30 20 EKED N#Cc1csc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 177681306 ADNIYEBOFBLMAF-IBGZPJMESA-N 338.863 5.152 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 255696920 YDJIHSAUYKLCBJ-UNJUUPHPSA-N 344.867 5.200 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)SCCC(C)(C)C#N 289391553 LUGUPVZETBKRSA-GJZGRUSLSA-N 332.513 5.200 30 20 EKED Cc1c(C(=O)N[C@]2(C#N)CCC[C@@H](C)C2)oc2c1ccc1ccccc12 303638806 HJMSQAXXGXQHGM-JLCFBVMHSA-N 346.430 5.097 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 376867058 QBPGBDBMHDDGDX-IRXDYDNUSA-N 327.431 5.032 30 20 EKED Cc1noc(C)c1-c1ccc(OCc2ccc(C#N)cc2Cl)cc1 432306926 KIQQQKOACJDYSX-UHFFFAOYSA-N 338.794 5.063 30 20 EKED C[C@H](NCCCC(C)(C)C#N)c1cccc(OCc2ccccc2)c1 444687779 BVFQMZWBNLQKDI-SFHVURJKSA-N 336.479 5.246 30 20 EKED N#CCCSc1ccccc1NCc1cccc(Cl)c1Cl 446622361 CVUCFIKHUFJOAP-UHFFFAOYSA-N 337.275 5.611 30 20 EKED Cc1ccccc1N(C(=O)CC(C)(C)C#N)c1nc2ccccc2s1 447180528 JBNMZISBLDLZPC-UHFFFAOYSA-N 349.459 5.209 30 20 EKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)c1 476315942 VWPMTFKVMPCFTO-IRLDBZIGSA-N 346.474 5.055 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)Cc1c(F)cccc1C#N 507770661 YGHXWUVRIUDMQE-UHFFFAOYSA-N 338.426 5.125 30 20 EKED Cc1ccccc1[C@@H](C)Nc1ccc(Oc2ccnc(C#N)c2)cc1 515024475 PYEBQFVLUDQXOF-MRXNPFEDSA-N 329.403 5.227 30 20 EKED CC(C)CCc1ccccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 521220726 GSEINSGMAVSMQI-MRXNPFEDSA-N 335.451 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)Cc1ccsc1 530553327 JQGJOUDFNTUITM-OAHLLOKOSA-N 342.508 5.353 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 536838664 MBIPKBBZVAZGLO-ACJLOTCBSA-N 333.262 5.689 30 20 EKED CC(C)c1ccc(C[S@@](=O)Cc2ccc(C#N)cc2)c(C(C)C)c1 610482203 IKMJVSKXRCGWCH-DEOSSOPVSA-N 339.504 5.254 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(Cl)c1SC(F)F 729567162 BHVGJEGUZBESSZ-UHFFFAOYSA-N 334.819 5.085 30 20 EKED CCn1cc(/C=C/C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cn1 732528908 FLLKFSFYMJMGPO-FPYGCLRLSA-N 342.851 5.181 30 20 EKED COc1cc(C=NOCc2ccc3ccccc3c2)ccc1OC(C)C 739899868 WFFGMYWLSOTJNN-UHFFFAOYSA-N 349.430 5.186 30 20 EKED C[C@H](NC(=O)CCCc1ccc(C(C)(C)C)cc1)c1cccc(C#N)c1 743777443 VLDPYLLYOSVMSR-KRWDZBQOSA-N 348.490 5.056 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccccc2C#N)cc1 755600789 KNYAHUHJBNSHBR-PFONDFGASA-N 339.394 5.130 30 20 EKED COc1cccc2cc(C(=O)/C=C/c3cnc(C4CCC4)s3)oc12 760264907 SNSVQZRYIBYQLH-CMDGGOBGSA-N 339.416 5.062 30 20 EKED CCCCCCCC(=O)N1CCCC[C@H]1c1nc2ccccc2o1 762430724 OIHOMWRSTCACCV-KRWDZBQOSA-N 328.456 5.242 30 20 EKED C#CCCCCCC(=O)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1 779920514 KVROXSJCGQZWPF-SFHVURJKSA-N 349.474 5.123 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccccc1SC(F)F)c1ccccc1 792878619 VKNTVLHLBMLCOY-AWEZNQCLSA-N 346.402 5.027 30 20 EKED C=CCC[C@H](Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1)c1ccco1 796918624 QFLJLAVCJDGOQX-QKLQHJQFSA-N 340.467 5.013 30 20 EKED CCCCCCCC(=O)Nc1ccccc1-c1ncc2n1CCCC2 798241459 XUQFRJCFCUYMRZ-UHFFFAOYSA-N 339.483 5.185 30 20 EKED C=CCC(F)(F)C(=O)Nc1ccccc1-c1nc2ccccc2s1 814875500 KIKVTXCVYHDFOP-UHFFFAOYSA-N 344.386 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@]1(C)CC1(Cl)Cl 830898285 YMTFXTRPKOZZMR-QGZVFWFLSA-N 340.294 5.451 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Nc1ccc(CCC#N)cc1 905855262 JXVNDGDTDJHCNO-QGZVFWFLSA-N 349.478 5.014 30 20 EKED CCCCCCCCC(=O)Nc1cc(NC(=O)CC)ccc1Cl 916427431 JALDZSQMEHSHEG-UHFFFAOYSA-N 338.879 5.378 30 20 EKED O=C1/C(=C\c2csc(-c3ccccc3)n2)Cc2c(Cl)cccc21 921263937 LJCBMPMJIWXPIK-LCYFTJDESA-N 337.831 5.286 30 20 EKED CCCCCCC[C@@H](C)CNc1cc(C)c([N+](=O)[O-])cc1C(=O)O 1776782287 CFGRLRPDHXUMOM-CYBMUJFWSA-N 336.432 5.010 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1Cl 37748455 HTKPNNAQQBPNQB-JTQLQIEISA-N 339.653 5.369 30 20 EKED CCSCc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 80454322 SAMIUNTVKFEDPS-HNNXBMFYSA-N 344.505 5.010 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1c(F)cccc1Cl 181736576 NZPGKLVSALZLLJ-CYBMUJFWSA-N 330.834 5.131 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 195656630 SLIMJTVMBARDSX-CQSZACIVSA-N 348.368 5.561 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(CCC)nc1C 294968771 RIFCSKUIAPIGOL-UHFFFAOYSA-N 326.440 5.040 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(CO[C@H]2CCC[C@H](C)C2)c1 303840281 LYHUGEYAPAQYME-PXNSSMCTSA-N 344.499 5.212 30 20 EKED COc1ccc(C#N)cc1CNc1ccc(C(C)(C)C(F)(F)F)cc1 432321663 VUKVSQCRXIMOMB-UHFFFAOYSA-N 348.368 5.019 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc(C#N)cs1 437690258 VRRANWCEFQVDQL-OAHLLOKOSA-N 346.455 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@](C)(CC)C1 475563661 JMJYQJSVEHYVKN-NRFANRHFSA-N 328.500 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCC[C@H](C)C1 475581114 DVBYGQURHPXXCQ-WMZOPIPTSA-N 328.500 5.581 30 20 EKED Cc1ccc(-c2nnc(SCCCCC#N)n2-c2ccccc2)cc1 489465060 RGYDWCURMFHYHY-UHFFFAOYSA-N 348.475 5.029 30 20 EKED C=CCOc1cccc(CN[C@H](C)c2ccc(SCC)cc2)c1 504029696 DLGZVVGDNRQCDO-MRXNPFEDSA-N 327.493 5.214 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccc3ccccc23)C(F)(F)F)cc1 510396250 KNZARIAAKZHQPK-IBGZPJMESA-N 340.348 5.105 30 20 EKED N#Cc1cc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)ccc1F 518011521 OWUMQMCWWYGQTK-GOSISDBHSA-N 349.236 5.245 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 552607076 MQRLVOLWFAISCG-HOCLYGCPSA-N 339.401 5.014 30 20 EKED Cc1csc(NC(=O)c2cc3c(Cl)cccc3s2)c1C#N 589034828 KZLNGMWLUBMYBV-UHFFFAOYSA-N 332.837 5.049 30 20 EKED CC(C)CCC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609930286 YJYBYXDRIDCXSR-HZPDHXFCSA-N 347.528 5.417 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 614178728 BSQRCUGYTYCUFV-ZDUSSCGKSA-N 347.289 5.645 30 20 EKED CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)ccc1OC 619755933 ZQZNLWLYNZGZIW-KRWDZBQOSA-N 349.261 5.115 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 755665840 RKNMHYXJSRWRHW-AAEUAGOBSA-N 332.444 5.074 30 20 EKED FC(F)(F)c1ccccc1ON=CC1CCC(C(F)(F)F)CC1 767386264 CKSXZAZCQZZBPN-UHFFFAOYSA-N 339.279 5.439 30 20 EKED Cc1ccc(C)c2c1CC/C(=C/c1csc(-c3ccccn3)n1)C2=O 769746753 LRAMMFWJWPTNND-PTNGSMBKSA-N 346.455 5.034 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1O 806142804 QXPPZHSWPJTRNA-DIFFPNOSSA-N 349.261 5.373 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCCc2cc(SC(F)F)ccc21 806176212 JOKQFLGREVUGGE-INIZCTEOSA-N 338.467 5.298 30 20 EKED CCCCc1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033341 KHSJRMCFQJZZHH-UHFFFAOYSA-N 344.842 5.217 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C/c1ccc(Cl)cc1 1776783035 DIAXIELBSIGYFD-DVBCCOPCSA-N 337.891 5.147 30 20 EKED CCC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccn1 91412247 ZWGVBAPIHVRRDC-JOCHJYFZSA-N 341.458 5.251 30 20 EKED CC(C)(C)c1cc(CSc2ccc(C#N)c(C(F)(F)F)c2)no1 430148741 TUVAOGJZWFKTCT-UHFFFAOYSA-N 340.370 5.155 30 20 EKED Cc1ccccc1[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)C(C)C 438846747 KRMYSFQTHOAFLG-SFTDATJTSA-N 349.478 5.036 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)c(Cl)c1 439454622 NWLLLMJCGUBHSS-SFHVURJKSA-N 331.246 5.106 30 20 EKED CC[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 447537394 VNMYEHLKFCZAIK-PKTZIBPZSA-N 344.433 5.528 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481998812 JOIXQDKQHRPWEM-JOCHJYFZSA-N 345.446 5.120 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1ccccc1 487349332 BDHHVGLLIOQQBM-WLRLJWMZSA-N 338.495 5.144 30 20 EKED CCOc1ccc(C(C)=O)cc1CS[C@H](C)c1ccc(C#N)cc1 522840366 HJIOFZICYRUKMC-OAHLLOKOSA-N 339.460 5.154 30 20 EKED CC[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 523703156 IVBFBQDTXOFDME-INIZCTEOSA-N 348.899 5.325 30 20 EKED CCC[C@H](NCc1ccc(C#N)s1)c1cccc(C(F)(F)F)c1 539497547 KSIPBKHOSZPPKB-INIZCTEOSA-N 338.398 5.270 30 20 EKED Cc1ccccc1C(NCc1ccccc1C#N)c1ccccc1C 546886260 MPTNAAYFVHPKJZ-UHFFFAOYSA-N 326.443 5.054 30 20 EKED C[C@@H]1CCC[C@H](OCc2cccc(NCc3ccc(C#N)s3)c2)C1 552554254 BFTWLKZPXMXLBF-QAPCUYQASA-N 340.492 5.327 30 20 EKED C[C@@H](NCc1ccc(C(C)(F)F)cc1)c1ccc(C#N)cc1Cl 559878762 VIZSQCZHWMHDEY-GFCCVEGCSA-N 334.797 5.174 30 20 EKED N#Cc1cccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1F 565862244 XHHVLSBWJFLICJ-GOSISDBHSA-N 349.236 5.245 30 20 EKED C[C@@H](Nc1ccccc1COCc1ccccc1)c1cccc(C#N)c1 573229984 OCEBHGOLEAEFIK-GOSISDBHSA-N 342.442 5.448 30 20 EKED N#CCC1CCN(c2ccnc3ccc(Oc4ccccc4)cc23)CC1 579548512 NVDRQVXZTZVZOT-UHFFFAOYSA-N 343.430 5.157 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Cl)cc1 609432815 FQQWJWOMTRCBAT-LBPRGKRZSA-N 345.855 5.378 30 20 EKED CCCOc1ccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)cc1OC 609503889 DHXIPPUYALNSSI-ZDUSSCGKSA-N 344.842 5.182 30 20 EKED N#Cc1cccc(CN[C@H](CCCc2ccccc2)c2ccccc2)c1 611697172 YJIXTIBMSRFKSW-XMMPIXPASA-N 340.470 5.412 30 20 EKED CC(C)(C#N)c1ccc(CNC(C)(C)c2cccc(Cl)c2F)cc1 614186343 HLWNCPWCAMAGMU-UHFFFAOYSA-N 344.861 5.305 30 20 EKED C=C(C)C[C@@H](C)C(=O)OCC(=O)Nc1c(C(C)C)cccc1C(C)C 767704257 XDQPLWMEEZFURX-MRXNPFEDSA-N 345.483 5.017 30 20 EKED CSc1ccccc1[C@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 800010930 CPMFOZAYYRXZNW-RDJZCZTQSA-N 339.460 5.100 30 20 EKED CCCCCCCCCC(=O)N1CC2(CCOCC2)[C@H]1c1ccco1 855601050 RPCGZOKLSZELOB-HXUWFJFHSA-N 347.499 5.100 30 20 EKED Clc1cccc(Cl)c1C=NNc1ccc(Br)cc1 912828078 LEZKRCGMVBQXMN-UHFFFAOYSA-N 344.039 5.202 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](CCC(C)C)C(=O)O)cc1 1776786519 QEHDUVKPOVUEBN-FQEVSTJZSA-N 349.515 5.015 30 20 EKED CC(C)c1ccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c(C(C)C)c1 44246914 ZHUUBGMCZNFENG-UHFFFAOYSA-N 349.478 5.469 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(Cl)s1 78481748 YCSYVKPCQPRBQB-ONEGZZNKSA-N 337.878 5.483 30 20 EKED CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 185198217 FVUCHSYLLCSJAT-JKSUJKDBSA-N 345.512 5.125 30 20 EKED CC(/C=C\C(=O)c1ccc(NC(=O)NC(C)C)cc1)=C\c1ccccc1 208021217 DGIUAJWHMMQHBA-KKYHCHHNSA-N 348.446 5.059 30 20 EKED CC(C)c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)s1 352190459 DDAZGMOESGHEBB-MRXNPFEDSA-N 326.465 5.036 30 20 EKED N#CCCC[C@@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 353894757 ACGGTHMCAZTCCS-OAHLLOKOSA-N 338.398 5.292 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425686245 VSTPVZMLGNVLGU-MRXNPFEDSA-N 349.478 5.216 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430590334 KPNLAVBAYWKSBG-OAHLLOKOSA-N 340.492 5.228 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cccc(C#N)c1 464370624 ZXMWYKAJWGQAAV-KRWDZBQOSA-N 340.426 5.058 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1ccccc1)c1ccco1 481934600 SRCCTBKMCNKFSD-GGAORHGYSA-N 342.442 5.298 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc2ccc(O)cc12 485518344 MLTAWFBOHMAFCR-UHFFFAOYSA-N 335.428 5.076 30 20 EKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(C#N)s1 487546327 YQABCYFFQNNVDR-HNNXBMFYSA-N 346.455 5.120 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1ccc(C#N)cc1F 507028514 YIURAYYPGHKJBA-LBPRGKRZSA-N 337.423 5.302 30 20 EKED Cc1cc(Cl)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1C 511617665 NSDUGYKFQXGAPC-UHFFFAOYSA-N 346.883 5.440 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 539495785 DUDFXWUKVQEXAG-KSFYIVLOSA-N 346.861 5.652 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](c2ccc(C)cc2)C1 554576258 SXXZWEBFUANBFC-FQEVSTJZSA-N 334.463 5.135 30 20 EKED CCSc1ccccc1-c1noc(C[C@@H](CC#N)c2ccccc2)n1 599180395 MSSUMNQMVHTVDV-MRXNPFEDSA-N 349.459 5.089 30 20 EKED CC(C)c1ccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c(C(C)C)c1 610318628 CQLQHLAALLEWTG-INIZCTEOSA-N 349.478 5.688 30 20 EKED CC(C)CC(=O)Nc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1 611466583 PSZYMWSGXCVLBF-OAQYLSRUSA-N 347.462 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)C(C)(C)CO2 643779762 PKRKJDWKCMZZKF-UHFFFAOYSA-N 349.474 5.461 30 20 EKED C=CCC[C@H](Nc1nnc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 683459415 SEHNWTMPBOFPGY-AWEZNQCLSA-N 337.345 5.085 30 20 EKED CCOc1cccc(C=Nc2ccc(COC3CCCC3)cc2)c1O 739427790 ZKBRGHPWZVLQHI-UHFFFAOYSA-N 339.435 5.001 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)s1 741470839 WMXLKKNOWXFRDB-FPLPWBNLSA-N 348.471 5.399 30 20 EKED Clc1cccc(C=NOCc2ccc3ncccc3c2)c1Cl 769807873 CDOBXFFMTUKNJG-UHFFFAOYSA-N 331.202 5.092 30 20 EKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100191 KRHVSZJSIIITSC-XUDAUXSOSA-N 346.817 5.168 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nccc3ccccc23)CCC(F)(F)CC1 850985104 DHCHYCCARMENJL-MRXNPFEDSA-N 342.389 5.017 30 20 EKED CC(C)OCc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1 920178012 NODCNWCTPIARJY-UHFFFAOYSA-N 338.234 5.375 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)cc1F 108408295 BNNOTSPMHSNHJO-CHWSQXEVSA-N 332.419 5.390 30 20 EKED Cc1ccc(-c2nc(N=C(O)[C@@H]3CCC(=O)[C@@H](C)C3)sc2C)s1 329006688 XWRXHXOSMFJIOA-JOYOIKCWSA-N 348.493 5.082 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)cc2cccnc12)c1ccccc1 353912175 DTUDPSOVEJPBPC-HXUWFJFHSA-N 349.865 5.413 30 20 EKED CC(C)(C)c1csc(NC(=O)c2ccc(C(F)F)cc2)c1C#N 410932425 YCBAKNBIXHXIJD-UHFFFAOYSA-N 334.391 5.107 30 20 EKED CC[C@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)cc1 447584553 GFEUVJCJKCNNII-QFIPXVFZSA-N 334.463 5.581 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccco1 455388944 VQGBTDOWRPQMHK-LJQANCHMSA-N 336.435 5.157 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CSC)cc1 476169427 YFPZCRCPEACIEM-UHFFFAOYSA-N 339.504 5.654 30 20 EKED C[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 480803135 HOLWUYKPTJEKGF-INIZCTEOSA-N 349.434 5.004 30 20 EKED C=CCC[C@H](C(=O)Nc1cc(-c2ncco2)ccc1C)c1ccccc1 489623135 VNKVJZFPIXRKQG-IBGZPJMESA-N 346.430 5.339 30 20 EKED N#CCCCOc1cccc(NCc2ccsc2C(F)(F)F)c1 527641380 ALMQEDZEYZWJRZ-UHFFFAOYSA-N 340.370 5.062 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1Cc2c(Cl)cccc21 529134084 BMGQYFMEYBWDLG-SFHVURJKSA-N 339.866 5.470 30 20 EKED CC(C)(C)c1cc(NC(=O)CCSc2ccccc2)c(C#N)s1 536010586 HYUZEDBWBHSPEG-UHFFFAOYSA-N 344.505 5.038 30 20 EKED CCC[C@@H](NCc1ccccc1C#N)c1cccc(C(F)(F)F)c1 538158019 KVOMTESZZUCHGJ-GOSISDBHSA-N 332.369 5.208 30 20 EKED Cc1c([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)oc2ccccc12 614185190 RPXFJZMHVNKFSU-INIZCTEOSA-N 332.447 5.393 30 20 EKED CCCCC[C@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 742648752 AZHTYQYWGJRBLS-HOTGVXAUSA-N 332.513 5.483 30 20 EKED CN(CCC#N)c1ccc(CNc2cccc(C(F)F)c2Cl)cc1 757934456 AGAFXFKBIXJUFD-UHFFFAOYSA-N 349.812 5.240 30 20 EKED CC[C@H](Nc1ccc(OCC(F)(F)F)cc1)c1ccc(C#N)cc1 774275766 YKRMNSROJSCGDP-KRWDZBQOSA-N 334.341 5.063 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1cc(Cl)sc1Cl 782887275 KKWRNSVYAOSSJR-SNAWJCMRSA-N 334.227 5.499 30 20 EKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc2ccccc2c1 793298873 YPAMMJAPYQCELI-NRFANRHFSA-N 342.442 5.280 30 20 EKED C=CCCCCCCNC(=O)Nc1cc(-c2nc(C)co2)ccc1C 806347665 GETUGSKRQPVYOS-UHFFFAOYSA-N 341.455 5.216 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc(C3CC3)c2)c1 815593764 WHUZYTMBHYJNFS-KKSFZXQISA-N 334.463 5.096 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)CC(C)(C)C 917041577 VNKMDOFTZIAMGN-QWHCGFSZSA-N 347.409 5.070 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1F 1776130913 ADWAAGNXUJLFOJ-KAMYIIQDSA-N 346.357 5.087 30 20 EKED Cc1c(C(=O)Nc2ccc(CC#N)cc2)oc2c1ccc1ccccc12 16495800 ROWSPYRRDDTJKH-UHFFFAOYSA-N 340.382 5.213 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc2[nH]ccc12 159047414 UXMSVRDFUKGALE-UHFFFAOYSA-N 345.855 5.103 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cccc2cccnc12 178387750 XEGBDVZZNOEGAY-OAHLLOKOSA-N 333.460 5.099 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(C2CC2)n1 189888883 YAMVHHUVAJJTKW-UHFFFAOYSA-N 326.465 5.125 30 20 EKED C=CCC[C@@H](NCc1ncc(C)s1)c1ccc(C(F)(F)F)cc1 342197213 TUWKTYBTGQEMCO-OAHLLOKOSA-N 340.414 5.267 30 20 EKED N#CCCC[C@@H](NCCSc1ccc(Cl)cc1)c1ccccc1 433017479 CIDZFMWHFFYUEX-LJQANCHMSA-N 344.911 5.457 30 20 EKED C[C@H](N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1(C)CC1 438662303 WTJHIKZCHCIJJN-HNNXBMFYSA-N 349.434 5.003 30 20 EKED CC[C@H](NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1)c1ccc(C#N)cc1 447526230 BZEROMZQVUGHBR-VABKMULXSA-N 348.490 5.075 30 20 EKED C[C@H](S[C@H](C)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 476156923 QSFLAGVKBPDOQA-UONOGXRCSA-N 335.432 5.164 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 505061360 KKULPGVZDLOEBQ-UHFFFAOYSA-N 334.419 5.215 30 20 EKED CC(C)(C#N)CCCN1CCC(c2ccc(C(F)(F)F)cc2)CC1 539097527 XSDWKJNSRQAQGE-UHFFFAOYSA-N 338.417 5.215 30 20 EKED CC(C)C[C@H](Nc1cccc(OCCCC#N)c1)c1cccs1 539628088 YLCRWBHNLQQUHZ-SFHVURJKSA-N 328.481 5.630 30 20 EKED C[C@@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1 546687624 JUXNANROQSBGIS-GFCCVEGCSA-N 331.246 5.205 30 20 EKED N#CCCC[C@@H](NC1CC(c2ccc(Cl)cc2)C1)c1ccccc1 556197884 NHXAUBUGLASONZ-DQVLVPHSSA-N 338.882 5.611 30 20 EKED CC(C)CN(C(=O)c1cccc2ccccc12)c1ccc(C#N)cc1 608879128 OGFQEYAKKLCBNG-UHFFFAOYSA-N 328.415 5.014 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C/C(=O)c2cccs2)c1 731318573 IOGWNWOZSVAPOW-ZHACJKMWSA-N 345.423 5.095 30 20 EKED C=CCN(C(=O)Nc1cccc(OCc2cccc(C)c2)c1)C(C)C 732437909 BWCLNUZJRVSERN-UHFFFAOYSA-N 338.451 5.002 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 759188186 SUEZGUGOOSDSLU-GPZRYRNASA-N 346.817 5.168 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccc(Cl)cc1Cl)c1ccncc1 766021472 TYGVHYJFZUZZJF-ROUUACIJSA-N 335.278 5.747 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)cc1 788348914 GMRCBAWUGAJXKR-BQYQJAHWSA-N 325.355 5.181 30 20 EKED C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1nc2ccccc2s1 795796869 UZURJDPTJWUPCB-KBXCAEBGSA-N 347.487 5.286 30 20 EKED Cc1cc(C)c(C(=O)O)cc1/C=C/C(=O)c1cccc2ccccc12 1776114274 KOQUXBDVRMAYAG-ZHACJKMWSA-N 330.383 5.051 30 20 EKED N#C[C@@H](C(=O)c1coc2ccccc12)c1nc(-c2ccccc2)cs1 113653826 HXUBOPXHBGKPOK-HNNXBMFYSA-N 344.395 5.046 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(C)cc1 189908788 PTHCMDASXNCUKD-QGZVFWFLSA-N 337.463 5.253 30 20 EKED CC1(C#N)CCC(Nc2ccc(F)cc2OCCC(F)(F)F)CC1 449305712 HMXMFDNGKMVIBH-UHFFFAOYSA-N 344.352 5.041 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C2CCC2)c1 466340369 SVHNXFPNEDYXGJ-UHFFFAOYSA-N 333.475 6.058 30 20 EKED C=CCCOCCCCC(=O)N(c1ccsc1)C1CCCCC1 487240905 UQIBFETUYPLPON-UHFFFAOYSA-N 335.513 5.177 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)C1(C#N)CCCC1 498484099 FCTAQCCWFQAMMH-UHFFFAOYSA-N 342.508 5.442 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1C 510049207 KCLLVEPINCNVRN-HZPDHXFCSA-N 349.434 5.003 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 540594777 NYDWOXDNPXACMZ-KSFYIVLOSA-N 346.861 5.652 30 20 EKED N#CC[C@@H](Cc1nc(-c2cccc3ccccc23)no1)c1ccccc1 584197355 IDJOZTAAXMXRLD-SFHVURJKSA-N 339.398 5.130 30 20 EKED C=CCC[C@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccco1 584366855 QKNBGAAAYNROTR-KRWDZBQOSA-N 340.467 5.692 30 20 EKED C=C(C)COc1cc(CNc2ccccc2OC(C)C)ccc1OC 604068345 HRYKAXQTEDLUSO-UHFFFAOYSA-N 341.451 5.049 30 20 EKED COc1cccc2cc(/C=C/C(=O)c3c(C)[nH]c4ccccc34)oc12 750904786 IEEYJIGYJZAHIG-ZHACJKMWSA-N 331.371 5.127 30 20 EKED N#Cc1cccc(/C=C(/Cl)c2nc3cc(C(F)(F)F)ccc3o2)c1 764431751 FFAAPEBWBCRWER-NTUHNPAUSA-N 348.711 5.455 30 20 EKED CC1(C)CCC(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)CC1 768766681 UORKNRSSJKTGJT-MRXNPFEDSA-N 338.476 5.203 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)c(F)c1 776741856 KELXVNYXOUMVSL-BLVKFPJESA-N 346.396 5.414 30 20 EKED C[C@@H]1/C(=C\c2ccccc2OCc2cccnc2)C(=O)c2ccccc21 809159611 SLNJZHVJQSXDPW-REIAIGDLSA-N 341.410 5.044 30 20 EKED Cc1oc(-c2cccs2)nc1CON=Cc1ccc(C(C)C)cc1 818264662 WNJHGTVWYKHJFH-UHFFFAOYSA-N 340.448 5.386 30 20 EKED CC[C@H](c1ccc(F)cc1F)[S@](=O)CCCCC1(C#N)CCC1 899392020 ODFOEOWQRZPKJK-UZUQRXQVSA-N 339.451 5.029 30 20 EKED CC(C)C(CCc1ccccc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033368 SGTRWIIXDRRQOJ-UHFFFAOYSA-N 344.842 5.095 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1sc2cc(F)ccc2c1Cl 63960463 MCLYARBAEJIZBJ-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C[C@@H](N[C@H](C)c1cccc2ccccc12)c1ccc(OCC#N)cc1 192943532 LOWUYDQBXUGKPK-IAGOWNOFSA-N 330.431 5.154 30 20 EKED CC(/C=C\C(=O)c1ccc(NC(=O)NC(C)C)cc1)=C/c1ccccc1 208021142 DGIUAJWHMMQHBA-RWJFQYMWSA-N 348.446 5.059 30 20 EKED C[C@@H](ON=Cc1cccs1)c1ncc(-c2ccc(Cl)cc2)o1 255061433 BROQLANUUHAEFA-LLVKDONJSA-N 332.812 5.168 30 20 EKED Cc1ccc2ncc(CN[C@H](CCCC#N)c3ccccc3)cc2c1 411760329 RUNORJKNSQDWOB-OAQYLSRUSA-N 329.447 5.068 30 20 EKED CC[C@H](C)[C@H](C)N(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CC1 458806265 VXAIYXHKSKPVKS-ZWOKBUDYSA-N 341.499 5.030 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC[C@@H]1CCC2(CCCCC2)O1 466848987 ZTLMHMUSCVJRNL-SJORKVTESA-N 344.524 5.375 30 20 EKED Cc1ccc2[nH]c(CNc3cccc(OCCCC#N)c3)cc2c1C 472041550 GPZIOQCUMNIOTP-UHFFFAOYSA-N 333.435 5.079 30 20 EKED C=C(CNC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 477112617 VVRDBSUJBFNQEF-UHFFFAOYSA-N 348.368 5.016 30 20 EKED Cc1cc(Cl)cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 477116080 YUKWMCIUMVHKLO-CYBMUJFWSA-N 344.867 5.153 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)s1 503362884 ACZUHVMMWTUHSL-OALUTQOASA-N 346.455 5.078 30 20 EKED CC(C)c1ccc([C@@H](NCc2ccc(C#N)cc2)c2cccs2)cc1 512837675 DBTQDRBUFDTKLD-JOCHJYFZSA-N 346.499 5.622 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sccc1SC 521672526 RRVPEZDOWPPESP-UHFFFAOYSA-N 343.926 5.013 30 20 EKED C[C@@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccc(C#N)cc1 532465917 VQMRVTHVYSJOKJ-SJKOYZFVSA-N 328.868 5.099 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 550827114 KIRLAAKPDHBVGA-DNVCBOLYSA-N 344.405 5.374 30 20 EKED Cc1cccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1Cl 551621399 BCQIIEKPINHPNF-UHFFFAOYSA-N 340.835 5.296 30 20 EKED CC(C)(C#N)CCCCN1CCC(c2ccnc3ccccc23)CC1 571340492 BRJMELZYEKJGER-UHFFFAOYSA-N 335.495 5.134 30 20 EKED C[C@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1Cl 584201804 LVCGMYFBVIASKX-XPTSAGLGSA-N 337.275 5.265 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(F)c2ccccc12 588975538 ARCILYRSSHIULG-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED N#CCCCCCC(=O)Nc1ccc(F)cc1Nc1ccccc1F 589845859 XEDRGGTVNOEMBK-UHFFFAOYSA-N 343.377 5.121 30 20 EKED CCC(C)(C)OCc1cccc(N[C@H](C)c2cccc(C#N)c2)c1C 600850056 PLRGDURLQWAATR-QGZVFWFLSA-N 336.479 5.745 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(-c3ccccc3)cc2)c1 726433425 HHYUXTAQOKRBIS-UHFFFAOYSA-N 328.440 5.144 30 20 EKED CCCCCCCCC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1 739780333 PBZKRGJABLSTGM-INIZCTEOSA-N 328.456 5.269 30 20 EKED CCCCCCCCC(=O)Nc1ccc(Oc2ccc(C)nn2)cc1 741609730 SWQJOIFNVKUWOY-UHFFFAOYSA-N 341.455 5.266 30 20 EKED CC1=C(C)C[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)CC1 842688363 FONAGVXQXLMEKS-IAGOWNOFSA-N 336.460 5.123 30 20 EKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1 842940831 FKKJIJHGHQNBLE-DLBZAZTESA-N 338.476 5.027 30 20 EKED CC(C)c1ccccc1NCc1cc(C#N)ccc1Br 863996934 FSXWHCQXPPNFOZ-UHFFFAOYSA-N 329.241 5.056 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(C)c(NC(C)=O)c1C 917828257 GDDNFVPPEYVWIT-UHFFFAOYSA-N 332.488 5.341 30 20 EKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1(C#N)CCCC1 76183324 NHBUPHMDESUQHJ-KRWDZBQOSA-N 348.446 5.158 30 20 EKED C=CCOc1ccc(CN[C@@H](CCC#N)c2ccccc2)cc1Cl 130602073 HWHQQHCMJHCNSN-IBGZPJMESA-N 340.854 5.039 30 20 EKED Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)n1[C@H]1CCC[C@@H](C)C1 245647459 UIAKLCXTDCJOMM-LBTNJELSSA-N 340.496 5.063 30 20 EKED C=C(C)COc1cccc(NC(=O)c2ccccc2SC(C)C)c1 303134775 CNCVBVPEJKATMK-UHFFFAOYSA-N 341.476 5.394 30 20 EKED N#CCCC[C@H](NCc1nc(-c2ccccc2)cs1)c1ccccc1 353914038 KKBLQDBDVWYZAA-IBGZPJMESA-N 347.487 5.335 30 20 EKED N#Cc1ccc(SCc2nc(-c3ccccc3)cs2)c(F)c1 436187145 KEYPEAQZBQCYOK-UHFFFAOYSA-N 326.421 5.113 30 20 EKED CN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccc(C#N)cc1 439943983 SADILMOZKQCLTF-UHFFFAOYSA-N 346.817 5.155 30 20 EKED Cc1cccc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C 458392166 AGKYVKFYZBFXFO-WIYYLYMNSA-N 349.478 5.099 30 20 EKED CCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](CC)c1ccccc1 461990353 XBVOYDWWBWGIJI-LAUBAEHRSA-N 334.463 5.052 30 20 EKED C[C@H](N(Cc1ccccc1)C(=O)Nc1ccc(CC#N)cc1)C(C)(C)C 469475426 ZQLZTTIWBXOPLR-KRWDZBQOSA-N 349.478 5.221 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1ccccc1C)C(C)C 483571220 BHOANFLHNBDIPU-IBGZPJMESA-N 342.508 5.151 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 488659053 STZHZKZWAOREAS-FQEVSTJZSA-N 332.447 5.176 30 20 EKED CCS[C@H]1CCC[C@H](NC2CCC(C#N)(c3ccccc3)CC2)C1 507612573 FHSMPUQYGQDXEQ-OMYXNUHHSA-N 342.552 5.044 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)cc1 508066170 YTEQBWJGTOONPC-QGZVFWFLSA-N 328.415 5.201 30 20 EKED CCN(C(=O)c1ccc(-c2ccccc2)o1)[C@H](C)c1ccc(C#N)cc1 543150724 JZGHSBNPCIFRRN-MRXNPFEDSA-N 344.414 5.042 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)c(F)c1 553791265 QAXOSQNOIPHGOJ-XCLFUZPHSA-N 326.390 5.028 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCCc4c3sc3ccccc43)CC2)c1 570309468 BKHABKJFGUGNSK-LJQANCHMSA-N 344.483 5.429 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(C)s1 604457019 LDPHJKRLDNGFSD-UHFFFAOYSA-N 348.427 5.281 30 20 EKED Cc1oc(-c2ccsc2)nc1CS[C@H](C)c1ccc(C#N)cc1 609825827 WAZNBORIPRERAM-CYBMUJFWSA-N 340.473 5.578 30 20 EKED C[C@H](Sc1ccc(Cl)cc1C#N)c1nc(-c2ccccc2)no1 610655033 NOQCKQXXIHZKIC-NSHDSACASA-N 341.823 5.115 30 20 EKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1sc(C)nc1C 726737028 FEJRLSSIWDRLKY-UHFFFAOYSA-N 338.480 5.070 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C/c1csc(-c2ccc(F)cc2)n1 731321923 OATKATOSAAPDNO-VQHVLOKHSA-N 341.382 5.293 30 20 EKED C=CCCCN(C)C(=O)c1cc(-c2cccs2)nc2ccccc12 736527337 XVBQUUDBNULFGI-UHFFFAOYSA-N 336.460 5.002 30 20 EKED CC[C@@H](CC(=O)N(CCC#N)c1ccc(C)cc1)c1ccc(C)cc1 737819277 RYRGQMRDGHLOFS-IBGZPJMESA-N 334.463 5.134 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 739142186 HAEPNYXWCJKWFL-YOEHRIQHSA-N 348.471 5.229 30 20 EKED C=C(C)[C@H](Cc1nc(-c2ccc(SC(C)(C)C)cc2)no1)OCC 762344718 AZWZZHJNZOAAGI-INIZCTEOSA-N 346.496 5.151 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCC[C@@H]3C)n2)cc1 769282266 ODRXZLYLZGENNP-BHYGNILZSA-N 338.476 5.121 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1csc2ccccc12 775666378 JYKPKPYOGJKWOW-LBPRGKRZSA-N 326.852 5.277 30 20 EKED CC(C)N(Cc1ccc(O[C@@H](C)C#N)cc1)[C@@H](C)c1ccsc1 817415913 AFRHCYUPQIETGY-HOTGVXAUSA-N 328.481 5.011 30 20 EKED CC[C@H](Cc1ccccc1C)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 820183679 DCTHMDMTVIXPTB-NVXWUHKLSA-N 340.492 5.020 30 20 EKED COc1ccc(F)cc1-c1cncc(CSCCC(C)(C)C#N)c1 901791803 MYWKUZVATFETMU-UHFFFAOYSA-N 344.455 5.069 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1cccc(F)c1 917714010 QBJNCSCLVOZVFF-KTKRTIGZSA-N 348.402 5.078 30 20 EKED CCCCCCC[S@](=O)Cc1csc(-c2cccs2)n1 132641208 BRKCKORURAGKPB-HXUWFJFHSA-N 327.540 5.091 30 20 EKED Cc1cc(C)cc(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)c1 189809242 HBWQPOXBKLILJW-AWEZNQCLSA-N 335.432 5.078 30 20 EKED Cc1ccc(Cl)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1C 425676436 DSWIRVCLXTWQPL-AWEZNQCLSA-N 341.842 5.053 30 20 EKED C=CCC[C@H](NC(=O)N1CCc2sccc2[C@H]1C)c1ccccc1 435106031 ZFUKEPZHUHURMT-QAPCUYQASA-N 340.492 5.084 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 466416373 IVFUGMYCCOECGK-CYBMUJFWSA-N 330.815 5.068 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1ccccc1 475559113 CGHGIBWBBGARRP-UHFFFAOYSA-N 336.479 5.293 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(SC)c1C 486415799 JODLIJBXROZNOY-UHFFFAOYSA-N 329.490 5.247 30 20 EKED Cc1sc(NC(=O)c2oc3ccc(Cl)cc3c2C)c(C#N)c1C 498700046 HQQOODOBKDDYIL-UHFFFAOYSA-N 344.823 5.197 30 20 EKED C=C[C@H](CC(=O)N1CCCC[C@@H]1c1ccc(F)cc1)c1ccccc1 533927609 GXDNGGVQOSMORR-DYESRHJHSA-N 337.438 5.239 30 20 EKED C[C@H](Sc1cccc(Cl)c1C#N)c1nc(-c2ccccc2)no1 537848467 DMAPSDMXHBSGDN-NSHDSACASA-N 341.823 5.115 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)c1ccc(C2CCCCC2)cc1 559578113 KOIWABMLPFHZJA-HSZRJFAPSA-N 331.525 5.562 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCc3c1ccc(Cl)c3Cl)CC2 565450213 LGHGGPHRUCCTRC-QZTJIDSGSA-N 343.257 5.129 30 20 EKED N#CC1(CCCSCc2cc(Cl)cc(Cl)c2)CCOCC1 570170885 FRLCBDHSJPTZAE-UHFFFAOYSA-N 344.307 5.327 30 20 EKED Cc1csc(-c2cccc(N[C@@H]3CCc4ccc(C#N)cc43)c2)n1 575371625 SWHONXWMHZIELT-LJQANCHMSA-N 331.444 5.090 30 20 EKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCC2)c1ccc2ccccc2n1 613291277 YZAJHLGKWRUOSE-MRXNPFEDSA-N 346.455 5.055 30 20 EKED Cc1csc([C@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)n1 642281951 VCNKHGSAFMDAIS-SNVBAGLBSA-N 346.864 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1F 682803822 SCNIAKMUBVSPEX-UHFFFAOYSA-N 325.427 5.249 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)C(=O)c1ccccc1 682822986 ZDEUKWASKXTTRZ-QGZVFWFLSA-N 349.474 5.386 30 20 EKED O=C1/C(=C\c2cccs2)CCc2nc(-c3ccccc3F)sc21 731937563 JLYFATYGCJBWSG-KHPPLWFESA-N 341.432 5.223 30 20 EKED C#Cc1cccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)c1 731964508 WCEVBYUNVFLFDA-UHFFFAOYSA-N 331.802 5.241 30 20 EKED Fc1c(Cl)cccc1NN=Cc1c(Cl)cccc1OC(F)F 732924658 CABZWEHAOCMVBD-UHFFFAOYSA-N 349.139 5.180 30 20 EKED C[C@H](C(=O)OCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 738794618 ZVMGJRPPRKIMDQ-HNNXBMFYSA-N 347.439 5.134 30 20 EKED C[C@H](c1ccccc1)N(CC1CCC1)C(=S)Nc1ccccc1C#N 740773487 SRISTZOITZFUDG-MRXNPFEDSA-N 349.503 5.118 30 20 EKED CCC(C)(CC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 752638611 YYBJDWZAFFYFDK-IBGZPJMESA-N 335.451 5.042 30 20 EKED C=CCC(F)(F)c1nc(-c2cccc(Oc3ccccc3)c2)no1 904591521 NDUGQGZWAXTBAJ-UHFFFAOYSA-N 328.318 5.197 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc(CCC#N)cc1 905856293 VYADJHWJCCQSHX-DLBZAZTESA-N 349.478 5.095 30 20 EKED Cc1cc(/C=C\C(=O)c2ccccc2)cc(C)c1OCc1ccccn1 915114211 GRZBCALALXSVIO-QXMHVHEDSA-N 343.426 5.174 30 20 EKED C/C=C/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 915656348 SMLKRENTXBXDFO-LKXZTCHMSA-N 336.822 5.066 30 20 EKED Cc1ccc(-c2nc(CN[C@H](CCC#N)c3ccccc3)cs2)cc1 130435597 ULSDGARSTNGDAN-HXUWFJFHSA-N 347.487 5.253 30 20 EKED Cc1cccc([C@@H]2CCCCN2C(=O)Nc2ccc(CC#N)cc2)c1C 174717009 ROCWIHRAJXTDES-NRFANRHFSA-N 347.462 5.129 30 20 EKED C=C(C)[C@H](NCc1cc(-c2cccs2)on1)c1ccc(F)c(F)c1 187791140 JUPWBDBYMLOLKH-SFHVURJKSA-N 346.402 5.088 30 20 EKED CSc1ccccc1[C@H](C)Nc1cccc(OCCCC#N)c1 194945782 IDERVLUSEXSPEJ-HNNXBMFYSA-N 326.465 5.264 30 20 EKED CCc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)s1 210707255 FWAHZNIPDKDUTL-HYXAFXHYSA-N 331.487 5.392 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1C 214013176 CJCVKWXJRUURSB-WAYWQWQTSA-N 325.458 5.385 30 20 EKED CCC[C@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 237030844 BDOFLYHOGYQHDC-SFHVURJKSA-N 332.369 5.208 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)c1ccc(C2CCCCC2)cc1 254380346 LPCVPJOLWGARSZ-UHFFFAOYSA-N 336.435 5.269 30 20 EKED Cc1ccc(Cl)cc1C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330044860 FZCALGUUYRAYQF-UHFFFAOYSA-N 348.874 5.030 30 20 EKED C=CCC[C@H](NC(=O)N[C@H](C)CCCC(F)(F)F)c1ccccc1 494793017 IBFHNIKSUTWIIS-ZBFHGGJFSA-N 342.405 5.114 30 20 EKED Cc1ccccc1[C@H](C)N(CC(C)C)C(=O)NCC(C)(C)CCC#N 513150358 PXFONWNNMAPFDJ-SFHVURJKSA-N 343.515 5.054 30 20 EKED CC[C@@H](NCC[C@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 556217360 MCZWVZVZERCRHL-RTBURBONSA-N 346.396 5.335 30 20 EKED N#Cc1c(N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1C(F)F 572687363 YWEZMPRBYPCZTE-SJORKVTESA-N 348.780 5.091 30 20 EKED C=CCN(C(=O)c1csc(C)c1)c1nc(-c2ccccc2)cs1 673432805 COBPMNYSLBEBMJ-UHFFFAOYSA-N 340.473 5.013 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1c[nH]c2cc(Cl)ccc12 726743361 FCLYKWYUTFWLEE-YVMONPNESA-N 335.790 5.036 30 20 EKED CSc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1 727974341 JWJMJMHALYUXON-QXMHVHEDSA-N 337.469 5.428 30 20 EKED N#Cc1ccc(F)c(CN2CCC[C@@H]2c2ccccc2C(F)(F)F)c1 728061359 QZZUVGZFJJOYNK-GOSISDBHSA-N 348.343 5.053 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 733679893 GREXDSISQAXBHO-OALUTQOASA-N 334.463 5.408 30 20 EKED CCOc1ccccc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741473478 QNIOZIWSLKOIKO-KHPPLWFESA-N 329.399 5.043 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1ccc(Cl)cc1Cl 742429098 HHKCUXIRLCNCQK-VQHVLOKHSA-N 343.213 5.280 30 20 EKED Cc1c([C@@H](NCc2ccc(OCC#N)cc2)C(C)C)oc2ccccc12 775411943 YQYBBZZQTNIGNE-NRFANRHFSA-N 348.446 5.131 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1nc2ccccc2s1 829933908 YIDURLMJNSAFSR-KRWDZBQOSA-N 344.524 5.710 30 20 EKED O=C(/C=C/c1ccccc1Cl)c1sccc1Br 915112531 CHMNYPUFFSJKDI-AATRIKPKSA-N 327.630 5.060 30 20 EKED Cc1ccc2c(c1)C/C(=C\c1csc(-c3ccc(F)cc3)n1)C2=O 921270015 QVUYYEQERTWCIQ-XNTDXEJSSA-N 335.403 5.080 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC[C@H](C)CCc1ccccc1 1776782391 PWGLCUANAOXCTF-QUCCMNQESA-N 333.516 5.049 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(CC(C)C)cc1 1776783924 ARSAOVXIVXXMLN-FQEVSTJZSA-N 333.516 5.179 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1Cl)c1cccc(C#N)c1 190892391 FQQVTSXWCFBWHX-QWHCGFSZSA-N 344.867 5.033 30 20 EKED CC[C@@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 193341896 LGFCVVPOMBKIBK-DOTOQJQBSA-N 338.476 5.213 30 20 EKED CC(C)c1oc([C@H]2CCCN2CCCCC#N)nc1-c1ccccc1 267336552 BCPAFXSJUOZKQT-GOSISDBHSA-N 337.467 5.296 30 20 EKED CC[C@@H](C#N)Oc1cccc(CNc2nc(-c3ccccc3)cs2)c1 301623269 YWASWEWWJFKUOA-KRWDZBQOSA-N 349.459 5.103 30 20 EKED OC1=N[C@@H](/C(O)=N/CC2(c3ccc(Cl)cc3)CCCCC2)CCC1 328830458 UVTMLECGJPBLFO-MRXNPFEDSA-N 348.874 5.007 30 20 EKED CC[C@@H](SCc1ncc(C#N)cn1)c1ccc(Cl)cc1Cl 419517332 IPGABILMCULWPN-CQSZACIVSA-N 338.263 5.040 30 20 EKED C=CCC[C@H](N[C@H](C)c1nc(-c2ccncc2)cs1)c1ccco1 428446836 KQYCNHXFYPKIAF-ZBFHGGJFSA-N 339.464 5.156 30 20 EKED CC(C)CN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCC1 458800658 LQHAOWGZTRQVCY-HXUWFJFHSA-N 341.499 5.032 30 20 EKED Cc1ccc(SCC(F)(F)F)c(N[C@H]2CCC[C@@H](C#N)C2)c1 463289981 RKOBYBMMFNEGMH-OLZOCXBDSA-N 328.403 5.144 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(F)c1Cl 495339618 ZLDWZGCWQTZZTC-UHFFFAOYSA-N 332.806 5.089 30 20 EKED Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 524278286 LPNFCAWKGXCTKK-UHFFFAOYSA-N 346.361 5.050 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C#N)s2)cc1 539529713 XSOXFDXRRLYLDO-HNNXBMFYSA-N 348.471 5.146 30 20 EKED N#CCc1ccccc1NC(=O)CC1CCC(c2ccccc2)CC1 570719890 UTQSJBVICNKXNQ-UHFFFAOYSA-N 332.447 5.055 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1cccc(CC(F)(F)F)c1 611483204 KGNIFCVMXTXVNH-GOSISDBHSA-N 330.353 5.153 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc2ccccc2s1 619755524 KJRRJNNACOEEAJ-GFCCVEGCSA-N 326.852 5.277 30 20 EKED O=C1/C(=C\c2csc(-c3ccc(F)cc3)n2)CCc2sccc21 726892807 OSAVBLJAIHPGSD-XFXZXTDPSA-N 341.432 5.223 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1cc(F)c(F)c(F)c1 727974506 LGUHNBPFKDIJBM-WAYWQWQTSA-N 339.382 5.062 30 20 EKED CC(C)c1ccc(NC(=S)N[C@@H](CCC#N)c2ccccc2)cc1 747707722 AZQIWYDYSKNLGA-IBGZPJMESA-N 337.492 5.141 30 20 EKED CC1(C)CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc2ccccc2s1 752473319 FZURDELYLQKTEN-KGLIPLIRSA-N 326.465 5.079 30 20 EKED Fc1ccccc1-c1ccc(C=NOc2ccccc2C(F)(F)F)o1 754712694 PPUPGKUIHVZAEV-UHFFFAOYSA-N 349.283 5.517 30 20 EKED CCCCCCC[S@@](=O)Cc1coc(-c2cccc(Cl)c2)n1 764455063 PIWHUDHZSPSHGZ-JOCHJYFZSA-N 339.888 5.214 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(SC(F)F)cc1)c1ccncc1 766018709 INHTUMZDNFNFQD-SUMWQHHRSA-N 334.435 5.364 30 20 EKED CC[C@@H](Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(C#N)cc1 774316882 WJJMCAQORCENGU-GOSISDBHSA-N 334.419 5.163 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC2CCC2)c2ccccc2)c1 776165069 NVCGIJBALRLOKZ-JTHBVZDNSA-N 348.490 5.389 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CC2CC(c3ccccc3)C2)n1 798838575 PKZKIWGWINHJSY-BDVYOWHSSA-N 338.476 5.027 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1[N+](=O)[O-] 80468093 GUNFOFQPPFBFDH-UONOGXRCSA-N 341.436 5.020 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1 90580684 NYVYCLWSGNGDHK-OXQOHEQNSA-N 348.490 5.274 30 20 EKED C[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1cccc(C#N)c1 153735922 UEEVSRMFAPCUKI-GJZGRUSLSA-N 333.460 5.094 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CCSC 191444798 NREHAFHQCHBQJW-OAHLLOKOSA-N 334.529 5.144 30 20 EKED CC1(C)CCC(CC(O)=Nc2cccc([C@@H]3CN=C(O)C3)c2)CC1 328649136 INLKPSRSYIXMPD-INIZCTEOSA-N 328.456 5.325 30 20 EKED C=CCC(C)(C)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 431753995 WTKBOVHPCZSICE-LJQANCHMSA-N 346.474 5.018 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)CC(C)(C)C 454769460 UACUYBDVVONWPB-KGLIPLIRSA-N 333.501 5.027 30 20 EKED CC(C)(C)C[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462726299 QNIRGWAMWINWDE-LJQANCHMSA-N 326.871 5.479 30 20 EKED N#Cc1ccc(SCc2nc(-c3ccccc3Cl)cs2)nc1 478925866 VAXXLUHMNUDKNI-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(=C)c1ccccc1 482171797 WGEHBESJZSGWOK-UHFFFAOYSA-N 334.463 5.373 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1ccc(C#N)c(F)c1 488803958 JDPZNDAMMAMNOF-BSEYFRJRSA-N 343.467 5.005 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc2ccsc12 501197825 IWRKZYBSHAYFKG-UHFFFAOYSA-N 349.459 5.215 30 20 EKED CCC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512642497 QFTXHBKZEJCNGI-BUXKBTBVSA-N 332.369 5.168 30 20 EKED N#Cc1cccc(CSCc2csc(-c3cccs3)n2)c1 517963308 ATNGODWFZARWDN-UHFFFAOYSA-N 328.487 5.177 30 20 EKED C[C@@H](CC(C)(C)c1c[nH]c2ccccc12)NCC1CCC(C#N)CC1 550933305 ISEPDHGOVSOFIF-AOCRQIFASA-N 337.511 5.144 30 20 EKED C[C@H](NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccc(C#N)c(F)c1 593719925 JGUPQIGPMYNOOV-LBPRGKRZSA-N 348.343 5.056 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N(CC2CCCCC2)C2CC2)cc1 604084879 HUKDXYNSZHUSCQ-UHFFFAOYSA-N 339.483 5.064 30 20 EKED C=CCOc1cccc(CN[C@@H](Cc2ccccc2)c2cccs2)c1 604891929 BGXGXDBGRXRYKZ-NRFANRHFSA-N 349.499 5.387 30 20 EKED C=Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 671065152 NQDKUWZGXQGFRJ-CQSZACIVSA-N 338.819 5.083 30 20 EKED CCOc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 728438855 AGHUNSRNXHDSDX-YFHOEESVSA-N 341.457 5.166 30 20 EKED O=C(/C=C\c1ccc(Cl)c(F)c1)c1cccc(-c2ccncc2)c1 741474754 ZMRWPSGDHNRJKT-ALCCZGGFSA-N 337.781 5.437 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cc(Cl)ccc1Cl 754711793 ATFANIAFGUWKNP-UHFFFAOYSA-N 334.124 5.425 30 20 EKED CCC(C)(CC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 767961701 ZEWMJWKOECSARP-AWEZNQCLSA-N 346.883 5.466 30 20 EKED N#CC1(c2ccc(CNc3ccc(SC(F)F)cc3)cc2)CC1 850199830 YYZXFWCWNWMQMD-UHFFFAOYSA-N 330.403 5.169 30 20 EKED CCC(CC)CCCN(C)C(=S)Nc1ccc(C#N)c(Cl)c1 853037945 WULLDDGCCNNPEF-UHFFFAOYSA-N 337.920 5.057 30 20 EKED Clc1nc(Oc2ccccc2)sc1C=NOCc1ccccc1 915960174 SUSMOJRZXDQLFO-UHFFFAOYSA-N 344.823 5.140 30 20 EKED CCCCCCCCCC(=O)Nc1cc(NC(C)=O)ccc1Cl 917829885 DTKCDRWRFILKPK-UHFFFAOYSA-N 338.879 5.378 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1 1776805945 GZZONPJBHMEKKZ-NFLUSIDLSA-N 334.415 5.023 30 20 EKED Cc1cccc2c1[C@@H](C)/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1777455845 FTVKNMKQPPPUOO-RGZVIEDOSA-N 348.423 5.291 30 20 EKED Cc1cc2nc(/C=C/c3ccc(O[C@@H](C)C#N)cc3)sc2cc1C 110655631 HSHKDJCLEPELLI-PPYMECGQSA-N 334.444 5.374 30 20 EKED CC(C)(C#N)CCCCSCc1csc(-c2ccccn2)n1 277818547 JFNFJGJQCLFNRE-UHFFFAOYSA-N 331.510 5.158 30 20 EKED CCc1oc2ccccc2c1CNc1cccc(OCCCC#N)c1 327086040 HKJQPWSUEXJUFP-UHFFFAOYSA-N 334.419 5.290 30 20 EKED CC1=C(/C(O)=N/C2CCC(/N=C(/O)C3=C(C)CCC3)CC2)CCC1 328697903 UVHLTHYCGAOWFV-UHFFFAOYSA-N 330.472 5.211 30 20 EKED Cc1nc(C(C)C)oc1CSc1ccc(C#N)c(C(F)(F)F)c1 436475056 YBSTXCNIIDAIMT-UHFFFAOYSA-N 340.370 5.289 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1cc(C#N)cs1 437554778 HFSLTYOTERAFDI-UHFFFAOYSA-N 336.869 5.026 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2ccccc2CSC)CCCC1(C)C 445120313 URTHXKQILPKQPC-KRWDZBQOSA-N 332.513 5.148 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 445988390 NQSMRACMXBXXBA-IRXDYDNUSA-N 338.417 5.261 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@H](C)c1ccc(C#N)cc1 447565290 KBMWUGPXFDETHF-KDOFPFPSSA-N 332.369 5.211 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc2[nH]c(C)cc2c1 471294206 ZALYYKUCLNNXGP-UHFFFAOYSA-N 333.435 5.087 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)s1 476080232 NRRMPOGRZALNAN-UHFFFAOYSA-N 327.493 5.976 30 20 EKED COc1ccc([C@H](Nc2ccc(C#N)cc2)c2ccc(C)cc2)cc1 513197426 WBLXYRPQAOGYRM-JOCHJYFZSA-N 328.415 5.077 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2[nH]1 513647267 FZHKVYAASXUAMD-GOSISDBHSA-N 343.430 5.101 30 20 EKED Cc1ccc(-c2nc(CSc3ccc(C#N)cc3F)cs2)o1 525115527 SABKYHSCJSJXEG-UHFFFAOYSA-N 330.409 5.015 30 20 EKED N#CCCOCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 549013638 ZSDKZIXLKWXGHS-GOSISDBHSA-N 331.868 5.093 30 20 EKED C=CCC[C@H](NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccco1 556867308 GUYKZKIAMMMJNB-RXVVDRJESA-N 338.495 5.102 30 20 EKED C[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1Cl 584201803 LVCGMYFBVIASKX-OTYXRUKQSA-N 337.275 5.265 30 20 EKED C[C@H](Nc1ccc(NC(=O)C2(C#N)CCCCC2)cc1)c1ccccc1 604445490 KMZIISOODPWNEI-KRWDZBQOSA-N 347.462 5.272 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)cc1Cl 618807471 ZVKADAABUIVMMM-BBATYDOGSA-N 331.246 5.203 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 726742653 UGDFLDSIBXSNJX-MDWZMJQESA-N 333.431 5.389 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(C(C)C)cc1 732625758 TYUDQAKLPOEBDO-UHFFFAOYSA-N 330.541 5.575 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1nc2ccccc2s1 735230468 CFLYGKWMFSJBGX-UHFFFAOYSA-N 346.864 5.144 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)cn1 746686478 GMTQLGMFUTYFPJ-ZZXKWVIFSA-N 343.641 5.320 30 20 EKED CC(=NNc1cccc2cnccc12)[C@H](C)c1nc2ccccc2s1 748788300 QCBHXUWBDAHSQY-ZDUSSCGKSA-N 346.459 5.436 30 20 EKED CCCCCCCCCC(=O)Nc1cc(F)c(F)cc1NC(C)=O 751193071 AZOMNIUSJDVWEL-UHFFFAOYSA-N 340.414 5.002 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3ccccc3)n2)cc1 773982930 NEUWHQRNXFYFFR-YJBOKZPZSA-N 346.455 5.099 30 20 EKED C/C(=C/C(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 773982965 NNQPOHKXJGRKOG-SCOADAFUSA-N 338.476 5.287 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc(Cl)s1 789718760 JMTLNOWAADQCTR-BENRWUELSA-N 345.895 5.905 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1cccc(OCC)c1 799901400 ZYEAHTGQUKDLAF-UHFFFAOYSA-N 326.465 5.013 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2CCCCCC2)cc1 915352230 IXFRPMHUFOYCNV-NRFANRHFSA-N 347.462 5.186 30 20 EKED CCCCCCCCSc1nnc([C@@H]2COc3ccccc3O2)o1 915793852 OOWGTOOYGDUDSI-INIZCTEOSA-N 348.468 5.035 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1 915982660 UWDFQWUEGXFOEI-VAWYXSNFSA-N 348.471 5.399 30 20 EKED O=C(O)c1cc(NN=C2CCCC[C@@H]2C2CCCCC2)ccc1F 1776063287 KIMUSLYDBHPVLZ-OAHLLOKOSA-N 332.419 5.062 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 62422393 ZKSUAAMRYFXNSM-NRFANRHFSA-N 332.834 5.091 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1nc(-c2ccccc2)cs1 153735999 UEEVSRMFAPCUKI-CABCVRRESA-N 333.460 5.094 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1 173990872 XROZWPNIHDXZGE-LSDHHAIUSA-N 347.487 5.402 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCCCC(C)(C)C#N 184343514 KKABPXNMTIUKNJ-CYBMUJFWSA-N 345.487 5.238 30 20 EKED C/C=C(\CC)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 191571209 STQXKWRKTBXTIB-QDEBKDIKSA-N 342.386 5.006 30 20 EKED CC[C@H](N[C@@H](CCCCOC)c1ccccc1)c1ccc(C#N)cc1 359018368 MRPUJKVLTQXBBO-VXKWHMMOSA-N 336.479 5.157 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1cccnc1 373715108 ZYBARVUNAKQGSO-FQEVSTJZSA-N 349.478 5.303 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC1CCC(C)(C#N)CC1 449098372 JBUDZIHTMVBUTE-JTOQLSFASA-N 339.508 5.242 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Oc2cccnc2)cc1 487994644 QBYXEEMWPFYNIY-IRXDYDNUSA-N 343.430 5.157 30 20 EKED Cc1ccc(C)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 509668570 UURLEYTUMDYIAY-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CC(C)[C@@H]1C[C@@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542948401 UPTMCCHHLHCICS-RTFZILSDSA-N 348.490 5.079 30 20 EKED CC[C@H](NCC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 556217357 MCZWVZVZERCRHL-OALUTQOASA-N 346.396 5.335 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 586795011 TZCZHLIDXXTSBJ-XFKAJCMBSA-N 336.401 5.013 30 20 EKED C[C@@H](NC(=O)Nc1cccc(-c2ccccc2)c1)c1cccc(C#N)c1 588342319 KEHAAIIGULSDQJ-MRXNPFEDSA-N 341.414 5.108 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1cccc(-c2ccncc2)c1 588423215 PIHWAGJIYALFEC-FPLPWBNLSA-N 336.394 5.193 30 20 EKED C=C(C)COc1cccc(NC(=O)c2oc3c(F)cccc3c2C)c1 589382102 JRSZGPSFVLZVKZ-UHFFFAOYSA-N 339.366 5.088 30 20 EKED CCSc1ccc([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1 594924713 LBUOVVCLAKYVKQ-INIZCTEOSA-N 336.504 5.205 30 20 EKED N#C[C@H](Cc1ccccc1)N[C@@H](CCc1ccccc1)c1ccccc1 603955320 QKWHUDNCRNOIQB-ZEQRLZLVSA-N 340.470 5.085 30 20 EKED N#Cc1ccc(NCc2ccnc(Oc3ccccc3)c2)cc1Cl 609499510 IUEGYLDYNLVFBA-UHFFFAOYSA-N 335.794 5.011 30 20 EKED N#Cc1nnc2ccccc2c1Oc1cccc(Oc2ccccc2)c1 610128435 JZMKCPIFQAXYCW-UHFFFAOYSA-N 339.354 5.086 30 20 EKED Cc1cc(NCc2cccc(OCCCC#N)c2)c2cccnc2c1C 610911554 PJWZSKWRHGKZSE-UHFFFAOYSA-N 345.446 5.146 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCCCCCC3)c2)cc1 729571561 ZDDZHKHFBZWGOU-UHFFFAOYSA-N 349.434 5.149 30 20 EKED Cc1cccc(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)c1C 745686473 BMJCPDUXBNJBPP-UHFFFAOYSA-N 337.492 5.035 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](c2ccccc2)C(C)C)n1 747198484 XOHCUTRREDRNEO-IRXDYDNUSA-N 340.492 5.273 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1c[nH]c2cc(F)ccc12 749453363 QVWISMMWGISGHD-CLFYSBASSA-N 348.402 5.327 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1c[nH]c2ccccc12 751513209 FSAJQPNCGYPSSK-FPLPWBNLSA-N 336.441 5.249 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1O)c1ccccc1 756774572 DOSPGFGHLBEPQL-BLLLJJGKSA-N 334.246 5.114 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@H]1c1cc(C)on1 775137071 SRYADAWBRAIACM-APWZRJJASA-N 334.504 5.423 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(-c3ccccc3)cc2)c1 794739927 OUFCFYCMEAFVGI-UHFFFAOYSA-N 332.790 5.131 30 20 EKED CCCCCC[C@H](CC)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211152 FFRBGVJBJHAJSJ-DZGCQCFKSA-N 340.389 5.273 30 20 EKED COc1cc([C@@H](C)Nc2ccc(CCC#N)cc2)ccc1SC 903298243 QSIBMIOVJBROBF-CQSZACIVSA-N 326.465 5.046 30 20 EKED O=C(/C=C/c1cccc(C(=O)O)c1F)c1ccc(-c2ccccc2)cc1 1776131219 LHVMLCFRZLXREP-BUHFOSPRSA-N 346.357 5.087 30 20 EKED CC(C)c1cccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)c1 1776375443 QSBAJSQBWCQDKR-MDZDMXLPSA-N 328.795 5.058 30 20 EKED CCc1c(C(=O)/C=C/c2ccc(NC(C)=O)cc2)oc2ccc(C)cc12 7716391 KTIZZMVGUFETPP-DHZHZOJOSA-N 347.414 5.158 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2cccc(Oc3ccccc3)c2)cn1 72047932 NWYQVWOCQGSSHO-VAWYXSNFSA-N 332.403 5.152 30 20 EKED Cc1cc(C)c(N[C@H](C)c2cccc(C#N)c2)c(Br)c1 159648303 CLJOKUWRDBEVIC-CYBMUJFWSA-N 329.241 5.111 30 20 EKED OC1=NC2(CCC2)[C@@H](/N=C(/O)C2(C3CCCCC3)CCCCC2)CC1 328685039 FKCXQDKSVSFYDP-KRWDZBQOSA-N 346.515 5.515 30 20 EKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)cc2cccnc12 353918587 YVVHTCXYMRTBRH-NRFANRHFSA-N 329.447 5.068 30 20 EKED N#Cc1cccc(SCc2ncc(-c3cccc(Cl)c3)o2)c1 435028948 SAVJIYRLHCADSZ-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CC(C)c1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c(C(C)C)c1 454405046 DGPMFYRVIPFFFP-RDJZCZTQSA-N 327.472 5.137 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cc(Cl)ccc1F 469254683 WOTDJGOWRMOYKM-LBPRGKRZSA-N 334.847 5.343 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCCCC2)C1 475581543 GQDLXLIJJWYPFZ-UHFFFAOYSA-N 326.484 5.337 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(C(F)F)cc1 481993168 SQXYHDGWDGKWDX-LJQANCHMSA-N 326.390 5.053 30 20 EKED CN(CCCCC#N)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482991841 VYZIIZIXNSDMRE-LJQANCHMSA-N 330.834 5.194 30 20 EKED CN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccc(-c2ccccc2)cc1 544399351 BGZMHPTYWNCYPZ-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 559863921 WDIGLDQRURCISR-FDDCHVKYSA-N 332.491 5.651 30 20 EKED CCCCOc1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 585765034 CJGHLCHQFOCHKU-HNNXBMFYSA-N 342.870 5.241 30 20 EKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cc1 728440965 ATVDLDPRNOHIPF-MLPAPPSSSA-N 339.460 5.042 30 20 EKED Cc1ncccc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 728786285 YKVGZQQWABIFTD-DAXSKMNVSA-N 326.610 5.246 30 20 EKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(Cl)cc1 730092636 NLWNOPAUHQSMTH-HXUWFJFHSA-N 346.817 5.002 30 20 EKED N#CCCCOc1cccc(/C=C2\C(=O)c3cccc4c3[C@H]2CCC4)c1 763291482 XPPQNARCIBISOS-SLOMDMAXSA-N 343.426 5.069 30 20 EKED C#CCOc1ccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)o3)cc2)cc1 777649274 CZXUYBMIELLKBO-MRXNPFEDSA-N 346.430 5.144 30 20 EKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1cccc(C#N)c1 785535983 XNOADWLGTAUQJN-ZDUSSCGKSA-N 342.851 5.108 30 20 EKED N#C[C@@H](C(=O)CCCC1CCCCC1)c1cc(C(F)(F)F)ccn1 813218799 ZOMBABOMDHIABV-OAHLLOKOSA-N 338.373 5.027 30 20 EKED CC1(C#N)CCC(Nc2cccc(CC[C@H](O)c3ccccc3)c2)CC1 823543829 KADKZOLWRSLJKQ-APKLWFBNSA-N 348.490 5.237 30 20 EKED Cc1nn(C)cc1C(=O)/C=C\c1ccc(-c2ccccc2Cl)s1 917519732 DPWKCWXDXAIACU-CLFYSBASSA-N 342.851 5.007 30 20 EKED Cc1ccccc1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777465307 MELICZGHGALWKD-NTCAYCPXSA-N 342.394 5.256 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 90665779 YWCDHEWNWSRGMW-RHSMWYFYSA-N 341.524 5.445 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2C(C)(C)C)s1 430602554 WICZETPQMGDFLV-CQSZACIVSA-N 340.492 5.228 30 20 EKED CC(C)c1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431858096 JHTDKGDDSNPKFL-NRFANRHFSA-N 349.478 5.044 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(C(F)(F)F)cc1 439428924 GVNBZRGDDZBCBM-LLVKDONJSA-N 338.760 5.081 30 20 EKED COc1cccc(Oc2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2)c1 439571577 LJLZAGKDXVVPHK-MRXNPFEDSA-N 344.414 5.532 30 20 EKED CC[C@@H](F)CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 440493812 YDBKTNFBBULBBS-NEPJUHHUSA-N 331.275 5.037 30 20 EKED CC[C@@H](NCc1nc2cc(Cl)ccc2s1)c1ccc(C#N)cc1 447561171 GSNMHTHJHMAUAE-OAHLLOKOSA-N 341.867 5.062 30 20 EKED CC[C@H](N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(C#N)cc1 447583648 CAIVYRZVBFWSMC-RBUKOAKNSA-N 338.426 5.040 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccc(Cl)c2ccccc12 462646333 WIIMNADISOXGQH-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1sccc1C#N 464363910 LLYQZNFTOAJDCT-OAHLLOKOSA-N 346.455 5.120 30 20 EKED N#Cc1ccc(F)cc1CSCc1csc(-c2ccsc2)n1 469327708 YSCOQVXDXNLVSL-UHFFFAOYSA-N 346.477 5.316 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1CCC 475575776 SPOUSLVDWIVPTN-GOSISDBHSA-N 328.500 5.725 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc(Cl)ccc1Cl 515097778 UWDMBQBDYKCQQI-VOJFVSQTSA-N 331.246 5.203 30 20 EKED N#Cc1cccc(CN(Cc2cccs2)Cc2cccs2)c1F 539196612 AQKYODVLWZYGCJ-UHFFFAOYSA-N 342.464 5.023 30 20 EKED CCOc1cccc2cc([C@H](C)NC3(c4cccc(C#N)c4)CC3)oc12 551806114 JUGREZDDCAMHQM-HNNXBMFYSA-N 346.430 5.043 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCC1CCCCC1 603527013 DXJWKEFWDZFCGY-UHFFFAOYSA-N 326.484 5.046 30 20 EKED C=CCN(C(=O)CC1CCCCC1)c1nc(-c2ccccc2)cs1 641900544 ZRNCUOLTZPQXIN-UHFFFAOYSA-N 340.492 5.300 30 20 EKED CCn1c2ccccc2c2cc(C=Nn3cnc4ccccc43)ccc21 725848804 JEXPKNVYQVCWEP-UHFFFAOYSA-N 338.414 5.046 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cccc(C#N)c2)cc1 741467136 HJLHROIZYQEQNK-KAMYIIQDSA-N 339.394 5.130 30 20 EKED CCOc1ccc(O)c(/C=N\[C@H](C)c2ccc(-c3ccncc3)cc2)c1 746393867 LRCAWNIXTAHUGW-OYJNRBEISA-N 346.430 5.033 30 20 EKED N#CCC[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccccc1 747690015 CUZUUHTVHJHWAG-SJJOQSKNSA-N 333.218 5.163 30 20 EKED CC[C@H](C)CN(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748942389 PBAOKHPJMUKVJC-UWJYYQICSA-N 349.478 5.242 30 20 EKED CCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 761046289 DUTFBVNHLHQKHP-AWEZNQCLSA-N 344.867 5.220 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccncc1 766017803 DRSRWACCIUSOAL-GWCFXTLKSA-N 327.280 5.418 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1ccc(-c2ccncc2)cc1 782888983 AUXPHYVIYOYFLQ-CMDGGOBGSA-N 336.394 5.193 30 20 EKED CCCCCCC[C@H](C)CNc1cc(C)c([N+](=O)[O-])cc1C(=O)O 1776782288 CFGRLRPDHXUMOM-ZDUSSCGKSA-N 336.432 5.010 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC[C@@H](CCC)c1ccccc1 1776782380 NORIBZVAQUSCJA-WOJBJXKFSA-N 333.516 5.364 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(Cl)c1Cl 1776783731 GTRCJBHSBZKHKV-AWEZNQCLSA-N 346.298 5.287 30 20 EKED N#C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1 34649194 YHITWOLMQMDJKP-HXUWFJFHSA-N 332.834 5.284 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)n1 89980100 UEDXCVWKZLSTHD-MRXNPFEDSA-N 336.416 5.017 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(SC(F)F)cc1 90665475 KGXDZDSICCRVRW-KSSFIOAISA-N 346.446 5.697 30 20 EKED N#Cc1csc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)c1 177682606 ZFTFJAUHTBVXQG-OAQYLSRUSA-N 344.439 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1F 189909973 XOKQSICHARPDQI-UHFFFAOYSA-N 331.818 5.583 30 20 EKED N#CCCC[C@H](N[C@@H]1CCC[C@@H](c2cccnc2)C1)c1ccccc1 340440761 CTGYCODLRZWUAS-FCEUIQTBSA-N 333.479 5.133 30 20 EKED CC[C@H](NCc1ccc(C#N)s1)c1ccc2cc(OC)ccc2c1 421884008 QOMPHOHECGXQIJ-FQEVSTJZSA-N 336.460 5.022 30 20 EKED Cc1noc(C)c1-c1ccc(OCc2ccc(Cl)cc2C#N)cc1 432301564 JSGLUBQVKDDABO-UHFFFAOYSA-N 338.794 5.063 30 20 EKED C[C@H](Sc1nc2ccccc2n1C(F)F)c1cccc(C#N)c1 442911100 HBDNDEZBAZOSST-NSHDSACASA-N 329.375 5.156 30 20 EKED Cc1c(C(=O)N(CC#N)c2ccccc2)oc2c1ccc1ccccc12 497897987 CSFVUXAAZHGMHH-UHFFFAOYSA-N 340.382 5.065 30 20 EKED C=CCCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 523273113 UFVOHXRJKXIZLO-GOSISDBHSA-N 334.246 5.165 30 20 EKED C[C@H](N[C@H]1CCCc2c1sc1ccccc21)c1ccc(C#N)cc1 532465306 WAKMIGZLPHEXCH-LIRRHRJNSA-N 332.472 5.501 30 20 EKED N#Cc1ccc(CNc2cccc(Cl)c2SCC(F)F)s1 538833130 KSTVMGGIQZUUPQ-UHFFFAOYSA-N 344.839 5.242 30 20 EKED CC[C@@H]1C[C@H](CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542946662 XNTUBDNELAEQOQ-GEQKSPFYSA-N 348.490 5.081 30 20 EKED N#CCCC[C@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1 556907902 FHQMHRMFYKYSMQ-QHCPKHFHSA-N 348.490 5.533 30 20 EKED N#CCCCCCC(=O)Nc1cc(F)ccc1Oc1ccccc1 588915130 GMMVIXLGXOREIC-UHFFFAOYSA-N 326.371 5.031 30 20 EKED N#C[C@]1(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)CC12CCCC2 590975720 BYWYUGSGIONZBQ-HNNXBMFYSA-N 343.641 5.059 30 20 EKED Cc1cccc2sc(C(=O)N(CC#N)c3ccccc3)c(Cl)c12 604517856 OLYKCWJRXITNAV-UHFFFAOYSA-N 340.835 5.034 30 20 EKED C=CCN(C(=O)N[C@@H](C)c1ccc(Oc2ccccc2)cc1)C(C)C 726270327 VPHGQDBRGPQXBY-KRWDZBQOSA-N 338.451 5.146 30 20 EKED CCc1oc2ccccc2c1C=NOCc1nc2ccccc2s1 727490217 GCXGEOBFVIBMTO-UHFFFAOYSA-N 336.416 5.156 30 20 EKED C=CC[C@H](NC(=O)N1CCCCC[C@H]1c1ccccc1)c1ccncc1 734681812 ZMQWUVVBQIPMQK-SFTDATJTSA-N 349.478 5.026 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cc1F 747003895 UCSJECQYWZSAQV-QHHAFSJGSA-N 325.166 5.037 30 20 EKED CCCCCC[C@](C)(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N 780148908 NBVYLMFZOAUWSH-JXFKEZNVSA-N 330.472 5.303 30 20 EKED N#Cc1sc(Oc2ccc(Sc3ccncc3)cc2)nc1Cl 804400105 NMFHTDVDKGJDAH-UHFFFAOYSA-N 345.836 5.007 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC[C@H]1C 98030900 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FJWLTXIGOUSNRF-LFIBNONCSA-N 348.446 5.131 30 20 EKED CCC(CC)N(C(=O)c1sccc1C#N)c1ccc(C)c(C)c1 728469364 MBEMOECDEAFCDR-UHFFFAOYSA-N 326.465 5.072 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 750683399 SVCUQPJBVFDSRO-GPZRYRNASA-N 346.817 5.168 30 20 EKED C[C@@H]1CC/C(=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 753578138 CCJGGZOCEZQYBP-VDMTXUJASA-N 330.431 5.027 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 756299230 COBUQLYOLSUWGR-CJNGLKHVSA-N 326.465 5.270 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(C(F)F)c1F 1776784076 WRNVODVKUFYQKW-CQSZACIVSA-N 345.405 5.057 30 20 EKED CC(C)[C@@H](NCc1cc(C#N)cs1)c1cccc(C(F)(F)F)c1 177694681 FCUGXJIYMGGEOB-MRXNPFEDSA-N 338.398 5.125 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 474695474 CLMWUQJVGJJEEG-SFHVURJKSA-N 348.446 5.034 30 20 EKED N#CC[C@@H](CC(=O)N1CCCCC[C@H]1c1ccccc1)c1ccccc1 474956054 UMEGNVFVCRYIET-VXKWHMMOSA-N 346.474 5.218 30 20 EKED C=CC[C@H](C(=O)N(CC)Cc1ccc(Cl)s1)c1ccccc1 487646613 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30 20 EKED CC(C)(CCC#N)CN[C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 554076530 FRTPKXJPOROMGD-WBVHZDCISA-N 338.417 5.261 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 554364534 HXSMLRXBGCHNFN-SJORKVTESA-N 338.417 5.261 30 20 EKED C=CCC[C@@H](NCc1cccc(C(=O)OC(C)(C)C)c1)c1ccco1 586791544 YVJCKFLEGSPYJT-GOSISDBHSA-N 341.451 5.032 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 605206652 QJCJFZCBXVAOBK-UHFFFAOYSA-N 349.434 5.171 30 20 EKED C[C@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1F 611589172 MFUCETQECWZNJW-AWEZNQCLSA-N 326.415 5.186 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C12CC3CC(CC(C3)C1)C2 612795053 OJNSZWFETLRDGC-UHFFFAOYSA-N 349.927 5.133 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(F)c(-c2cccs2)c1 618741457 GMDSAAOWURSMNW-HXUWFJFHSA-N 348.446 5.203 30 20 EKED O=C(/C=C/c1ccc(Br)cc1Cl)c1cccs1 742429773 ZKUXUFDAUOQKOU-GQCTYLIASA-N 327.630 5.060 30 20 EKED C[C@H](CCC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 750313182 NXRZBXIGOPBKAI-GDBMZVCRSA-N 334.444 5.056 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)n1 756571963 QIGXRRURFZFSHR-QKPAOTATSA-N 330.497 5.049 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(-c2ccncc2)cc1 760264736 MJHMFPBLZOYWMS-HJWRWDBZSA-N 346.455 5.369 30 20 EKED C[C@@H](Nc1ccc(SC(C)(C)C)cc1)c1ccc(OCC#N)cc1 777672814 CATVVZCXEJIZRU-OAHLLOKOSA-N 340.492 5.653 30 20 EKED Cc1c(C(=O)/C=C\c2ncc(C(F)(F)F)s2)oc2ccccc12 788347456 AXOJLBMLYWEGAQ-SREVYHEPSA-N 337.322 5.113 30 20 EKED COc1cc(NN=Cc2c(Cl)cccc2Cl)ccc1Cl 788468163 QCIXXRMOSZOSBP-UHFFFAOYSA-N 329.614 5.101 30 20 EKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc(Cl)c1 795980195 CFBHUSMNGNJUDU-RHSMWYFYSA-N 327.811 5.032 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCC[C@H]1CC1(Cl)Cl 819066985 FRFJPUIREABBDK-NEPJUHHUSA-N 329.296 5.077 30 20 EKED CSc1ccc(/C=C/C(=O)c2sccc2Br)cc1 915114036 ZUFVBNJXASBLEU-QPJJXVBHSA-N 339.279 5.129 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cc1O 916141846 WDJKPBBQFWDARO-NTUHNPAUSA-N 346.382 5.089 30 20 EKED Cc1cccc(Cl)c1NN=Cc1csc2ccc(C(=O)O)cc12 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20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)s1 1776339689 MYSUFUKBVBNIDR-FNORWQNLSA-N 348.851 5.194 30 20 EKED N#Cc1csc(CNCc2ccccc2-c2ccc(Cl)cc2)c1 237804007 ZRVKWHSXWFXWCO-UHFFFAOYSA-N 338.863 5.230 30 20 EKED Cc1cc(O)nc2cc(/C(O)=N/[C@H]3CCCCC34CCCC4)ccc12 329615861 LEAJILNOELPIPT-SFHVURJKSA-N 338.451 5.056 30 20 EKED N#CCCC[C@H](Nc1ncnc2c1oc1ccccc12)c1ccccc1 431492358 CKHWWLTZRZIEJO-KRWDZBQOSA-N 342.402 5.223 30 20 EKED CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458799928 KMOOSVLEQQERIS-IHPCNDPISA-N 341.499 5.032 30 20 EKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458801125 MQPBXROWWLYROB-DFQSSKMNSA-N 341.499 5.032 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@@H]1CCCc2cc(C#N)ccc21 467404763 ZSIOBUUTXCVQAK-LJQANCHMSA-N 344.380 5.053 30 20 EKED C[C@@H](CC1CCCC1)C(=O)Nc1ccccc1SC[C@H](C)C#N 510863368 BWODGQWESCDQKZ-CABCVRRESA-N 330.497 5.093 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1OCC(C)C 511537011 GACWPVQWJRBSPE-UHFFFAOYSA-N 344.480 5.003 30 20 EKED N#Cc1c(Br)ncc(-c2ccccc2)c1-c1ccccc1 514260790 BUYHASUVQDZWES-UHFFFAOYSA-N 335.204 5.050 30 20 EKED CCc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 515690095 YMIXGCKYAFXNTO-UHFFFAOYSA-N 332.428 5.101 30 20 EKED C=CCN(Cc1cccs1)Cc1c(Cl)ccc2cccnc12 517646119 HPARSEQQPKEZPT-UHFFFAOYSA-N 328.868 5.138 30 20 EKED CC(C)(C#N)CCCSCc1cc(Cl)c2c(c1)OCCCO2 532201973 MSUSBHOKQJKNCW-UHFFFAOYSA-N 339.888 5.064 30 20 EKED CC(C)(C)CN(CCC#N)C(=O)N(c1ccccc1)c1ccccc1 543902560 ZFUMKJISKGMMHX-UHFFFAOYSA-N 335.451 5.206 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)sc1Cl 551802873 WCOOMDJEJNXAOC-SNVBAGLBSA-N 337.275 5.266 30 20 EKED N#C[C@@H](C(=O)c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 592973963 MELVOQAKVSIEPT-INIZCTEOSA-N 346.386 5.079 30 20 EKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cc2ccccc2s1 594924336 MAWHGSKXRRKVKJ-OAHLLOKOSA-N 332.472 5.307 30 20 EKED N#CC1(CCCSC[C@@H]2CC[C@@H](c3ccccc3)C2)CCOCC1 596391218 JQMXBJHSTWTIQQ-UYAOXDASSA-N 343.536 5.404 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCc1ccccc1 603968980 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20 EKED C[C@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc(C#N)c(F)c1 777659302 JPHKIJRCWFKZNZ-ZDUSSCGKSA-N 343.833 5.124 30 20 EKED N#CCCCCOC(=O)c1sc2cccc(Cl)c2c1Cl 914627127 BPMXHNJMSCAITB-UHFFFAOYSA-N 328.220 5.059 30 20 EKED CCCCCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920804764 YUPIQZZTTNUUSQ-GFCCVEGCSA-N 348.418 5.235 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776339815 RSUZEORUEGZQBC-KHPPLWFESA-N 342.822 5.133 30 20 EKED CCc1c(C)sc(NC(=O)c2cc(Cl)sc2Cl)c1C#N 68677857 YXOSRQBUMAWQRD-UHFFFAOYSA-N 345.276 5.111 30 20 EKED C=CCn1c(S[C@H](C)c2ccc(F)cc2)nnc1-c1ccoc1C 72098940 SKROGJLMFMBZTE-CYBMUJFWSA-N 343.427 5.025 30 20 EKED Cc1cccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1Cl 118980347 SQTBBZVWUCCOIP-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC1CCCCCC1 189912558 WEXKYKFNOLOCHC-QGZVFWFLSA-N 343.511 5.605 30 20 EKED CC[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 236948133 FGWTYQVGEQOFKX-FQEVSTJZSA-N 342.870 5.263 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(Cl)c1 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332.419 5.062 30 20 EKED CCCCCCC[C@@H](C)CN=c1c(C(=O)O)c[nH]c2ccc(C)cc12 1776782394 RRGUIMGEFFBLTR-MRXNPFEDSA-N 342.483 5.072 30 20 EKED N#C[C@@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 46441491 QUCLQCBTUORLIW-JTQLQIEISA-N 347.226 5.093 30 20 EKED O=C(O)c1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cc1 83193374 OJCARDYMAVHZLJ-OVCLIPMQSA-N 344.366 5.073 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 186105905 NKPPHERUWWGTOZ-LLVKDONJSA-N 338.835 5.203 30 20 EKED N#CCc1cccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)c1 189744344 UPVHYUPZZSJFNY-UHFFFAOYSA-N 346.817 5.325 30 20 EKED CCCCC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1 236850734 VSXANMVCPRPOCG-XMSQKQJNSA-N 336.479 5.389 30 20 EKED CC(C)(Cc1nc2ccccc2[nH]1)/C(O)=N/[C@@H]1CC[C@@H]2CCC[C@@H]2C1 328806768 LZQGETRSWKREKR-ARFHVFGLSA-N 339.483 5.057 30 20 EKED CC[C@H](/C(O)=N/[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1c(C)noc1C 329927992 XMDVHYYLWFUVAL-JQHSSLGASA-N 344.430 5.217 30 20 EKED N#CCCC[C@H](NC(=O)c1cccc2ccsc12)c1ccccc1 352168713 VZGRPROXKDVWNZ-SFHVURJKSA-N 334.444 5.066 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(C#N)cc(N(C)C)c1 432659070 PIJDJPNLIAPYHM-UHFFFAOYSA-N 349.478 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc2c1CCCC2 476807924 RFLZAOVSCIXLGM-UHFFFAOYSA-N 339.504 5.731 30 20 EKED C=C[C@H](CC(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccccc1 477528299 WJJICNVNFBZPEH-GOSISDBHSA-N 342.442 5.355 30 20 EKED CC(C)(C)c1c(CC#N)nc2sc3c(c2c1-c1ccncc1)CCC3 478268442 YBRLSCOEBOTSKW-UHFFFAOYSA-N 347.487 5.211 30 20 EKED C=CCCCC(=O)N(C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 479600925 SDLPSIVJUBFFKG-MRXNPFEDSA-N 342.508 5.303 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1CCC(C)C 521198914 XFSHOCBBPGLPPW-UHFFFAOYSA-N 342.508 5.557 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCCCCC#N 588154066 RZRFBIRKBXBTLT-UHFFFAOYSA-N 347.418 5.072 30 20 EKED Cc1nc(S[C@@H](C#N)Cc2ccccc2)n(C2CCCCC2)c1C 604084889 JRYCVOBSYUYHNS-LJQANCHMSA-N 339.508 5.232 30 20 EKED Cc1ccc(N(CCC#N)C(=O)CCc2ccc3ccccc3c2)cc1 726940124 JECJYNVDWOWNEB-UHFFFAOYSA-N 342.442 5.028 30 20 EKED CC(=NNc1cc(C)ncn1)c1ccc(-c2ccc(Cl)cc2)s1 731935546 FOZWXJFOHBPGFV-UHFFFAOYSA-N 342.855 5.003 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2ccc(C#N)cc2)o1 734303044 BGJOKUIIHKMXJQ-JXMROGBWSA-N 331.346 5.162 30 20 EKED CCCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 735214225 NYDYYGNONILOOM-ZFWWWQNUSA-N 346.471 5.608 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cc(Cl)ccc1Cl 740764183 NJNIMYFHFIHUMD-FPLPWBNLSA-N 328.198 5.438 30 20 EKED CC(=NNc1nc2ccccc2s1)c1sc(C(C)C)nc1C 751127442 NICHSQMHJVZRKN-UHFFFAOYSA-N 330.482 5.021 30 20 EKED CCc1ccc(CC)c(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1 751899782 HJXQAIYHNMZEPV-UHFFFAOYSA-N 343.883 5.145 30 20 EKED C[C@@H](ON=C1CCC1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753822015 GCDGAKACCGBXID-SECBINFHSA-N 325.195 5.266 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(OCCC(C)C)cc1)c1ccncc1 766020995 SEIHPFASBWCWQW-AVRDEDQJSA-N 338.495 5.475 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1cnn(C2CCCC2)c1 799896136 NANDMLDUMUIZRJ-ZHACJKMWSA-N 349.459 5.018 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1O 815636455 VOSNUMVKVBYAFV-OALUTQOASA-N 326.415 5.007 30 20 EKED N#Cc1cc(F)ccc1N1CCC[C@H]1c1ccccc1C(F)(F)F 864006888 OOUMDQUVMJNJFS-KRWDZBQOSA-N 334.316 5.058 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccccc2)o1 154156535 ZKUXOSBOWJPOBU-LLVKDONJSA-N 341.823 5.115 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cnn(C(C)(C)C)c1C)c1ccc(F)c(F)c1 191507813 DSSNSNVHCFJYCL-ORAYPTAESA-N 347.453 5.193 30 20 EKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@@H](C)OC1CCCCCC1 330128691 NVQFLWNYBKBSLK-OAHLLOKOSA-N 341.455 5.101 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc2ccccc2s1)c1ccccc1 352215335 CGGKJBJFEOFCMY-QGZVFWFLSA-N 334.444 5.066 30 20 EKED N#CC1(CSc2nc3c(Cl)c(Cl)cc(Cl)c3o2)CC1 440602259 NAMYRMMDANUQSC-UHFFFAOYSA-N 333.627 5.184 30 20 EKED CC(C)(C#N)CCCCNC1(c2cccc(Br)c2)CCC1 444663758 PFDFSZLJXUOOAE-UHFFFAOYSA-N 349.316 5.138 30 20 EKED Cc1nc(-c2ccccc2)sc1CNc1c(Cl)cccc1C#N 462819008 SAVJDQPPQDNGLU-UHFFFAOYSA-N 339.851 5.256 30 20 EKED C=C[C@@H](C)NC(=O)c1oc2ccccc2c1CSc1cccs1 465114267 WLIAAEFPIXEQGB-GFCCVEGCSA-N 343.473 5.091 30 20 EKED CC[C@@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 480110619 QGTKYGPQOGSXNY-LLVKDONJSA-N 344.402 5.086 30 20 EKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480807781 XIJXGENTZLCXRO-FOIQADDNSA-N 349.434 5.003 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)s1 483239644 SKXPNWMZPDLNJC-HNNXBMFYSA-N 334.444 5.084 30 20 EKED Cc1ccc(C)c([C@H](NCCCCC#N)c2ccccc2Cl)c1 491004995 KERIVRFZDOJYEN-HXUWFJFHSA-N 326.871 5.330 30 20 EKED C[C@@H](Nc1ccc(Nc2ncc(C#N)cc2Cl)cc1)c1ccccc1 513602821 JYMWEZYEASWIPO-CQSZACIVSA-N 348.837 5.523 30 20 EKED Cc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 517355886 WVRXXOFHQIUZTK-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CCC1(C)CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 517529548 DHQMVDMRBNJHKS-HNNXBMFYSA-N 345.512 5.125 30 20 EKED C=CCC[C@H](NCc1ncccc1C)c1ccc(C(F)(F)F)cc1 540433402 PZTYSMGXGKNDPV-KRWDZBQOSA-N 334.385 5.206 30 20 EKED COc1ccc(CC[C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 568891750 XYAXRDFXKOUFNN-XMSQKQJNSA-N 336.479 5.041 30 20 EKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)C[C@H](CC#N)c1ccccc1 597885458 JTCWGLBTEYKMAZ-LEWJYISDSA-N 346.474 5.055 30 20 EKED CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CCCCC1 609208740 CLGXRHJPQTWKMR-UHFFFAOYSA-N 349.434 5.147 30 20 EKED Cc1nc(-c2ccc(N[C@H](C)c3ccc(C#N)cc3F)cc2)oc1C 611588595 HNIQJKGMCOZLMO-CYBMUJFWSA-N 335.382 5.142 30 20 EKED Cc1nc(-c2ccc(N[C@@H](C)c3ccc(C#N)cc3F)cc2)oc1C 611588897 HNIQJKGMCOZLMO-ZDUSSCGKSA-N 335.382 5.142 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2)o1 618805187 DQRZHXKKKGLQLN-YWZLYKJASA-N 328.415 5.156 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1cc(Cl)sc1Cl 620307004 VVEWHNWUGWPPEU-BETUJISGSA-N 344.307 5.087 30 20 EKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1csc(C(=O)O)c1 730148933 QBDCMRYIMZJBPS-VOTSOKGWSA-N 340.425 5.071 30 20 EKED CCc1ccc(/C=C\C(=O)c2ccc(Br)s2)s1 731156065 ZLBJLNRCYYMADC-WAYWQWQTSA-N 327.268 5.031 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(F)cc3F)s2)cc1 734306722 RAUCWRHWNLNOEA-CLFYSBASSA-N 341.382 5.293 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1cccc(C(F)(F)F)c1 760263805 IOHJRVHSQPUYHI-FPLPWBNLSA-N 337.366 5.326 30 20 EKED O=C1/C(=C\c2cnc(-c3ccco3)s2)[C@@H]2CCCc3cccc1c32 789143687 QFZARKTYQQVWSR-FBKCMUNRSA-N 333.412 5.103 30 20 EKED C#C[C@@H](NCc1cnc(C2CCCC2)s1)c1ccc(Cl)cc1F 809699258 MPHADLSSPKZFKW-QGZVFWFLSA-N 348.874 5.057 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N(C)C)cc1 815635459 DARPLTIZQZXLNX-FGZHOGPDSA-N 335.495 5.228 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1cc(Cl)ccn1 853328397 HBVMXBSILHQYRL-UHFFFAOYSA-N 347.690 5.188 30 20 EKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccc(CCC#N)cc2)c1 932572259 AXAOJJQDYDAHQP-NRFANRHFSA-N 347.462 5.129 30 20 EKED C=CCCC1(C(=O)O)CCN(Cc2ccc(C(C)(C)CC)cc2)CC1 1776168906 DPMLLPBNCPPUNW-UHFFFAOYSA-N 343.511 5.007 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776370440 FJDLGMLYJBRQCI-FPLPWBNLSA-N 334.824 5.119 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cccc(-c2ccncc2)c1 125566787 CYGIIDQQOMSXSY-VQHVLOKHSA-N 336.394 5.193 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(OC(F)F)cc1 172907514 WFGGTOWCWJSFHX-ZDUSSCGKSA-N 348.418 5.294 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccsc1Cl 186972021 OTOKZXLOJKKGFI-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCO[C@H](CC)C1 276464552 OTCDUHXPBXJTDZ-FUHWJXTLSA-N 329.484 5.072 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(F)c3ccccc23)cc1 327798979 UCGDJSUDQJZUHC-UHFFFAOYSA-N 332.378 5.032 30 20 EKED CCC1(NC(O)=Nc2ccc(C(C)C)cc2C(C)C)CCOCC1 330795242 DTVLXZARJKCXSV-UHFFFAOYSA-N 332.488 5.028 30 20 EKED C[C@H](N[C@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 363696943 BKSVDMVJLOOLJE-DLBZAZTESA-N 327.431 5.032 30 20 EKED CC(C)(C)c1csc(NC(=O)c2sccc2C2CC2)c1C#N 410929240 MEEZTKAAKGEVGO-UHFFFAOYSA-N 330.478 5.108 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(CC(F)(F)F)c1 438564716 WPWXXIIPCFEAPB-UHFFFAOYSA-N 328.378 5.002 30 20 EKED N#C[C@@H]1CC[C@@H](N[C@H](c2ccccc2)c2ccc3ccccc3c2)C1 442763687 BIESFPUKPHZSET-NLSFWIRASA-N 326.443 5.211 30 20 EKED Cc1cccc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C 458392163 AGKYVKFYZBFXFO-GHTZIAJQSA-N 349.478 5.099 30 20 EKED Cc1cc2cc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)oc2cc1C 463414248 MVUSCQJUNVOOAF-UHFFFAOYSA-N 332.403 5.103 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 466874195 VQDAURSGBIPKDR-PBHICJAKSA-N 339.401 5.361 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCCC1(C)C 467468487 OOUZSGGOJGPMCJ-RHSMWYFYSA-N 345.512 5.029 30 20 EKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)c1C 476157579 NPHVDLVJSWDHDE-NRFANRHFSA-N 346.474 5.082 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1cccc(CSC(C)C)c1C 488485669 MVODYVWVQADVIB-QGZVFWFLSA-N 332.513 5.209 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2-c2ccccc2)c1 503696626 BXXUSLGORGQXLY-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](C)CCCC(F)(F)F 505058178 QPZXZOLLXOBTKG-CYBMUJFWSA-N 328.378 5.048 30 20 EKED N#CC1(CCCSCc2cccc(Cl)c2Cl)CCOCC1 512387813 PZWKXNCBKSKODN-UHFFFAOYSA-N 344.307 5.327 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1cccc(Cl)c1)c1ccccc1 535353032 CDDPJGJCTNYIEE-UZLBHIALSA-N 339.866 5.363 30 20 EKED CCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](CC)c1ccccc1 538537685 RUCVJCILWOEGCE-NRFANRHFSA-N 346.474 5.245 30 20 EKED CC(C)Oc1cccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2)C(F)F)c1 577395585 MBDJHPYECIMAOA-IFXJQAMLSA-N 344.405 5.002 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)Nc3ccc(F)cc3)c2)cc1 609199752 WHZSZECDTXCHIW-UHFFFAOYSA-N 347.349 5.134 30 20 EKED Cc1cc(C#N)ccc1CN[C@@H](c1ccc(F)cc1F)C(C)(C)C 614407465 RPQMVSLPENLKCV-IBGZPJMESA-N 328.406 5.022 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@H]1c1ccncc1 726883875 NOKGHXONXOYROZ-IMTHGLKYSA-N 328.500 5.442 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1nc2ccccc2s1 727264504 SELIOWJHLREAEN-KHPPLWFESA-N 348.452 5.316 30 20 EKED C=C1CCN(C(=O)c2cc(-c3ccccc3)nc3ccc(C)cc23)CC1 731052329 KRXPPMVZOGEOQS-UHFFFAOYSA-N 342.442 5.002 30 20 EKED CCCCCC[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 741924004 BCBMSRSWDAERGR-HZPDHXFCSA-N 332.513 5.626 30 20 EKED C=CCOc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990647 WCBXKEYQWGNGDM-LFYBBSHMSA-N 341.410 5.210 30 20 EKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 776086443 GUNCBXLXKPPQKB-TZMCWYRMSA-N 332.444 5.218 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C/c1nc2ccccc2s1 800156464 QNNIYVWFQPIYEH-BUHFOSPRSA-N 334.444 5.067 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C\c1nc2ccccc2s1 800156465 QNNIYVWFQPIYEH-YPKPFQOOSA-N 334.444 5.067 30 20 EKED CC[C@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1O 806178370 SMZLXGVJUOGAQG-ZDUSSCGKSA-N 329.271 5.070 30 20 EKED CC(/C=C\C(=O)c1ccc(Cl)nc1)=C/c1ccccc1OC(F)F 811692429 FTEJOVHTRQZXPF-CQSVFKTNSA-N 349.764 5.179 30 20 EKED CCCC[C@H](CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915180654 QPIGQZNHETZUPN-UWJYYQICSA-N 334.463 5.497 30 20 EKED N#CCc1cccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 915804923 ZLSFLVPJOREPCT-UHFFFAOYSA-N 340.386 5.420 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1ccccc1C(=O)O 1776031372 CPWKLHMGVYALMK-RHSMWYFYSA-N 330.472 5.415 30 20 EKED CC(CCCCCCC(=O)O)=NNc1ccc(F)cc1C(F)(F)F 1776110875 YFENXKQUEJRZRO-UHFFFAOYSA-N 348.340 5.058 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CCCC2)cc1Cl 46861730 OLVLFTRKYJBYTE-SFHVURJKSA-N 338.838 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CC1)[C@@H](C)C1CC1 191453655 SCQQWEMTFCDAGU-HNNXBMFYSA-N 326.484 5.333 30 20 EKED Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c(Cl)c1 191688096 WDFJYSMVGRSSSL-UHFFFAOYSA-N 332.856 5.131 30 20 EKED Cc1cccc(C)c1NC(=O)CCCSCCCCC(C)(C)C#N 277907350 OKMUSSDTJSKUSJ-UHFFFAOYSA-N 346.540 5.475 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnn([C@@H](C)CC)c1C1CC1 410394329 XQRYJGWTUSYNFY-HNNXBMFYSA-N 337.467 5.102 30 20 EKED CC[C@@H](NCCC1(C#N)CCCCC1)c1nc(C(F)(F)F)cs1 411519834 TXZWCRXWXPDEQG-GFCCVEGCSA-N 345.434 5.067 30 20 EKED C=CCN(C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 429370472 DWFSYJGCAUHRNI-LLVKDONJSA-N 346.418 5.246 30 20 EKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 444685043 QDPDHNPUCSBJQI-GOSISDBHSA-N 345.490 5.596 30 20 EKED C[C@@H](Sc1ccccc1C#N)c1nc(-c2ccc(Cl)cc2)no1 466638251 YSASCDCITCPWFK-LLVKDONJSA-N 341.823 5.115 30 20 EKED CCc1oc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C 471389708 CHDZYDNQXDEVEB-UHFFFAOYSA-N 336.416 5.003 30 20 EKED N#CC1(CCCOc2ccc(C3CCCCC3)cc2)CCOCC1 499924952 APIDGBFFNQLGMT-UHFFFAOYSA-N 327.468 5.214 30 20 EKED CCC(CC)[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccs1 538508420 LNEZUMMLKBKVSB-YJYMSZOUSA-N 330.472 5.587 30 20 EKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cl 550831236 UQEASSWSSHFIKR-DNVCBOLYSA-N 342.870 5.434 30 20 EKED N#Cc1ccnc(Oc2cc(C(F)(F)F)ccc2Cl)c1Cl 568308486 DLIBDDFKNRSDER-UHFFFAOYSA-N 333.096 5.071 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@@H](CCC#N)c1ccccc1 572916486 FNJXTJHSMPBNDR-UNMCSNQZSA-N 343.474 5.488 30 20 EKED CCC(CC)(NC(=O)CCCCC#N)c1ccc(Cl)c(Cl)c1 593975760 RAUQWVFKNXUZCJ-UHFFFAOYSA-N 341.282 5.209 30 20 EKED C=C(C)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 614092960 UACKBVXFKOCJEU-INIZCTEOSA-N 335.476 5.223 30 20 EKED Cc1cc(/C=C2/Cc3ccccc3C2=O)ccc1Oc1cccnc1 732714382 YNBMHTKVJXOJMU-PDGQHHTCSA-N 327.383 5.005 30 20 EKED Cc1cccc([C@@H]2CCCCCN2Cc2ccc(OCC#N)cc2)c1 735494666 HLLJJJLMAUKDAX-QFIPXVFZSA-N 334.463 5.015 30 20 EKED CC(C)=C(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 751120985 XEIIYBFREJPKEF-SFHVURJKSA-N 338.838 5.290 30 20 EKED C[C@@H]1CC[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 776518789 XIWARNQCHLWIGW-UXIGCNINSA-N 344.867 5.076 30 20 EKED O=C(/C=C/c1ccsc1Cl)c1cccc(-c2ccncc2)c1 790220916 YCORSIJIXLGDBK-SNAWJCMRSA-N 325.820 5.360 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792096530 PKPDTDQCUHGLBD-SZEUEKNRSA-N 346.817 5.168 30 20 EKED CCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211266 GZEUTGZOEPANHU-PBHICJAKSA-N 340.389 5.273 30 20 EKED C=CCC(F)(F)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 815146043 LXVULHAUKFTABF-AWEZNQCLSA-N 335.419 5.049 30 20 EKED Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1776127506 VSFVGMWKVQDCAO-AUWJEWJLSA-N 342.394 5.256 30 20 EKED CCCOc1ccc(/C=C/C(=O)c2ccc(Cl)s2)cc1OC 83194484 WMAYYGGKQGVLLN-GQCTYLIASA-N 336.840 5.095 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 181886947 CORRUVKUGVDCPC-AOMKIAJQSA-N 330.406 5.138 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@H](C)c2cccc(C#N)c2)o1 237426139 ICSCZIODNMUFIT-OAHLLOKOSA-N 334.394 5.117 30 20 EKED C[C@@H]1CCC[C@H](CC/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)C1 330013486 MFRLMLKFAFJEPU-RSIVFMTNSA-N 334.504 5.085 30 20 EKED C=CCC1(C(=O)Nc2nc(-c3nccc4ccccc34)cs2)CCC1 360498648 WIAUSYLNCZODGG-UHFFFAOYSA-N 349.459 5.043 30 20 EKED C=CCCc1ccccc1NC(=O)c1sc(C(C)(C)C)nc1C 410353226 QZQHQFKVTFFLED-UHFFFAOYSA-N 328.481 5.120 30 20 EKED Cc1ccc2ccccc2c1CN[C@@H](CCCC#N)c1ccccc1 433035890 OJHBWAZOZAOTRO-QHCPKHFHSA-N 328.459 5.673 30 20 EKED C[C@@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 442787854 AWIOGEJNKYSTAV-CQSZACIVSA-N 349.821 5.572 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 464653834 XLQZGRJFGMRSEI-GUYCJALGSA-N 333.884 5.209 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C)c1ccccc1 466901075 NCEHNANYLPZNFQ-WOIUINJBSA-N 333.475 5.141 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C1CCC(C)(C)CC1 494832669 KPEDQOYGTJJEND-CQSZACIVSA-N 330.497 5.093 30 20 EKED C[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 525952007 QGYNKPYZUWAZGC-GHMZBOCLSA-N 337.225 5.416 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(OC)c1)c1ccccc1 537950067 HKNSNMINBHSMON-APWZRJJASA-N 325.452 5.062 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1nccc2ccccc12 577431488 ZMLBJCSSPHIMCG-INIZCTEOSA-N 331.419 5.090 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@@H](CCCC#N)c1ccccc1 590068696 QUKNBHXMFJJLPT-IBGZPJMESA-N 346.396 5.539 30 20 EKED N#CC1(c2ccc(CNc3ccccc3CCC(F)(F)F)cc2)CC1 594931956 KGBUDIJXUICRCF-UHFFFAOYSA-N 344.380 5.349 30 20 EKED C=CCCCCCN(C)C(=O)c1oc2ccccc2c1COC(C)C 606817024 PDGMGJXVUDNBJO-UHFFFAOYSA-N 343.467 5.176 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(-c2cccs2)cc1 610829993 WBLGCHSDMVOOHA-HOTGVXAUSA-N 332.472 5.699 30 20 EKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 614184082 ZKGCNUWUYGYFMC-OAHLLOKOSA-N 332.900 5.444 30 20 EKED C=CCOc1ccc(CN[C@@H](CC)c2ccccc2OC)cc1Cl 727466030 QPLOSZYECZNCOA-SFHVURJKSA-N 345.870 5.154 30 20 EKED Cc1ncccc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 728786313 YKVGZQQWABIFTD-QPJJXVBHSA-N 326.610 5.246 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2ccc(C#N)cc2)o1 734303407 NVCKNMLZDXTSOG-PKNBQFBNSA-N 331.346 5.162 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cc(Cl)sc1Cl 747191338 CTESLQUUMRYHKV-GQCTYLIASA-N 334.227 5.499 30 20 EKED FC(F)(F)Oc1cccc(C=NOc2ccccc2C(F)(F)F)c1 754725536 VFXZJMVCHCLYDV-UHFFFAOYSA-N 349.230 5.017 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC(CC#N)CC1 781852253 UWTYTCLIQBJMON-UHFFFAOYSA-N 345.512 5.043 30 20 EKED Clc1nc(Nc2ccccc2)sc1C=NOCc1ccccc1 839420215 YSYJDMGOMOQGNI-UHFFFAOYSA-N 343.839 5.091 30 20 EKED O=C(O)c1cc(NN=Cc2ccc(C3CCCC3)cc2)ccc1Cl 1776033857 QKDSQZMCOYMEEK-UHFFFAOYSA-N 342.826 5.142 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(/C=C\C(=O)O)cc1)CC2 1776374772 NOVMWEWBJSYOGR-RIQVWZMISA-N 346.426 5.120 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 117456759 ZVSVJTGNHJPHTI-HOTGVXAUSA-N 345.512 5.125 30 20 EKED CCCCSc1nnc(S[C@@H](C)c2ccc(C#N)cc2)s1 118173796 XTGQPJUPDNWHMR-NSHDSACASA-N 335.523 5.155 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\c2ccc3ccc(Cl)cc3n2)cc1 208271724 GYWAWGFWXQFBCQ-OLUUIJGHSA-N 334.806 5.349 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)C2CCCCC2)cc1 237607161 NGCQZNWVJLAWDY-JPYJTQIMSA-N 348.490 5.389 30 20 EKED O=C(/C=C/c1ccc2ccccc2c1)c1c(Cl)nc2ccccn12 303889185 RSVIJJNTQVWWMJ-PKNBQFBNSA-N 332.790 5.037 30 20 EKED O/C(=N/Cc1ncoc1-c1ccccc1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 328776070 COHIRIPJBJEMKJ-CGTJXYLNSA-N 338.451 5.405 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CC(C)(C)C 467468746 PBJYFIUZLWACHK-CQSZACIVSA-N 347.528 5.275 30 20 EKED CC[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)s1 476052323 OUAMGCLLITWABX-HUUCEWRRSA-N 346.883 5.056 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCCC[C@H]1CC 476149450 NLYPBPGBKDUUSS-YLJYHZDGSA-N 343.511 5.462 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477508042 HEOVSQRVROBGAX-HXUWFJFHSA-N 349.478 5.493 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487486636 PNIVOMBZGUWGGU-KNQAVFIVSA-N 348.490 5.197 30 20 EKED CC(C)C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499609113 XEAQCAVTKLZJMX-IBGZPJMESA-N 348.918 5.117 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1C 510073532 OSBUFAXSGOBWHZ-HZPDHXFCSA-N 349.434 5.003 30 20 EKED C[C@H](N[C@H](COc1ccccc1)c1ccccc1)c1cccc(C#N)c1 540609554 UPJZSCZJEGUNRM-FDDCHVKYSA-N 342.442 5.029 30 20 EKED C[C@H](NCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 543428543 XWULYKDRCKJCPL-LBPRGKRZSA-N 338.398 5.388 30 20 EKED N#CCCC[C@@H](NC1CC(c2cc(F)cc(F)c2)C1)c1ccccc1 556907164 JXBQQURDYLVOLQ-FBPXKMNZSA-N 340.417 5.236 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1cccc(OCc2ccccc2)c1 562045166 VNMSVUZEFWMTHN-SFHVURJKSA-N 336.479 5.246 30 20 EKED N#C[C@H](N[C@H](COCc1ccccc1)c1ccccc1)C1CCCCC1 583328798 DBIAIOWEGPWIDH-XZOQPEGZSA-N 348.490 5.007 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@H](C#N)c2ccc(Cl)cc2)cc1 595411451 QEYRKKCMCNICTN-AUUYWEPGSA-N 328.843 5.043 30 20 EKED N#CC1(c2cccc(-c3ccccc3CC(F)(F)F)c2)CCOCC1 598929928 OOHLTLGLXKBQAJ-UHFFFAOYSA-N 345.364 5.030 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)ccc1Cl 618806864 STKOJDVXLADHIU-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1ccsc1 619788242 BVYWSEJQPCAOON-STQMWFEESA-N 345.493 5.025 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 729068178 XIDCFZKZQQLSAT-HOCLYGCPSA-N 334.444 5.056 30 20 EKED CCc1nc(C)c(C(C)=NNc2ccc(Cl)c(Cl)c2)s1 735223541 FBUNGFHBBOEACJ-UHFFFAOYSA-N 328.268 5.157 30 20 EKED CCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCC1 759541269 WGFSHYIAVANCHT-INIZCTEOSA-N 338.476 5.265 30 20 EKED C#CCCCCC(=O)Nc1cccc(Oc2ccnc3ccccc23)c1 773304026 SQCJOQSGTLOGKI-UHFFFAOYSA-N 344.414 5.159 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)cc1 774390831 ILTBKDAAEPSKTQ-SFHVURJKSA-N 331.246 5.106 30 20 EKED C[C@@H]1CC[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 776518787 XIWARNQCHLWIGW-KYOSRNDESA-N 344.867 5.076 30 20 EKED C[C@H](Nc1ccc(SC(C)(C)C)cc1)c1ccc(OCC#N)cc1 777672807 CATVVZCXEJIZRU-HNNXBMFYSA-N 340.492 5.653 30 20 EKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccs1 818194738 OEVZVOOJJDBJLQ-VQHVLOKHSA-N 341.413 5.281 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2cccs2)cc1F 917519556 RTHCLYVJOCHGIH-SREVYHEPSA-N 329.421 5.215 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)c1 1776341486 SJRMCSBSNGKRSB-MDZDMXLPSA-N 342.822 5.133 30 20 EKED CC(C)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 58989376 UNTXYMSIIDYMPW-GOSISDBHSA-N 340.854 5.370 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2)no1 189905304 QGQOGZQHUYPNDG-UHFFFAOYSA-N 346.430 5.446 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NCC(C)(C)CCC#N)cc2)cs1 343252211 IWVCOOCGUWUUFL-CQSZACIVSA-N 327.497 5.099 30 20 EKED CC[C@@H](N[C@H](c1ccc(C)cc1)c1ccccn1)c1ccc(C#N)cc1 366863893 KGYCOCMFAHZPKX-FYYLOGMGSA-N 341.458 5.092 30 20 EKED CC[C@H](SCc1ncc(C#N)cn1)c1ccc(Cl)cc1Cl 419517331 IPGABILMCULWPN-AWEZNQCLSA-N 338.263 5.040 30 20 EKED CC[C@@H](NC(=O)c1sc2ccc(C#N)cc2c1C)c1cccs1 429899948 DWXXTASREKLJQT-CQSZACIVSA-N 340.473 5.024 30 20 EKED CCCCc1nc(CN[C@H](CCCC#N)c2ccccc2)cs1 433017623 ZNOSCLNYRJZVKT-GOSISDBHSA-N 327.497 5.010 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 489599453 REPNRLHKQQMHHQ-LAUBAEHRSA-N 349.478 5.014 30 20 EKED CC1CCC(C)(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 520856478 GWLKWFGONYCKSF-HVEKOLDVSA-N 345.512 5.029 30 20 EKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)C[C@H](CC#N)c2ccccc2)C1 561279924 WGOPMVJJSXDDNH-COPCDDAFSA-N 346.474 5.074 30 20 EKED O=C(/C=C\c1ccnc2ccccc12)c1cc2cc(Cl)ccc2o1 731835956 XAVWNSYFYFWLJT-ALCCZGGFSA-N 333.774 5.531 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1ccnc2ccccc12 735233413 VSAPXSLCLPLXMJ-UHFFFAOYSA-N 340.835 5.083 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cccc(Cl)c3)c2)s1 740013738 JRDXPDAKGROIDD-UHFFFAOYSA-N 338.863 5.230 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1cccc(OC(F)F)c1 741848509 NNQMJFNFMOXEJE-WAYWQWQTSA-N 332.277 5.069 30 20 EKED CCCCCC[C@@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 741925408 PRXVJSUGTUIJDW-JKSUJKDBSA-N 332.513 5.483 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1cccc(Cl)c1Cl 742434631 LTCOBXASTGXDSG-MDZDMXLPSA-N 343.213 5.280 30 20 EKED CCOc1cccc(/C=N\[C@@H](C)c2ccc(-c3ccncc3)cc2)c1O 746393191 HRGMWFMFTNDTOO-PHQOBFFQSA-N 346.430 5.033 30 20 EKED C#CCCCNC(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 752716920 TWYGPWFLZYJAOO-INIZCTEOSA-N 338.476 5.075 30 20 EKED C[C@@H](C#N)CN(C(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CC1 754384656 POKOEJCXUMGWRL-HNNXBMFYSA-N 347.422 5.258 30 20 EKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(C2CCCCC2)cc1 780153036 HLGPORNCOXFAMZ-MRXNPFEDSA-N 348.446 5.277 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCC2(CCC2)CO1 890166091 XLTMDAYBQCRIBJ-GOSISDBHSA-N 341.495 5.216 30 20 EKED O=C(O)c1cc(NN=C2CCCCC[C@H]2c2ccccc2)ccc1F 1776064520 SJLPMKWTKZPXCU-INIZCTEOSA-N 340.398 5.040 30 20 EKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 11048930 POASVFGQQBIBGP-OAQYLSRUSA-N 332.834 5.091 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 58829469 VMZSGFOOBOZPGP-UHFFFAOYSA-N 335.234 5.214 30 20 EKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 80457945 WVHNJGGIFCSSCY-HZPDHXFCSA-N 326.465 5.027 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Cl)c1F 153623935 OPYLCLRFRXZYDJ-NSHDSACASA-N 348.830 5.126 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)c(F)c1 237484679 LCRDWNJQFYGIFQ-INIZCTEOSA-N 346.405 5.340 30 20 EKED N#Cc1ccc(Oc2ncnc3sc(-c4ccccc4)cc23)c(F)c1 301708978 UFDMCEUHUWZJAX-UHFFFAOYSA-N 347.374 5.161 30 20 EKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CC23CCCC3)c1)C1CCC1 330000710 WYSNQCRSHVPOMM-KRWDZBQOSA-N 326.440 5.112 30 20 EKED CCc1cc2c(N[C@@H](CCCC#N)c3ccccc3)ncnc2s1 431512938 REAQVJCLBGNMKL-KRWDZBQOSA-N 336.464 5.101 30 20 EKED C[C@@H](Sc1cccc(Cl)c1C#N)c1noc(-c2ccccc2)n1 446068906 DWYJUXFCVSGIDD-LLVKDONJSA-N 341.823 5.115 30 20 EKED C[C@H](NCc1ccc(-c2cccc(F)c2)s1)c1ccc(C#N)cc1 509569407 LOJZRPJGATZKIL-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C[C@H](Nc1ccc(C#N)cc1F)c1ccc(Oc2cccnc2)cc1 517051033 RYJTVGGBCNIPFI-AWEZNQCLSA-N 333.366 5.058 30 20 EKED C=C1CCN(C(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)CC1 520822853 MWAXOWIRGCFWNG-UHFFFAOYSA-N 345.801 5.064 30 20 EKED C=C[C@@H](CC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccccc1 534982962 XNODCQQWERVNKN-HOTGVXAUSA-N 337.467 5.030 30 20 EKED CCOc1ccccc1[C@H](CC)NCc1ccccc1C(C)(C)C#N 539253010 JEQDMMTWBBSLJN-FQEVSTJZSA-N 336.479 5.127 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2F)s1 554360020 OARUTRVVBDKZPX-AWEZNQCLSA-N 330.472 5.535 30 20 EKED CCOc1ccc([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cc1 619508238 YNQKZYNDWUUTOR-ZHRRBRCNSA-N 334.463 5.075 30 20 EKED N#C[C@H](Sc1ccc(C(F)(F)F)cn1)c1ccc(Cl)cc1 619863714 LAGZSQGMQCSLTK-LBPRGKRZSA-N 328.746 5.111 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc(C)c(C)c2)c1 727284343 YBKGKEFCQLOTFR-UHFFFAOYSA-N 326.465 5.067 30 20 EKED Cc1ccc(-c2nc(/C=C3/CCOc4ccccc4C3=O)cs2)cc1 728441406 JLYZLYVZHURYEL-VBKFSLOCSA-N 347.439 5.167 30 20 EKED N#CC(CCSc1nccs1)(c1ccccc1)c1ccccc1 766068787 RKFHAEANMVBFTP-UHFFFAOYSA-N 336.485 5.135 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 776075553 XYTFJOMGUAIEAR-FXAWDEMLSA-N 342.442 5.070 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(SC(F)F)cc1 777250515 QTXQTBBERDRNGK-CYBMUJFWSA-N 344.430 5.213 30 20 EKED O=C1/C(=C/c2scnc2C2CC2)Cc2cc(Cl)cc(Cl)c21 782347175 JBCWACPKQMUNIY-BJMVGYQFSA-N 336.243 5.150 30 20 EKED N#C[C@@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2ccccc2s1 798814517 OSMFHKCYLSZPLM-PREGVCBESA-N 346.455 5.056 30 20 EKED CCCCCCCCCC(=O)Nc1ccccc1C(=O)N1CCCC1 887735068 NSORHMWAQHIJRQ-UHFFFAOYSA-N 344.499 5.002 30 20 EKED N#Cc1c(-c2ccccc2)cc(-c2ccc(Cl)cc2)nc1Cl 83204190 QTHBQZAJKIBOIA-UHFFFAOYSA-N 325.198 5.594 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC[C@@H]1C 98030899 YYBAFUXAWNNHDU-INIZCTEOSA-N 349.434 5.065 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)s1)c1ccc(C(F)(F)F)cc1 130353216 CUINQHKCRCBHPB-INIZCTEOSA-N 338.398 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(SC)ccc1C 189904713 IUYAYWICJADKIC-UHFFFAOYSA-N 339.504 5.821 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC[C@@H]1CCCCO1 191423130 XGVWLKPOXOXIAO-SFHVURJKSA-N 344.499 5.009 30 20 EKED CCC[C@@H](NCc1cc(C#N)cs1)c1cccc(C(F)(F)F)c1 236911048 YOWZBKSVOYPYMN-MRXNPFEDSA-N 338.398 5.270 30 20 EKED Cc1cccc([C@@H](Nc2cc(Cl)ccc2C#N)c2ccccn2)c1 301869848 HCQWOJGYMUOUEG-HXUWFJFHSA-N 333.822 5.117 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CCCCCCC1 303289530 ANMABINMUGWBRV-HNNXBMFYSA-N 345.512 5.173 30 20 EKED CC(O)=Nc1ccc(F)c(/C(O)=N/[C@H]2CCCCC23CCCC3)c1 329633700 SPXNRLKJEBXTQW-KRWDZBQOSA-N 332.419 5.241 30 20 EKED C=CCCc1ccccc1NC(=O)CCc1c[nH]c2cc(C)ccc12 410351449 XRYUMDLZIGSHIY-UHFFFAOYSA-N 332.447 5.166 30 20 EKED CCc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 452138790 KKJLTAYTBQSYFH-LJQANCHMSA-N 346.430 5.160 30 20 EKED CCCn1ccc2cc(NC(=O)C[C@H](CC#N)c3ccccc3)ccc21 475446031 DAKUCQSOHNQWGI-SFHVURJKSA-N 345.446 5.077 30 20 EKED CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1SC[C@@H](C)C#N 475759904 CNLWWGUUFVKGIH-XHSDSOJGSA-N 330.497 5.093 30 20 EKED N#Cc1ccc(Oc2ccc(OCc3ncc(Cl)s3)cc2)cc1 478933417 WJDYCPXLSYQNNH-UHFFFAOYSA-N 342.807 5.039 30 20 EKED COc1cc(Cl)ccc1CNc1ccccc1SC[C@@H](C)C#N 480144940 PRFYKAIQCKZFLF-ZDUSSCGKSA-N 346.883 5.212 30 20 EKED C[C@@H](Sc1cccc(C#N)c1)c1nnc(-c2ccccc2F)s1 484499581 GSMBYRDIQRMIQB-LLVKDONJSA-N 341.436 5.069 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(OC(F)F)cc1F)c1ccccc1 512451495 HZTPWKFTYVVYNC-HNNXBMFYSA-N 349.352 5.116 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1OC(F)F 537407288 JRFISVNVAQZWFZ-PXAZEXFGSA-N 348.368 5.101 30 20 EKED Cc1cc(Cl)cc(C)c1CN[C@H](CCCC#N)c1ccccc1 568423579 BVFHYXFGICZHOY-HXUWFJFHSA-N 326.871 5.482 30 20 EKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)cc2c1 583352731 JWUPZHKLQALXFW-CYBMUJFWSA-N 348.452 5.310 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2occc2s1 609860112 LWAHTFXWMZQGAX-NSHDSACASA-N 342.445 5.141 30 20 EKED CCOc1ccccc1[C@H](CC)N[C@H]1CCCc2cc(C#N)ccc21 611392384 PQYMZKGPLLYDTP-SFTDATJTSA-N 334.463 5.075 30 20 EKED C=CCSc1ccccc1NC(=O)CS[C@H](C)c1cccs1 737403126 VLDDILNXMCKTLF-CYBMUJFWSA-N 349.546 5.459 30 20 EKED FC(F)(F)c1ccc2sc(NN=C[C@@H]3CC=CCC3)nc2c1 743445390 SBCBKQQBOQOGTF-SNVBAGLBSA-N 325.359 5.069 30 20 EKED CCOc1cc(/C=C\C(=O)c2coc3ccccc23)cc(Cl)c1O 747705595 OIOLCMOQVCAQTQ-FPLPWBNLSA-N 342.778 5.087 30 20 EKED CCCCCCCC(=O)N1CCC[C@H]1c1nc2ccccc2n1CC 751234549 ZYAIXXZVIADIEP-IBGZPJMESA-N 341.499 5.080 30 20 EKED C[C@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 755610354 NIVCRYKRHLDJQU-OLZOCXBDSA-N 347.409 5.070 30 20 EKED CC(C)C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 772960307 QZNUALSQBSEBQF-FQEVSTJZSA-N 342.870 5.119 30 20 EKED C[C@H]1CC(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C[C@H](C)C1 780311332 AOPLIFCSCZHACZ-CPUCHLNUSA-N 338.476 5.059 30 20 EKED CC(=NN(c1ccccc1)c1ccccc1)c1cnn(C(C)(C)C)c1C 787144748 MGIVTBSELQOZIL-UHFFFAOYSA-N 346.478 5.509 30 20 EKED CC(C)(C)c1cnc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)s1 790601173 QVHYFMICFIUNCJ-HJWRWDBZSA-N 348.471 5.399 30 20 EKED Cc1cc(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)oc1C 799897924 UDCRBTHKNZTKEN-FPLPWBNLSA-N 327.380 5.055 30 20 EKED CCCCCC1=C(C)CCC1=NNc1c(F)c(F)nc(F)c1F 916326710 LBKSJJAZKQWQJQ-UHFFFAOYSA-N 329.341 5.097 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)Cc2c(Cl)cccc21 921263926 LBMBXTXKEFUXIN-WDZFZDKYSA-N 343.860 5.347 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776699963 KYXMFWVPGBSKMQ-FBOQAHMBSA-N 348.851 5.509 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)o1 58452933 NQWVUJLJHMAJHI-VQHVLOKHSA-N 335.384 5.354 30 20 EKED CCN(Cc1nc(-c2ccccc2)oc1C)[C@H](C)c1ccc(C#N)cc1 60477341 MJVMPKJMTJUUII-MRXNPFEDSA-N 345.446 5.105 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1cccs1)c1ccccc1 160362589 GVDQCVWMDCYBQK-WBVHZDCISA-N 328.481 5.158 30 20 EKED Cc1ccc(-c2noc([C@H](C)SCCCC(C)(C)C#N)n2)cc1F 161440508 YYOBAWDCIJADBM-ZDUSSCGKSA-N 347.459 5.308 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H]1c1ccccc1 191432285 RGTLHWMQMYINIW-JTSKRJEESA-N 348.490 5.763 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCc2ccc(C#N)cc2)c1 237764977 WOZNISWPBOTSMT-UHFFFAOYSA-N 336.382 5.133 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)N[C@H]2CC[C@@H](CC#N)C2)cc1 296278916 DXXPAFPHOLYJFY-UWVAXJGDSA-N 334.463 5.095 30 20 EKED CC(C)Oc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 326570280 ASIMVVGAFAZMOT-QGZVFWFLSA-N 338.451 5.329 30 20 EKED Cc1cc(C(C)(C)C)cc(C)c1C[S@@](=O)CCCCC(C)(C)C#N 436105382 PPIKPJUUMYAXCF-DEOSSOPVSA-N 347.568 5.570 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 449444531 BNKAALYNLRMOHG-QXRTWZOPSA-N 336.401 5.013 30 20 EKED Cc1ccc(-c2noc(CCCC#N)n2)c(Sc2ccccc2)c1 463059312 ZZDYBNLIMCYXRR-UHFFFAOYSA-N 335.432 5.043 30 20 EKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nc(-c2cccs2)no1 465389318 RKATYLBJTJIUPN-VIFPVBQESA-N 347.852 5.176 30 20 EKED Cc1cccc([C@@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)c1C 476167595 SRIIYECMCYHHIQ-UNMCSNQZSA-N 346.474 5.055 30 20 EKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccc(C(F)(F)F)cc1 500544332 KYSFMBGYKGWRHT-SECBINFHSA-N 326.268 5.028 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)c(F)c1 517408592 VQKYMAMZRZAQBV-BLVKFPJESA-N 328.818 5.079 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(C#N)cc1F 520174217 ZBMFHOQGXCQDSN-LLVKDONJSA-N 337.225 5.197 30 20 EKED CCc1ccc([C@@H](C)CC(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1 523111256 IBFZWOABKBGRMD-ROUUACIJSA-N 348.490 5.224 30 20 EKED C=CCCOCCCCC(=O)N(C)c1ccc(-c2ccccc2)cc1 540500133 NDHHTSCURLWDDM-UHFFFAOYSA-N 337.463 5.079 30 20 EKED CC(C)(C1=CCCCC1)c1noc(C[C@H](CC#N)c2ccccc2)n1 577102307 RQLKAQVXSDHEJK-KRWDZBQOSA-N 335.451 5.088 30 20 EKED COc1cccc2c1CCC[C@H]2N[C@@H](CCCC#N)c1ccccc1 581205738 OULAMKCBJNZUSC-LEWJYISDSA-N 334.463 5.097 30 20 EKED CC(C)(C)c1ccccc1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594058638 LAOCWKZHRJQNOR-UHFFFAOYSA-N 347.462 5.057 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C 605884802 UJMNRJMKTVFJDT-MRXNPFEDSA-N 342.405 5.010 30 20 EKED N#CCCCCNC(=O)Nc1cccc(CSC2CCCCC2)c1 609750490 PEFYSWYOQQHWNX-UHFFFAOYSA-N 345.512 5.068 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 610089370 SYDWUMNCIJLZRX-INIZCTEOSA-N 346.861 5.729 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(C#N)c1 610317132 NCUKAUWKMQUECC-MRXNPFEDSA-N 349.478 5.688 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610361401 COXGFFSELGWBRU-IAGOWNOFSA-N 334.463 5.053 30 20 EKED Cc1cccc2sc(C(=O)N(C)c3ccccc3C#N)c(Cl)c12 611072021 WZHCCDCVVQJSBH-UHFFFAOYSA-N 340.835 5.011 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@@H]2CCc3cc(C#N)ccc32)o1 618743165 YTIPGJANKSKQEG-OAQYLSRUSA-N 346.405 5.043 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H]3CCc4cc(C#N)ccc43)oc12 618801427 AUZUJSXBBMVKMV-LIRRHRJNSA-N 346.430 5.041 30 20 EKED C=CCOc1cccc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)c1 620437315 GCQKISCJSYCIPR-AWEZNQCLSA-N 335.369 5.121 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2ccccc2COC(C)(C)CC)C1 666701599 CWBXLOZYMFTXTM-QGZVFWFLSA-N 344.499 5.212 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1C 747193099 FCCJIHKMKTXZMW-TUYSUELWSA-N 338.476 5.081 30 20 EKED C=CC[C@H](NC(=O)C/C=C\c1ccc(C(C)C)cc1)c1ccncc1 764242394 HCQHODBDYWTCHT-JKTFDMFLSA-N 334.463 5.042 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cnn(-c2ccccc2)c1)c1ccccc1 773076837 PDKVMXZNPCBNQZ-PGRDOPGGSA-N 331.463 5.230 30 20 EKED CCCCOc1ccc(/C=C\C(=O)c2cc(F)ccc2F)cc1OC 916134929 UESQCFZCYZQSDE-UITAMQMPSA-N 346.373 5.048 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C1CCC(F)(F)CC1 89422526 GVBQVHOFCYZWAH-UHFFFAOYSA-N 346.402 5.051 30 20 EKED N#CCC[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccc1 164278137 IFLZPWZEDGRJSE-MRXNPFEDSA-N 329.325 5.034 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2ccc3ccccc3c2)n1 177760107 VUMIZXPDOKBJFO-SFHVURJKSA-N 348.471 5.229 30 20 EKED Cc1ccc(-n2c(SCCCCC#N)nnc2-c2ccccc2)cc1 195561299 DBBDZQPFQRSKAA-UHFFFAOYSA-N 348.475 5.029 30 20 EKED CCOc1ccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)cc1OCC 303508208 SKCYDULLDDYIRB-CYBMUJFWSA-N 344.842 5.182 30 20 EKED N#CCCC[C@H](NC(=O)c1cc2ccccc2s1)c1ccccc1 352215334 CGGKJBJFEOFCMY-KRWDZBQOSA-N 334.444 5.066 30 20 EKED C[C@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 429463212 BELZSZICGJOPLJ-YJBOKZPZSA-N 349.434 5.003 30 20 EKED CC#CCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 464553617 UQSMTRXVSJWWJY-UHFFFAOYSA-N 348.471 5.463 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C1CCCC1 475582358 MUUFRYMUBOJRHS-HXUWFJFHSA-N 340.511 5.725 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1OCC1CC1 476159997 RTZVKLREFWJBLP-UHFFFAOYSA-N 349.474 5.580 30 20 EKED C=CCC1(C(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)CCC1 478969924 WLSBJCCBHDUFDG-AWEZNQCLSA-N 340.492 5.042 30 20 EKED C=CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 484259148 VSWYORUEFLUXDS-DLBZAZTESA-N 345.364 5.028 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccc(F)c(F)c1 502431823 PNVQEYGTPDZHPL-XOBRGWDASA-N 345.437 5.244 30 20 EKED CCC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 540424600 GAKKTVFNTGBZPD-FQEVSTJZSA-N 342.433 5.397 30 20 EKED CC(C)Oc1ccc([C@H]2CCC[C@@H]2NCC(C)(C)CCC#N)cc1 558247528 PVILYVJXARELEF-UXHICEINSA-N 328.500 5.029 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C2CC2)c1 579369411 BOUYNVKQBQJTNO-CQSZACIVSA-N 336.460 5.211 30 20 EKED C[C@@H](NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccc(C#N)cc1F 593721588 QIFABSIKJZUOKS-GFCCVEGCSA-N 348.343 5.056 30 20 EKED C[C@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1cccc(C#N)c1 600850207 QRLWKBNACSTSQF-INIZCTEOSA-N 346.405 5.449 30 20 EKED N#CCC1(COC(=O)c2sc3cc(Cl)ccc3c2Cl)CC1 744277598 VSCKSUGBMMLINM-UHFFFAOYSA-N 340.231 5.059 30 20 EKED N#C[C@@H](C(=O)CCC1CCC1)c1nc(-c2ccc(Cl)cc2)cs1 750688401 SMTJHAAOKWIIGB-HNNXBMFYSA-N 344.867 5.220 30 20 EKED CC(C)C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1cccs1 754297574 YFXLKZGYMHGOGQ-MRXNPFEDSA-N 348.899 5.181 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1O)c1ccncc1 756585067 WYNMVASCGDOQHU-ABAIWWIYSA-N 337.250 5.062 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccccc1C(F)(F)F 769733047 NBZXZMYWRXOHFE-KRWDZBQOSA-N 338.417 5.562 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1O 775522919 BRLHUEIJPUIUJR-QZTJIDSGSA-N 328.843 5.131 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)CCC2 776168230 ACNOLEMOVYQWFQ-SBUREZEXSA-N 348.490 5.441 30 20 EKED C#CCCCCCC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 781014713 RJPHIVRUKVTNFZ-IBGZPJMESA-N 349.474 5.066 30 20 EKED CC[C@H](C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 796800208 VWKWCWNLKXEZPG-BBRMVZONSA-N 326.465 5.121 30 20 EKED CC[C@@H](C)CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 796902979 HXFRKLQNEBTRNW-NEPJUHHUSA-N 348.418 5.091 30 20 EKED N#C[C@@H](C(=O)CCCc1ccccc1Cl)c1ccc2ccccc2n1 810522186 YIYAFAPOJCOMQX-QGZVFWFLSA-N 348.833 5.087 30 20 EKED CC(C)c1cccc(NCc2cc(C#N)ccc2Br)c1 863999415 SMJBGFCXUXAOFT-UHFFFAOYSA-N 329.241 5.056 30 20 EKED Cc1ccc(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)c(C)c1 189843219 AEKJNMRMVACHMQ-AWEZNQCLSA-N 335.432 5.078 30 20 EKED C[C@H]1CCC[C@H]1/N=C(/O)[C@H]1CC[C@H](/C(O)=N/[C@H]2CCC[C@H]2C)CC1 328785240 KKDDGPHGKSYPEG-DQQOZFGGSA-N 334.504 5.083 30 20 EKED N#CCC[C@H](NC(=O)c1ccc(C2=CCCC2)cc1)c1ccccc1 355344625 HTMJVKUPNILWKF-NRFANRHFSA-N 330.431 5.029 30 20 EKED C=CCCc1ccccc1NC(=O)c1sc(C)cc1OC(F)F 410365802 MFBUNQXAKAOSRA-UHFFFAOYSA-N 337.391 5.029 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnc(C)c(Cl)c1Cl 410368907 VDWHBKWIOYMJQJ-UHFFFAOYSA-N 335.234 5.068 30 20 EKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(C#N)c1 442776763 CMWJTOTUYKPSTO-MRXNPFEDSA-N 339.398 5.395 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)[C@@H](C)c1ccccc1C(F)(F)F 444677161 VWDFTLPUVHABST-CABCVRRESA-N 340.433 5.507 30 20 EKED C=CCC[C@H](C(=O)Nc1cnc(C(F)(F)F)cc1C)c1ccccc1 464661748 KTRBAYYSQAGTTR-HNNXBMFYSA-N 348.368 5.097 30 20 EKED N#Cc1cc(CNc2cccc(COC3CCCCC3)c2)ccc1F 467773168 REEZKFFWHASYBM-UHFFFAOYSA-N 338.426 5.159 30 20 EKED CC(C)CCC[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 523006382 AYVSZSJVUSSDJO-HOTGVXAUSA-N 347.528 5.275 30 20 EKED CN(Cc1cc(C#N)cs1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 539926801 DIDJDFUAPLPMGH-CQSZACIVSA-N 344.789 5.009 30 20 EKED C[C@H](NC(=O)Nc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 543861380 LZUPGZGBYLUHAX-INIZCTEOSA-N 341.414 5.108 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cncs1)c1ccc(C(F)(F)F)cc1 557274813 ZIWRYSPWQHVJJQ-IUODEOHRSA-N 340.414 5.520 30 20 EKED CC(C)(CCC#N)CNc1ncnc2scc(-c3ccccc3)c12 564061205 KHUFXATVWYVPEY-UHFFFAOYSA-N 336.464 5.100 30 20 EKED N#Cc1c(N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1C(F)F 572687361 YWEZMPRBYPCZTE-IAGOWNOFSA-N 348.780 5.091 30 20 EKED Cc1c(Cl)cc(NC(=O)c2cc(C#N)ccc2Cl)cc1Cl 583586978 QTQXBBZNLHIDFW-UHFFFAOYSA-N 339.609 5.079 30 20 EKED CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1cccc(CC#N)c1 608952884 LXJHSGJBGYINBE-JOCHJYFZSA-N 348.490 5.016 30 20 EKED CCCOc1ccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)cc1OC 609503888 DHXIPPUYALNSSI-CYBMUJFWSA-N 344.842 5.182 30 20 EKED C[C@@H](N[C@@H]1CCCc2c1sc1ccccc21)c1cccc(C#N)c1 610829624 BPHSGIQGRZYMTA-AUUYWEPGSA-N 332.472 5.501 30 20 EKED C=CCN(Cc1csc(-c2cccs2)n1)Cc1ccccc1F 615353676 MGLFWFYKEOUIGL-UHFFFAOYSA-N 344.480 5.199 30 20 EKED C#Cc1cccc(NC(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)c1 726444424 KSGCOWMSNOCQKF-NSHDSACASA-N 349.286 5.022 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1Cl 727628000 FRINMFGFCPVEIQ-AINHQSCGSA-N 346.817 5.168 30 20 EKED COc1cccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)c1 727780034 FMJRNTKMADDOGL-QXMHVHEDSA-N 335.428 5.023 30 20 EKED Cc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733621018 GPKDEDAAWZELHJ-HXUWFJFHSA-N 341.414 5.295 30 20 EKED C[C@H](CC#N)OC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 733708939 FHJBJASMNNASLS-SECBINFHSA-N 340.231 5.181 30 20 EKED C#CCCCCCC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 779821178 VBLXSROYMPAKRZ-CYBMUJFWSA-N 326.267 5.097 30 20 EKED O=C(/C=C/c1cocn1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 790216351 WZUNDVVHUCYGPL-AATRIKPKSA-N 349.333 5.318 30 20 EKED C=CCC[C@H](Nc1ccc(O[C@H]2CCCC[C@@H]2O)cc1)c1ccco1 796895326 BSVGOJFUZBCDIC-ZJOUEHCJSA-N 341.451 5.081 30 20 EKED Clc1cccc(Cl)c1C=NNc1ccccc1Br 812462095 HTZGQNSHUKPFDJ-UHFFFAOYSA-N 344.039 5.202 30 20 EKED CCc1ccc(N(C(=O)c2ccc(C(C)(C)C#N)cc2)C(C)C)cc1 813260868 UGASWLNFWYQLBV-UHFFFAOYSA-N 334.463 5.105 30 20 EKED O=C(/C=C/c1ccc(-n2cccn2)cc1)c1ccc(Cl)cc1Cl 884003390 PPVYLRBXBJLROL-RUDMXATFSA-N 343.213 5.075 30 20 EKED CC(=NNc1cccc(Cl)c1C)c1[nH]c(-c2ccccc2)nc1C 915111567 KCJONBFCXULIEX-UHFFFAOYSA-N 338.842 5.183 30 20 EKED CCCCCCC[C@@H](C)CNC(=O)Nc1cc(NC(C)=O)ccc1C 918035301 PXMIVPSHMUNWHW-OAHLLOKOSA-N 347.503 5.072 30 20 EKED CCCCCCCOc1cccc(CN[C@H](C)CCCCC(=O)O)c1 1776787939 IKUXRQQYXPRIJL-GOSISDBHSA-N 349.515 5.159 30 20 EKED COc1ccc(CNc2ccccc2C(C)C)cc1OCCCC#N 157765142 CQORAENASIMHPU-UHFFFAOYSA-N 338.451 5.113 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(Oc2ccccn2)c1 438659682 GIDVBJCKKDNBKY-UHFFFAOYSA-N 339.439 5.084 30 20 EKED N#Cc1ccc(COc2ccc(Oc3nccs3)cc2)c(Cl)c1 438908485 GMUPZLIGHRURCB-UHFFFAOYSA-N 342.807 5.039 30 20 EKED CC(C)C[C@@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458794597 BHWBPPPLFAJFHM-VQTJNVASSA-N 341.499 5.032 30 20 EKED CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1SC[C@H](C)C#N 475759902 CNLWWGUUFVKGIH-BZUAXINKSA-N 330.497 5.093 30 20 EKED C=CC[C@H](C(=O)Nc1cnn(CCCC)c1C(C)C)c1ccccc1 482728789 QDJKJIORHUKSTN-SFHVURJKSA-N 339.483 5.105 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(C#N)cc1 520153812 YFACAMLBGTUISX-NSHDSACASA-N 348.233 5.090 30 20 EKED N#CCc1ccc(CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)cc1 576279469 XDTOQHJASCDKJL-OAQYLSRUSA-N 346.474 5.069 30 20 EKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)CCCCCC#N)c2)C1 588154670 AYPAJJLVTRINDY-PXNSSMCTSA-N 342.483 5.194 30 20 EKED CCC[C@@H](NC(=O)CCCCCC#N)c1cccc(C(F)(F)F)c1 588341094 XYESHUMFVKFBLM-MRXNPFEDSA-N 340.389 5.137 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccccc3F)n2)cc1 609102524 WYCQNFBQRRQPJV-UHFFFAOYSA-N 326.421 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2cc(F)ccc21 613901112 NZKVKKLBAHRRJD-HXUWFJFHSA-N 337.438 5.346 30 20 EKED CC(=NNc1ccc(Cl)nc1)c1csc(-c2csc(C)n2)c1 743449691 DUWFYSFSTVMFPK-UHFFFAOYSA-N 348.884 5.065 30 20 EKED CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745989847 CPFGFWRPTQNCHS-WDZFZDKYSA-N 329.399 5.043 30 20 EKED Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)OCCCCC#N 747661366 SIBCCNGCFNWWDE-UHFFFAOYSA-N 344.414 5.061 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)cc(Cl)c2)cc1 755705977 QEGCPENISZSSQE-DJFZKKHWSA-N 346.213 5.180 30 20 EKED Cc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(O)c1 756787327 PSZYXWFOZOMUHF-QGZVFWFLSA-N 342.442 5.090 30 20 EKED C=CC[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccncc1 766017786 DDLANPHBNWMRSH-YJBOKZPZSA-N 335.476 5.173 30 20 EKED C=CC[C@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccncc1 766018763 IUTNWAAQLPOLAT-DLBZAZTESA-N 333.262 5.283 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1cc(Cl)sc1Cl 782312918 LXCQJVJOASXMLN-DUXPYHPUSA-N 334.227 5.499 30 20 EKED CC(C)C[C@@H](C)N(C(=O)CCCCC#N)c1ccc2[nH]ccc2c1 846850112 VKJVRWJANVQMCC-MRXNPFEDSA-N 325.456 5.019 30 20 EKED CCCCCCCCCC(=O)Nc1cc(NC(C)=O)c(F)cc1F 921158140 QJXPNRJTSBOTLR-UHFFFAOYSA-N 340.414 5.002 30 20 EKED Cc1cccc([C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 151866440 VLNIWYHEKCNTNH-JKSUJKDBSA-N 338.476 5.132 30 20 EKED CCCOc1ccc(Cl)cc1N[C@@H](C)c1ccc(OCC#N)cc1 324273558 ZALPEHOMQBKEMS-AWEZNQCLSA-N 344.842 5.204 30 20 EKED N#CCCC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 431510932 JCVILIZHUOFCHK-MRXNPFEDSA-N 329.787 5.095 30 20 EKED C=CCCCSCc1ncc(-c2ccccc2Br)o1 437273783 YSUXTZVHFADBQR-UHFFFAOYSA-N 338.270 5.304 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1ncc(-c2ccccc2)o1 471412242 PZZBWFWQJNWEOT-CABCVRRESA-N 334.444 5.769 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1ccccc1Cl)c1ccc(F)c(F)c1 479772668 PTFLJNYIIYLGNH-MRXNPFEDSA-N 336.769 5.057 30 20 EKED CC1CCC(N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 481916938 FRPGTVDQDCHPFK-UHFFFAOYSA-N 348.446 5.001 30 20 EKED CCCC[C@@H](CC)CC(=O)Nc1ccccc1SC[C@H](C)C#N 524210467 DBYOSFABRIDQCU-HZPDHXFCSA-N 332.513 5.483 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(OC2CCCC2)c1 557522938 GYWWDUXWOAYURE-HSZRJFAPSA-N 346.474 5.047 30 20 EKED CC(C)c1ccc(C2(C(=O)NCC(C)(C)CCC#N)CCCC2)cc1 557922111 FHVGCWLSXRMYFS-UHFFFAOYSA-N 340.511 5.068 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(-c2ccncc2)c(C)c1)c1ccccc1 561089200 JTABSJHOHHOWSQ-SFHVURJKSA-N 342.442 5.355 30 20 EKED N#C[C@@H](Cc1ccccc1)N[C@H](CCc1ccccc1)c1ccccc1 603955318 QKWHUDNCRNOIQB-DNQXCXABSA-N 340.470 5.085 30 20 EKED C[C@@H](SCc1ncc(-c2ccc(F)cc2)o1)c1ccc(C#N)cc1 609825813 VAXWJXVUFBWZEC-CYBMUJFWSA-N 338.407 5.347 30 20 EKED CC(C)(C)OCc1cccc(CNc2cc(Cl)ccc2C#N)c1 609892391 CNGJUJCAPINLEO-UHFFFAOYSA-N 328.843 5.139 30 20 EKED C[C@H]1CCC[C@H](C)N(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 610184754 HVEMZRAHUZAXCY-IRXDYDNUSA-N 348.446 5.001 30 20 EKED FC(F)Oc1ccc(NN=C(CC(F)(F)F)c2ccccc2)cc1 726427118 QOYFBCILUGUJRY-UHFFFAOYSA-N 344.283 5.057 30 20 EKED CSc1ccc(C(=O)/C=C/c2c[nH]nc2-c2cccc(C)c2)cc1 728785897 PCKHSADNQJEWCM-DHZHZOJOSA-N 334.444 5.003 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C\c3ccsc3)c2)cc1 729375315 DNWHWIUGNNQXOU-TWGQIWQCSA-N 346.411 5.064 30 20 EKED COCc1cccc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)c1 742431120 DFVHRTSXQMXEKC-ALCCZGGFSA-N 326.779 5.129 30 20 EKED O=C(/C=C/c1nc(Cl)cs1)c1cc2c(ccc3ccccc32)o1 759073965 AEZMTDHWUABBSA-SOFGYWHQSA-N 339.803 5.592 30 20 EKED C[C@H](CC(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 773981704 CITGJAQCOLPONZ-UKRRQHHQSA-N 326.465 5.059 30 20 EKED O=C1/C(=C/c2coc(-c3ccccc3)n2)CCc2[nH]c3ccccc3c21 781551986 POWRIWQQGCCONR-NTCAYCPXSA-N 340.382 5.035 30 20 EKED CCCC[C@@](C)(F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 850770897 DKXYXLCOEVABIR-MEDUHNTESA-N 338.835 5.044 30 20 EKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(CCC#N)cc2)cc1 932576293 PUHXHGPANCZICT-NRFANRHFSA-N 347.462 5.210 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1cc(C(=O)O)ccc1Cl 1776786064 IBYBFXAFOIPDHV-CYBMUJFWSA-N 339.863 5.363 30 20 EKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 177773291 VIWSIDUQEATVKY-HNNXBMFYSA-N 344.505 5.257 30 20 EKED C[C@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccc(OCC#N)cc1 182006002 BNJAYKAVBKKEPN-KKSFZXQISA-N 334.463 5.052 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1ccc(-c2ccncc2)cc1 187438170 RVQOHDYDBSDHTF-HNNXBMFYSA-N 347.849 5.124 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(F)cc1F 214020506 KWENEKVDTRVOLO-RQOWECAXSA-N 333.384 5.046 30 20 EKED CN(CCC#N)c1ccc(CN[C@H](c2ccccc2)C2CCCC2)cc1 237207840 WYIQQUGVGIPBCP-HSZRJFAPSA-N 347.506 5.058 30 20 EKED N#Cc1ccc(NCc2ccc(-c3nc4ccccc4s3)o2)c(F)c1 326958389 LMNSYHODVMOUJH-UHFFFAOYSA-N 349.390 5.179 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(F)c1 439558890 YSLGQVZSGNTOJU-MRXNPFEDSA-N 346.405 5.449 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1[C@@H]2CCCC[C@@H]12 468055632 APRKCGMTDPIZLG-RTBURBONSA-N 346.430 5.034 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(N2CCCC2)cc1C)c1ccccc1 487546372 YZWCYJOFKGNBOI-NRFANRHFSA-N 348.490 5.284 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 490200972 JSNWTWRWRQICRD-CYBMUJFWSA-N 335.781 5.576 30 20 EKED C[C@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1ccc(C#N)cc1 537296010 QJEGMFWKNYMPDT-JKSUJKDBSA-N 340.426 5.869 30 20 EKED N#CCCC[C@H](N[C@@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 559864143 NPZUVFDVPDWEDJ-RBBKRZOGSA-N 343.474 5.570 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccncc2s1 595039302 QXUOSRBKEGVEDN-YJBOKZPZSA-N 335.476 5.382 30 20 EKED C=CCN(Cc1cccs1)C(=O)CCc1ccc(C(C)C)cc1 611782383 YXAFBHSBSNBKOK-UHFFFAOYSA-N 327.493 5.019 30 20 EKED C=CCn1c(S[C@@H](C)c2c(C)cc(C)cc2C)nnc1C1CC1 620258991 MQBTYLKKEMREMZ-HNNXBMFYSA-N 327.497 5.120 30 20 EKED COc1ccc(CN[C@@H](c2oc3ccccc3c2C)C(C)C)cc1C#N 742370650 GWFDXDWBNGZHCN-OAQYLSRUSA-N 348.446 5.108 30 20 EKED COCc1cccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)c1 742435382 WTEAIGIRORMKAZ-KPKJPENVSA-N 326.461 5.230 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)(C)C 744036089 XFJUTPAXIDMHPV-HFQYIWAZSA-N 338.476 5.287 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1cccc(-c2ccncc2)c1 760262667 DBJDGODLYTTZNN-FPLPWBNLSA-N 346.455 5.369 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(OC)c2ccccc12)c1ccncc1 766022563 XDJPHWHFJGPXFC-IIBYNOLFSA-N 332.447 5.211 30 20 EKED N#Cc1cccc(C2(NCc3ccc4oc5ccccc5c4c3)CC2)c1 775431243 MTOXHKNSKXEUCL-UHFFFAOYSA-N 338.410 5.237 30 20 EKED C#CC[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccccc1 782473399 UGLDLQIWPCSPAV-QFIPXVFZSA-N 340.426 5.299 30 20 EKED CC(C)(CC(=O)Nc1ccc(F)cc1C(F)(F)F)CC(F)(F)F 888783332 OLYWIZMSBRETAF-UHFFFAOYSA-N 345.258 5.152 30 20 EKED Clc1ccc(C=NOCc2cc(Cl)cc3cccnc23)cc1 914786739 ONMMMNMZHXRGMO-UHFFFAOYSA-N 331.202 5.092 30 20 EKED CC(=NNc1nccc2sccc12)c1cc(Cl)ccc1Cl 915980697 ZRQGYEPMBKBDCZ-UHFFFAOYSA-N 336.247 5.439 30 20 EKED N#Cc1c(Cl)nsc1NCc1cccc(Oc2ccccc2)c1 917065889 WVSIAUBGWAYARO-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)[C@@H](C)Cc1ccccc1 1776034773 YAHRZYQOBQVRDL-ZDUSSCGKSA-N 344.842 5.095 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Br)cc1 36991678 GMXWBLLOLOSAKX-SCLBCKFNSA-N 343.268 5.123 30 20 EKED N#Cc1ccccc1Oc1nc(C2CC2)nc2sc3c(c12)CCCC3 60217782 ARSPIINHLRDIFF-UHFFFAOYSA-N 347.443 5.111 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc(F)cc1F 255736993 VGRSZJQWFXMNSA-XQRVVYSFSA-N 333.384 5.046 30 20 EKED OC(CC1CCC(C(F)(F)F)CC1)=Nc1cccc2ocnc12 328885305 OHEQLFFTIQTZBA-UHFFFAOYSA-N 326.318 5.175 30 20 EKED CC[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1 329993097 LAQBPCIZBFAWCD-ABHNRTSZSA-N 328.456 5.020 30 20 EKED N#CCCC[C@@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 340444330 DAKISKHSKPKGKI-RTWAWAEBSA-N 346.474 5.458 30 20 EKED Cc1cc2occ(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2cc1C 352180153 IWKWKNRZHNUUCP-FQEVSTJZSA-N 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N#Cc1cccc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c1 30619046 HXIXYVGCGSJZAY-UHFFFAOYSA-N 347.226 5.332 30 20 EKED Cc1ccc(NC(=O)C(C)C)cc1NCc1ccccc1C(C)(C)C#N 131535993 PDUXGIRYGLGARJ-UHFFFAOYSA-N 349.478 5.003 30 20 EKED C=CCC(CC=C)C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 163647637 RRUAYRFGSMLOLY-UHFFFAOYSA-N 346.474 5.008 30 20 EKED N#CCC[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1 164292970 ITOQNJHIFSZNSL-QGZVFWFLSA-N 329.325 5.034 30 20 EKED Cc1ccccc1-c1cccc(CN[C@H](C)c2cccc(C#N)c2)c1 237463902 HYUJQTYCKOOUQX-GOSISDBHSA-N 326.443 5.385 30 20 EKED O/C(CCc1cc2ccccc2o1)=N/[C@H]1CCOC2(CCCCC2)C1 330202762 ZSKBHUDFQSIQEF-KRWDZBQOSA-N 341.451 5.204 30 20 EKED C[C@H](CC1CCCCC1)/N=C(/O)Nc1ccc(C(C)(C)C(=N)O)cc1 331145094 NGYNEQHGNMIOIT-CQSZACIVSA-N 345.487 5.184 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccc1 340445179 LSTZDBAOFJJRJW-DHIUTWEWSA-N 343.474 5.351 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cc2[nH]ccc2cc1C)c1ccccc1 444970874 VWOALGUWLAQVPO-GOSISDBHSA-N 333.435 5.305 30 20 EKED CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458801126 MQPBXROWWLYROB-MISYRCLQSA-N 341.499 5.032 30 20 EKED N#Cc1ccc(NCc2nc(-c3cc4ccccc4o3)cs2)cc1 475737987 GKSQVXJVSNQRGI-UHFFFAOYSA-N 331.400 5.040 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 480670819 MFPQXTGTWOYCGT-YJYMSZOUSA-N 346.377 5.149 30 20 EKED CC(C)C[C@H](Nc1ncccc1C#N)c1cccc(C(F)(F)F)c1 498942551 VNRDDKNHQBYRSF-INIZCTEOSA-N 333.357 5.171 30 20 EKED Cc1ccc(C(C)(C)CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 499434687 GDTSKGJCRBAGTH-UHFFFAOYSA-N 334.463 5.103 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)NC2(c3ccccc3)CCCC2)cc1 506724574 MBNGTPQDDJEASY-UHFFFAOYSA-N 347.462 5.079 30 20 EKED CCCCS[C@H](C)C(=O)Nc1sc(-c2ccccc2)cc1C#N 511451007 VGQZYYHZGIBLGD-CYBMUJFWSA-N 344.505 5.147 30 20 EKED N#CCC[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 611337033 FSOFYIBJYMLGFX-QZTJIDSGSA-N 345.273 5.615 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2cscc2Cl)cc1 611346563 QLTRJFJPUBZGIZ-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc3ccccc3c2)c1 727283950 UXTZMBQCSWRIGT-UHFFFAOYSA-N 348.471 5.604 30 20 EKED O=C1/C(=C/c2nc(-c3ccccc3)cs2)Cc2c(Cl)cccc21 727975176 QSZMQECJRLXGLR-JLHYYAGUSA-N 337.831 5.286 30 20 EKED CC(C)(C=NNc1nc2cc(C(F)(F)F)ccc2s1)CCC#N 755748466 BGDMBGBMSJQXQU-UHFFFAOYSA-N 340.374 5.043 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1O)c1ccncc1 756585074 WYNMVASCGDOQHU-NHYWBVRUSA-N 337.250 5.062 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1cc(Cl)ccc1Cl 779713399 SHSCLHDJOYNVTA-NEPJUHHUSA-N 335.234 5.457 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](F)CC1CCCCC1 793460019 GGNVDZMRBCJBAF-GOEBONIOSA-N 348.487 5.185 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)cc(Cl)c1O 806133168 IMIJCWWZUPRTCO-DIFFPNOSSA-N 349.261 5.373 30 20 EKED C[C@H](c1cccs1)N(C)C(=O)Nc1scc(C(C)(C)C)c1C#N 821488249 KFFDTZLEBJGBHE-LLVKDONJSA-N 347.509 5.204 30 20 EKED CCCCCCCC(=O)NCc1ccc(-c2csc(C)n2)s1 827097846 ACMVWVBDPGCYNC-UHFFFAOYSA-N 336.526 5.157 30 20 EKED CC(C)[C@H](N[C@@H](C)c1cc(C#N)ccn1)c1ccc(C(F)(F)F)cc1 902884333 FIOOHUMWKZJYES-UGSOOPFHSA-N 347.384 5.020 30 20 EKED N#CCCCCOC(=O)/C=C\c1ccc(-c2ccccc2Cl)s1 914622788 SZODQPNPNHAFFO-LUAWRHEFSA-N 345.851 5.319 30 20 EKED C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352219 IWIYRNBDBIJFNF-HBGVWJBISA-N 347.462 5.042 30 20 EKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1cccc2ccccc12 915981215 LDMLRZDHNRRWPC-QXMHVHEDSA-N 342.423 5.254 30 20 EKED C=CCc1ccccc1/C=C(\CC(=O)O)c1nc2ccccc2s1 1776187745 PKMRFTKRYHUUOG-FOWTUZBSSA-N 335.428 5.040 30 20 EKED O=C(/C=C/c1cnn(-c2ccccc2)c1)c1cc(Cl)sc1Cl 18065595 TXPLKTJUAJAVQV-VOTSOKGWSA-N 349.242 5.137 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1 89763747 BUBCCKQASHSPGD-LBPRGKRZSA-N 337.316 5.143 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1)c1ccccc1 125777985 HKYWUSYMQDSSSI-XMSQKQJNSA-N 349.474 5.109 30 20 EKED C=CCC[C@H](NCc1coc(-c2ccc(OC)cc2)n1)c1ccccc1 180043536 IXOKPJWOKSBPJW-NRFANRHFSA-N 348.446 5.147 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 181886965 CORRUVKUGVDCPC-ZHRRBRCNSA-N 330.406 5.138 30 20 EKED C[C@H]1C[C@@H](C(O)=Nc2ccc(OC3CCCC3)c(Cl)c2)CCC1=O 328905571 AWIXTEPUYYDXPG-STQMWFEESA-N 349.858 5.255 30 20 EKED CCCCN(CCCC1(C#N)CCOCC1)[C@H](CC)c1ccccc1 410372022 MVIQGOYBJDPGGY-OAQYLSRUSA-N 342.527 5.340 30 20 EKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474695485 CPUNBUPXLCPSHG-AEFFLSMTSA-N 346.430 5.040 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1c(Br)cccc1SCC 484886842 RKONQSUPIYSQCY-NSHDSACASA-N 342.302 5.102 30 20 EKED COc1cc(CN[C@@H](C)c2ccc(-c3cccs3)cc2)ccc1C#N 516516485 FIGMEZHFMYWADU-HNNXBMFYSA-N 348.471 5.146 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)c(F)c1 517408594 VQKYMAMZRZAQBV-CWTRNNRKSA-N 328.818 5.079 30 20 EKED C[C@H](N[C@H](COc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 539510962 QPVWTZRWXWBZFW-FDDCHVKYSA-N 342.442 5.029 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CCCCC#N)cc1 593989910 YKWLLDQWJYXDBZ-MRXNPFEDSA-N 338.476 5.562 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)CC1(C#N)CCCCC1 597551611 FXPLQHPKZPETIU-UHFFFAOYSA-N 326.484 5.565 30 20 EKED CC[C@](C)(C#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732658222 FQFDDTPVZVNCBL-QGZVFWFLSA-N 334.872 5.100 30 20 EKED C=CC[C@@H](NCc1ccc(-c2ccccc2OC)cc1)c1ccncc1 742371209 KEVHMOOAQZHSQI-JOCHJYFZSA-N 344.458 5.164 30 20 EKED C=C(C)[C@@H](NC(=S)Nc1ccc(C)cc1C)c1ccc(F)c(F)c1 774206911 PRGDZMRZUMAXPP-GOSISDBHSA-N 346.446 5.185 30 20 EKED CC(C)(C)CCC(=NNc1cccc2cnccc12)c1cscn1 807970426 JGRHPGQZKUGAMJ-UHFFFAOYSA-N 338.480 5.334 30 20 EKED C=CC[C@@H](OC(=O)[C@@](C)(C#N)CC)c1ccc(Cl)c(Cl)c1 808795842 UOUBOGIVSYRMSX-GDBMZVCRSA-N 326.223 5.094 30 20 EKED N#C[C@H](C(=O)CCCc1ccccc1Cl)c1nccc2ccccc12 810717359 VBXHUWZZYQCZNU-GOSISDBHSA-N 348.833 5.087 30 20 EKED CCCC[C@H](CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915180652 QPIGQZNHETZUPN-LAUBAEHRSA-N 334.463 5.497 30 20 EKED CCOc1cc(/C=C/C(=O)c2cccc3ccccc23)ccc1OC 916134830 JAAKIOIJQACJAT-ACCUITESSA-N 332.399 5.143 30 20 EKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cc1 214464490 LJENTZINEWOWPR-SXGWCWSVSA-N 341.410 5.208 30 20 EKED C[C@@H]1C[C@H](/C(O)=N/[C@@H](CC2CCCC2)c2ccccc2)CC(O)=N1 329675761 PFBGUKLFZXTVNL-JLSDUUJJSA-N 328.456 5.020 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1nc2c(s1)CCCC2 340449427 VDUBXDXNBFCAND-RDJZCZTQSA-N 339.508 5.108 30 20 EKED C[C@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 439678891 RQBJWOZJUXVMFY-JTSKRJEESA-N 342.442 5.105 30 20 EKED C[C@H](SCc1ccc(Oc2ccccc2)nn1)c1ccc(C#N)cc1 498416683 FAQRMQOALUPXIJ-HNNXBMFYSA-N 347.443 5.135 30 20 EKED Cc1c(C(=O)N(CCC#N)CC(C)(C)C)oc2c1ccc1ccccc12 517832923 PBLOBNPEGYWIKV-UHFFFAOYSA-N 348.446 5.296 30 20 EKED Cc1ccccc1[C@H](C)N(CCCC1(C#N)CCOCC1)CC(C)C 551716617 YMTLZKVYZJZISL-FQEVSTJZSA-N 342.527 5.115 30 20 EKED N#CCCCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 588299862 NCPSEYSXJCDNFW-MRXNPFEDSA-N 339.266 5.131 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc2nc(C3CC3)oc2c1 611476091 ZHYVQHIYVHRLOX-GOSISDBHSA-N 329.403 5.066 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 739155480 IFYDPKADBKRGRL-MAUKXSAKSA-N 346.430 5.321 30 20 EKED C#Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 746658660 GDDJPSHKLKQKIL-LBPRGKRZSA-N 347.245 5.200 30 20 EKED N#Cc1cccc(COc2cccc(/C=C/C(=O)c3ccsc3)c2)c1 749103845 DDBOCGWMRCENPK-BQYQJAHWSA-N 345.423 5.095 30 20 EKED O=C(/C=C\c1cc2ccccc2o1)c1ccc(Br)s1 750901563 UHJBEHJJZCKQNH-WAYWQWQTSA-N 333.206 5.153 30 20 EKED CC(C)(C)[C@@H](NCc1ccc(OCC#N)cc1)c1cc2ccccc2o1 779409279 JYTQJQOLZRADPE-NRFANRHFSA-N 348.446 5.212 30 20 EKED COc1cc(NN=C(C)c2sc(C(C)C)nc2C)ccc1Cl 788467220 GHCRWPNTJWINRK-UHFFFAOYSA-N 337.876 5.073 30 20 EKED CC[C@H](C(=O)OCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 798877223 QJXUIDOKEPXYPM-HNNXBMFYSA-N 341.373 5.072 30 20 EKED COc1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)ccc1C#N 823045146 SJDFJPHIAVPWSQ-UHFFFAOYSA-N 336.435 5.066 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccoc1)C1CC1 931060556 VQDRUWZLBVFZSX-UHFFFAOYSA-N 338.451 5.328 30 20 EKED CC(=NNc1ccccc1C(=O)O)[C@H](C)c1cc2ccccc2s1 1776031787 XMCTVKPEVWSNKA-LBPRGKRZSA-N 338.432 5.191 30 20 EKED CCCCCCC[C@H](C)CNc1ncnc2sc(C(=O)O)c(C)c12 1776782354 KYRVIKRVRQZOTR-LBPRGKRZSA-N 349.500 5.106 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1nccc2ccccc12 188069230 POBNYHAMBQAJTB-UHFFFAOYSA-N 330.431 5.339 30 20 EKED N#CCCCOc1cccc(/C=C\c2nc3cc(Cl)ccc3o2)c1 207619753 XFUJUFHKNCFDRU-TWGQIWQCSA-N 338.794 5.334 30 20 EKED CCc1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 217184603 MCONYJUPUGDLFZ-AWEZNQCLSA-N 339.464 5.287 30 20 EKED Cc1ccccc1[C@H](NCc1cccc(OCCCC#N)c1)C(C)C 236740351 IUIJUPIRXINWQP-JOCHJYFZSA-N 336.479 5.165 30 20 EKED CCc1ccc2occ(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2c1 352174222 LTAAHOAPTOYGLF-FQEVSTJZSA-N 346.430 5.160 30 20 EKED N#CC1(CSc2nnc(-c3ccccc3)c3ccccc23)CCC1 450678350 HYVIGWAMZDMIPK-UHFFFAOYSA-N 331.444 5.083 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC(F)(F)CC1 475551236 XJPITTBZCLDWAB-UHFFFAOYSA-N 336.426 5.238 30 20 EKED CSc1cccc([C@@H](NCCCCC#N)c2cc(F)ccc2F)c1 491010616 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EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 439438856 DTIBMDUFHLDAIC-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@@H](C)CC1 443597054 YRTFTLQIIZABGI-OWCLPIDISA-N 345.512 5.171 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCCCCC(C)(C)C#N 444673058 MGAHIROZKDQYOB-OAHLLOKOSA-N 341.524 5.489 30 20 EKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 445616607 QZXDEBJSKLVVAS-KXBFYZLASA-N 335.513 5.053 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c(C)c1 460080186 VJQVMQCDUALDMD-YWZLYKJASA-N 342.508 5.298 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC12CCCCC2 475552495 ZHGXGAONHVCJBP-UHFFFAOYSA-N 340.511 5.869 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(C(C)=O)c(Cl)c1 485523992 WQHYUGBYFWKEJH-UHFFFAOYSA-N 345.851 5.073 30 20 EKED CC1(C)CCCC[C@H]1CC(=O)N[C@H](CCCC#N)c1ccccc1 487498520 FMKRWFVDKLSHME-RBUKOAKNSA-N 326.484 5.144 30 20 EKED C[C@@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1F 512636144 JWMPFLDLLJHMNZ-GFCCVEGCSA-N 342.464 5.261 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)c1sc2ccc(C#N)cc2c1C 517722751 PMXGGWKHURTLSN-UHFFFAOYSA-N 348.471 5.766 30 20 EKED N#Cc1ccccc1CN[C@@H](c1ccccc1)c1ccc2ccccc2c1 521884444 SNEMRUOEDMNEIL-VWLOTQADSA-N 348.449 5.591 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CCC(C)(C)C 542551728 UYDJUEYRMBIAHQ-HUUCEWRRSA-N 332.513 5.482 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@H]2N[C@H](CCCC#N)c1ccccc1 572065015 MMCRLBHSCFDHPO-FGZHOGPDSA-N 348.490 5.442 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1Cl 572581813 YRSKOEZUVOUUNN-CABCVRRESA-N 342.870 5.411 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C2CC2)c1 579369410 BOUYNVKQBQJTNO-AWEZNQCLSA-N 336.460 5.211 30 20 EKED Cc1cccc2cc(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)oc12 609415138 ZOLSAUNZYHUHGO-SFHVURJKSA-N 346.430 5.033 30 20 EKED C[C@@H](Oc1ccccc1NCc1ccc(C#N)cc1)c1ccccc1 609671255 WOJSZIUCKIPQAQ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED N#Cc1cc(Cl)ccc1SCc1csc(-c2ccco2)n1 610655065 OSQMUFVHFHQFLO-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(COC(C)(C)C)cc1)c1ccccc1 681664796 ZWCLHRDDKZLPFG-HXUWFJFHSA-N 337.463 5.300 30 20 EKED Cc1c(C(=O)/C=C\c2cccc(OCCCC#N)c2)oc2ccccc12 726743626 NNGFWHOONLLOHI-QXMHVHEDSA-N 345.398 5.320 30 20 EKED C#Cc1cccc(N(C(=O)c2ccc(Cl)c(Cl)c2)C(C)C)c1 728248182 NYEZDTGXIYYNSG-UHFFFAOYSA-N 332.230 5.030 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2scnc2C)o1 734305823 GAIGFRRUQGWOPA-DAXSKMNVSA-N 327.380 5.055 30 20 EKED Clc1cccc(-c2ccc(C=NOCc3cccnc3)s2)c1 746587452 CEXGZKONGRQOGJ-UHFFFAOYSA-N 328.824 5.014 30 20 EKED C=CCCC[C@H](C)NC(=O)c1ccc(C2SCCCS2)cc1 775924705 CMJXDJGDNBOOQL-AWEZNQCLSA-N 335.538 5.030 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nccc2ccccc12 792099397 IAUQQQPHVDUKTL-UYAOXDASSA-N 334.463 5.408 30 20 EKED C=CC[C@@H](OC(=O)CC(C)(C)C#N)c1ccc(Cl)c(Cl)c1 797553779 KQEJPUJKXURFGI-CQSZACIVSA-N 326.223 5.094 30 20 EKED CC(/C=C/C(=O)c1c(F)cccc1Cl)=C\c1cccc([N+](=O)[O-])c1 809158797 DNSNMGJMCDAQRI-CDKJVOIVSA-N 345.757 5.230 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813218060 SAYGBYMPFDSMFN-MLGOLLRUSA-N 346.352 5.104 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815635855 KFBMQKXVLZJMRI-KDOFPFPSSA-N 328.843 5.131 30 20 EKED CSc1ccc(C(=O)/C=C\c2c[nH]nc2-c2ccc(C)cc2)cc1 920063948 MOSKLWUAJBWWTM-XFXZXTDPSA-N 334.444 5.003 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(F)cc2)ccc1SC(F)F 63874770 OKXNGTCUKNWYNU-XBXARRHUSA-N 338.350 5.045 30 20 EKED O=C(/C=C\c1cc(Br)cs1)c1cc2ccccc2o1 96767013 VBKLTZBIHDUHIY-WAYWQWQTSA-N 333.206 5.153 30 20 EKED Cc1cc(Cl)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 121318411 NFSYPQYUCWUQDN-CYBMUJFWSA-N 344.867 5.295 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(F)c(F)c1 189871041 WKVVHDANVWNDDU-UHFFFAOYSA-N 333.353 5.208 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(C(F)(F)F)cc1 208116328 NYDIFPFFEVBPFY-WMZJFQQLSA-N 327.305 5.150 30 20 EKED CC1(C)CCC(/N=C(/O)[C@@H]2CCSc3ccccc32)(C(=N)O)CC1 328893969 VHWRJDTVNSDANO-CQSZACIVSA-N 346.496 5.097 30 20 EKED CC#CCCCC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 464572168 UTQWOGUYPMFMER-QGZVFWFLSA-N 325.477 5.032 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C(C)C)c(Cl)c2)n1 467269317 RAOBWQJWFYVVCE-AWEZNQCLSA-N 346.883 5.533 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ccc(C)s1 476092558 XXQMRLPXQNVVIU-UHFFFAOYSA-N 341.520 5.870 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(Cl)c1 476123069 NOWHXKDTHDNIIY-OAHLLOKOSA-N 341.882 5.934 30 20 EKED CCCc1sc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1CC 483245346 QJIODDIKIHPAKV-KRWDZBQOSA-N 348.471 5.301 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 512668775 WOAREHQSZDWJHR-HXOBKFHXSA-N 344.433 5.332 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 559863753 MDHQNQMRHRQIIM-CVEARBPZSA-N 332.900 5.877 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C1CC1)C(F)(F)F 564125729 RYQNJJYIVJJABF-MRXNPFEDSA-N 340.389 5.001 30 20 EKED N#CC1(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CCC1 609856584 LYKQFNIQXAYFAJ-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 620595242 JHUGRQHJZNWZAV-OAHLLOKOSA-N 335.403 5.020 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734059815 IWTFVKFIIUIJQK-LAUBAEHRSA-N 347.462 5.138 30 20 EKED Cc1ccc(-c2nc(/C=C3/CSc4ccccc4C3=O)co2)cc1 749885371 CBTLZKRUHATCLT-GDNBJRDFSA-N 333.412 5.022 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(SCC(F)F)cc1)c1ccncc1 766024056 YYVCIMCLUWGMLF-KSSFIOAISA-N 348.462 5.407 30 20 EKED CC(=NNc1c(Cl)cc(F)cc1Cl)c1sc(C)nc1C 767909798 NHUNDEQSRIVJPN-UHFFFAOYSA-N 332.231 5.042 30 20 EKED Cc1cccc(C=NOc2ccccc2C(F)(F)F)c1OC(F)F 777887069 DREORWCLKSQJNP-UHFFFAOYSA-N 345.267 5.028 30 20 EKED CC(C)(C#N)CCCNc1ccc(OC(F)F)c(C(F)(F)F)c1 795048994 KCOMLAOWSVZYDC-UHFFFAOYSA-N 336.304 5.049 30 20 EKED N#Cc1cccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 834793504 ALMUQSKDMXRTEC-CXUHLZMHSA-N 341.197 5.604 30 20 EKED C[C@H](OC(=O)CCCCC#N)c1ccc(Cl)c(C(F)(F)F)c1 846943163 MLKCMOZVODORFM-JTQLQIEISA-N 333.737 5.047 30 20 EKED CC[C@H]1c2ccccc2CN1C(=O)N[C@H](CCCC#N)c1ccccc1 895042013 QHYWLQIDNCKNSA-RTWAWAEBSA-N 347.462 5.098 30 20 EKED N#CCCCCOC(=O)/C=C/c1ccc(-c2ccccc2Cl)s1 914622804 SZODQPNPNHAFFO-PKNBQFBNSA-N 345.851 5.319 30 20 EKED CC(C)[C@@H]1/C(=C\c2cccc(C(=O)O)c2Cl)C(=O)c2ccccc21 1776308590 HCMWPJJMGOSING-KGZWWPETSA-N 340.806 5.058 30 20 EKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1csc2ccc(C(=O)O)cc12 1776666068 WHEMUCBTMZVQEM-YXHQGMJNSA-N 348.423 5.058 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC[C@@H](CCC)c1ccccc1 1776782378 NORIBZVAQUSCJA-UXHICEINSA-N 333.516 5.364 30 20 EKED CC(C)(C#N)CCCN(Cc1cccc(-c2cccnc2)c1)C1CC1 159036774 KVWJBTZEUFQNQP-UHFFFAOYSA-N 333.479 5.043 30 20 EKED Cc1scc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 180099680 LDMBMGPVJRJEQB-LLVKDONJSA-N 330.478 5.012 30 20 EKED CC[C@H](C)[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 302936611 IJAJODODQDDPKI-OXJNMPFZSA-N 334.463 5.256 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@]1(F)c1ccccc1 413745838 JQJXVNUGSQEVCS-UGKGYDQZSA-N 337.438 5.362 30 20 EKED C[C@@H](NC1CC(F)(F)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 429455086 OYMKRVLCLQKITQ-SSDOTTSWSA-N 347.249 5.173 30 20 EKED C[C@H](Sc1cccc(Cl)c1C#N)c1noc(-c2ccccc2)n1 446068908 DWYJUXFCVSGIDD-NSHDSACASA-N 341.823 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@@H](OCC)C(C)C 475568758 FQGFSRAZVSTDRP-LJQANCHMSA-N 346.515 5.111 30 20 EKED Cc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(C)c1 482304059 QUCWLKSBTYWPFK-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CC(C)[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 487606997 WSGUHPXSUBVHDN-YADHBBJMSA-N 348.490 5.368 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(Cl)s1 505052544 UXJPPJNUWSESPB-UHFFFAOYSA-N 334.872 5.184 30 20 EKED C[C@@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)cc1F 512282400 MGOFUZDXRKOZQW-OAHLLOKOSA-N 338.426 5.330 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2cc(Cl)ccc2o1 618807383 UGXWZDBXPXOLRO-SGTLLEGYSA-N 336.822 5.296 30 20 EKED COc1ccc2oc(C(=O)/C=C/c3ccc(O)c(Cl)c3)c(C)c2c1 729150742 MAFMLTVOCKMHMQ-QPJJXVBHSA-N 342.778 5.005 30 20 EKED CC1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCCC1 734929697 OJNUNVJHGWIXLN-FQEVSTJZSA-N 347.462 5.186 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 739144421 XMRXUCJMPYWXPZ-JXFKEZNVSA-N 342.442 5.167 30 20 EKED CC(C)Oc1cccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741471612 BYAPVJHXVUBEEX-MDZDMXLPSA-N 343.426 5.432 30 20 EKED N#C[C@@H](NC(=O)C1CCCCCCC1)c1ccc(Cl)c(Cl)c1 741687879 VFGRTTPKKONRGR-MRXNPFEDSA-N 339.266 5.035 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C\c1cnc(-c3ccccc3)s1)CC2 741848791 PTEXDROOHRLEFD-WJDWOHSUSA-N 347.439 5.031 30 20 EKED CCOc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)ccc1O 744869233 RMATXDHZEOUXTB-HWKANZROSA-N 343.231 5.055 30 20 EKED CC(C)(C#N)c1ccccc1CSC[C@@H]1OCCc2ccccc21 767825752 YEEKHQOMABULNN-FQEVSTJZSA-N 337.488 5.035 30 20 EKED CC1(C)CCC[C@@H]1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772162966 WYHVSEFZLFIPFO-VQTJNVASSA-N 332.447 5.107 30 20 EKED N#Cc1ccc(F)c(CN[C@@H]2CCCSc3ccc(Cl)cc32)c1 773030885 WZHFCMMMQCRYPB-QGZVFWFLSA-N 346.858 5.068 30 20 EKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1cc2ccccc2s1 780188977 SPYMLTPOZCKLPM-HJWRWDBZSA-N 348.452 5.316 30 20 EKED CC1=CC(=NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)CCC1 794981337 LPMPJPHBXMUQRE-UHFFFAOYSA-N 346.356 5.061 30 20 EKED C=CCC[C@H](Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccco1 796857387 SHXYNFULESLZQK-INIZCTEOSA-N 344.842 5.179 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797572632 DWWJILLSTGLYMJ-HOCLYGCPSA-N 340.492 5.201 30 20 EKED COc1cccc(/C=C/C(=O)c2cccc(Cl)c2)c1OC(C)C 916137602 UPIUKXLZHYCHKP-ZHACJKMWSA-N 330.811 5.032 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(Oc2ccccc2)c(F)c1 917144422 LBUWFLDUNRXNRX-MDZDMXLPSA-N 337.350 5.119 30 20 EKED CCCCCCC[C@H](C)CN=c1c(C(=O)O)c[nH]c2ccc(C)cc12 1776782393 RRGUIMGEFFBLTR-INIZCTEOSA-N 342.483 5.072 30 20 EKED CC(C)N(C(=O)c1cccc(SCC#N)c1)c1ccc(Cl)cc1 79461122 BUCHZOCCQRNIEY-UHFFFAOYSA-N 344.867 5.011 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)s1 176943772 MLWQNXKGPPCSLM-NRFANRHFSA-N 344.439 5.245 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1 268810457 NZWUVQHETQQKQL-OLZOCXBDSA-N 327.497 5.033 30 20 EKED N#CCCC[C@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 340444331 DAKISKHSKPKGKI-SFTDATJTSA-N 346.474 5.458 30 20 EKED C=CCCc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 410349705 BTHOCVVZGQVZGT-UHFFFAOYSA-N 332.447 5.248 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2-c2cccs2)c1 505997327 UKLRNHUWCFIWAG-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C[C@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1ccc(C#N)cc1 513974772 SGSDMEWSUGQQHE-AWEZNQCLSA-N 347.443 5.169 30 20 EKED Cc1sc(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)c(C#N)c1C 518702425 SQDVHJCBAPJLGM-ZWKOTPCHSA-N 346.455 5.132 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccccc1 537950400 VTNYFKIAYANONB-WMZHIEFXSA-N 345.490 5.290 30 20 EKED C=CCCOCCCCC(=O)N1CCCCC[C@H]1c1cccc(C)c1 540501434 UQKNWMULWGIEJW-NRFANRHFSA-N 343.511 5.202 30 20 EKED N#C[C@@H]1CC[C@@H](N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 559149872 OYZBJNSFSJASAI-ZXIHIIQKSA-N 342.792 5.092 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(Oc2cccnc2)cc1)c1ccccc1 571441702 ZCJFHNCEVYQPCC-KRWDZBQOSA-N 344.414 5.172 30 20 EKED N#Cc1csc(CN[C@@H](c2cccc(Cl)c2)C2CCCC2)c1 610916020 SPTICQDJFWOHNK-GOSISDBHSA-N 330.884 5.294 30 20 EKED C[C@@H](CCC(F)(F)F)Nc1ccc(C(F)(F)C(F)(F)F)cc1 681140656 BHKFIJMYSUAGKU-QMMMGPOBSA-N 335.238 5.484 30 20 EKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c(Cl)c1 741472109 FRNDBBSGSCELTR-SOFGYWHQSA-N 349.817 5.307 30 20 EKED C#Cc1cccc(NC(=O)N(C2CC2)[C@@H](C)c2ccccc2Cl)c1 743084606 PFKGLHASCRAULI-AWEZNQCLSA-N 338.838 5.079 30 20 EKED CCCCCCCCC(=O)N(C)C[C@@H]1CCCO[C@H]1c1ccccc1 747786307 ZWDGKINYEJDQLA-UNMCSNQZSA-N 345.527 5.363 30 20 EKED C#CCCCCCC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 758216078 XEXIJWGWNZYCPJ-UHFFFAOYSA-N 325.374 5.049 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1c(Cl)oc2ccccc12 761274353 UAOQJDCQNANSFE-UHFFFAOYSA-N 339.700 5.518 30 20 EKED Cc1ccoc1C(=O)/C=C/c1ccc(/C=C/C(=O)c2occc2C)cc1 769784481 XDJVGVPSIVCUDN-FIFLTTCUSA-N 346.382 5.282 30 20 EKED C#CC[C@H](NCc1csc(Nc2ccccc2C)n1)c1ccccc1 775399714 IXFKFVIUICSTKW-FQEVSTJZSA-N 347.487 5.049 30 20 EKED O=C(/C=C/c1ccc(N2CCCCC2)cc1)c1ccccc1Cl 916135195 IBIQDXHYNATVKM-JLHYYAGUSA-N 325.839 5.226 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1ccccc1Cl 916135384 VUDDGUHIATYQKK-ZHACJKMWSA-N 325.820 5.360 30 20 EKED CCC/C(C)=C/C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 920222845 UMYAHTQYHQEOLA-SAPNQHFASA-N 348.446 5.017 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776114712 YOLHWOFOEZFGGS-XNTDXEJSSA-N 342.394 5.256 30 20 EKED CC(C)[C@H]1/C(=C\c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776308769 MUXKDUNGYOWEPC-OTJDAXFFSA-N 346.382 5.151 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc2cccc(CC)c2o1 1776782733 CKJXANQORXUTJW-SFHVURJKSA-N 345.483 5.289 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)ccc1F 66800506 VKNWMISQXKSHGT-NSHDSACASA-N 348.830 5.126 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2cccs2)c1 67320215 XYFSDCXPNXKSSA-QGZVFWFLSA-N 342.464 5.072 30 20 EKED CC(C)(CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 171875439 IQGCZFKQPOIRGN-QGZVFWFLSA-N 346.430 5.053 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccccc3C#N)s2)cc1 179085562 NZVBDYAMGUXAKK-OAHLLOKOSA-N 347.487 5.149 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]2CCC[C@@H]21 191504189 VOZSHBVDAZHLPA-LPHOPBHVSA-N 326.484 5.335 30 20 EKED CCc1cccc(C)c1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330026827 MBVITZTWICHPLT-UHFFFAOYSA-N 328.456 5.071 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1c(Cl)ccc(C)c1C 434482253 RPCYDADLQPWXHL-UHFFFAOYSA-N 328.843 5.177 30 20 EKED C[C@@H](S[C@H](C)c1nc(-c2cccs2)no1)c1cccc(C#N)c1 443156968 PVZUANCSQDRXQW-VXGBXAGGSA-N 341.461 5.225 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(SC)c1 475548452 QWKKWXYKUXLWNY-UHFFFAOYSA-N 340.492 5.904 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C 476858471 XGYSHVVBZUIZJK-GOSISDBHSA-N 341.842 5.039 30 20 EKED CCCc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)sc1C 483235239 NIBXGWPJANLSIU-QGZVFWFLSA-N 334.444 5.047 30 20 EKED N#Cc1ccccc1NC(=O)c1cc2sc3ccccc3c2s1 511837163 CQGKYXFIGBOIQB-UHFFFAOYSA-N 334.425 5.240 30 20 EKED CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1S[C@H](C)CC#N 513436832 KCLMRXQCEGOFMJ-NVXWUHKLSA-N 344.524 5.626 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC(F)(F)F)cc1 513647223 GWNZCRTVWUXVKX-ACJLOTCBSA-N 348.368 5.259 30 20 EKED Cc1cccc(Cl)c1NC(=O)c1sc2ccc(C#N)cc2c1C 517763934 WMXAQKDOWHRJAT-UHFFFAOYSA-N 340.835 5.296 30 20 EKED N#Cc1ccsc1C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 523307147 BPDBCXBILVEZDS-UHFFFAOYSA-N 344.395 5.285 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@@H](CCC#N)c2ccccc2)o1 532670505 XWICLAWFEHOAIT-NRFANRHFSA-N 348.421 5.529 30 20 EKED Cc1ccc(-c2c(C#N)c(C(C)C)nc3sc4c(c23)CCOC4)cc1 541588249 ACXRYJVTZLAGJE-UHFFFAOYSA-N 348.471 5.340 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(OCc2ccccc2)cc1 561438080 OFDYXFHBSPPNAE-MRXNPFEDSA-N 348.471 5.050 30 20 EKED C=CCC[C@H](Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 570810647 WEAZPVSXZCIDQA-IBGZPJMESA-N 340.467 5.188 30 20 EKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)CCCCCC#N 588752849 PXEXHBXVNDRWHZ-UHFFFAOYSA-N 341.282 5.204 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Sc2ccccc2C#N)cc1 590885206 PDJXLXYORRGWIU-UHFFFAOYSA-N 349.459 5.122 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1OC(C)(C)C 604629851 CVVPEMCSKCQRMM-UHFFFAOYSA-N 344.480 5.146 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)F)cc1 609376771 JRROCXAJNGHMAK-GFCCVEGCSA-N 346.402 5.128 30 20 EKED CCC(C)(C)OCc1cccc(N[C@@H](C#N)Cc2ccccc2)c1C 610538613 RIRBGDOIVMILBF-HXUWFJFHSA-N 336.479 5.247 30 20 EKED C[C@@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1cccc(C#N)c1 610830273 JFQQAUCMVKXVKH-IAGOWNOFSA-N 327.431 5.032 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1sc2cc(F)ccc2c1Cl 610907304 HTWMVUGMEDZPQJ-UHFFFAOYSA-N 344.798 5.126 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1nc2ccccc2s1 726427144 FPAXPUVMPRYQEA-KHPPLWFESA-N 348.452 5.316 30 20 EKED C=C(C)CNC(=S)Nc1ccc(-c2cccc(Cl)c2)cc1C 726750654 SOTKEWJGXDQQMB-UHFFFAOYSA-N 330.884 5.178 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1cc2ccccc2o1 727264527 VGVJVZJWAYNECO-ZHACJKMWSA-N 331.396 5.452 30 20 EKED CCC(C)(CC)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 767960558 SVTMAFDUYMOGFB-OAHLLOKOSA-N 326.465 5.121 30 20 EKED CCCCCCCCCCC(=O)N1CCCCC[C@@H]1c1noc(C)n1 779701543 VNOQXZSMJZQBRU-GOSISDBHSA-N 349.519 5.353 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1 792759697 BUVJOJYHOACBFK-AWEZNQCLSA-N 346.402 5.027 30 20 EKED C=C(C)CCc1noc(-c2ccc(C3SCCCS3)cc2)n1 795768846 NLHOAFFQXRRDBD-UHFFFAOYSA-N 332.494 5.114 30 20 EKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 795992924 RXOAYELKSLHWQD-YOEHRIQHSA-N 327.811 5.032 30 20 EKED COc1ccccc1CON=C(C)[C@H](C)c1nc2ccccc2s1 799118266 XFBCSOHRXVNBKL-ZDUSSCGKSA-N 340.448 5.001 30 20 EKED C[C@H](CCCC(F)(F)F)Nc1ccc(OCC(F)(F)F)c(F)c1 800497711 QCKWORJIUVRYEV-SECBINFHSA-N 347.274 5.300 30 20 EKED CCCCCCCC[S@@](=O)[C@H](C)c1nccn1-c1ccccc1 806641349 DHEVECMLLKIRAS-UZUQRXQVSA-N 332.513 5.043 30 20 EKED CC(C)c1cccc(NC(=S)N(C)[C@@H](C)c2cccc(C#N)c2)c1 819029003 SGWOUHULEHXSLW-HNNXBMFYSA-N 337.492 5.071 30 20 EKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2cccnc2)cc1 916136492 PYQUTKKLAVLZOJ-QINSGFPZSA-N 342.442 5.004 30 20 EKED CCN(Cc1cc2ccccc2nc1Cl)[C@H](C)c1ccc(C#N)cc1 918739232 GQENDBSREQCUIH-OAHLLOKOSA-N 349.865 5.343 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1c(F)cccc1F 108408200 UVNUNOMENDUQSD-OLZOCXBDSA-N 332.419 5.390 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 108981768 ZADSBAJNUZFUTQ-JKSUJKDBSA-N 338.476 5.213 30 20 EKED C[C@@H](CC#N)N(C)C(=O)Nc1cccc(CSC2CCCCC2)c1 120479904 WTDPMJJNFCXJHB-HNNXBMFYSA-N 345.512 5.018 30 20 EKED FC(F)(F)CCOc1cc(C(F)(F)F)cc(C(F)(F)F)c1 302843366 BTJSDUVVFWVQFV-UHFFFAOYSA-N 326.158 5.055 30 20 EKED N#CCCC[C@@H](NCc1csc(Cl)c1Cl)c1ccccc1 353917186 STUZKQBOIQDNGG-CQSZACIVSA-N 339.291 5.580 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1occc1C 417034160 DUDYHIVXLKLVIF-UHFFFAOYSA-N 340.467 5.494 30 20 EKED N#Cc1ccc(NC(=O)CC/C=C\c2ccccc2)cc1C(F)(F)F 443880541 FWIQFSBBVXEVQX-YWEYNIOJSA-N 344.336 5.009 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1ccccc1 475572436 YMFADVUTCFZLNW-UHFFFAOYSA-N 336.479 5.595 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(COC(C)(C)C)c1C 475985367 MXLJJMBBKMWQQG-UHFFFAOYSA-N 346.515 5.520 30 20 EKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1ccc(C(F)(F)F)cc1 500544333 KYSFMBGYKGWRHT-VIFPVBQESA-N 326.268 5.028 30 20 EKED Cc1c([C@@H](NCc2ccc(C#N)cc2F)C(C)C)oc2ccccc12 533445859 YZOIIEUXKTUWLD-FQEVSTJZSA-N 336.410 5.239 30 20 EKED CC[C@H](C)Cc1c(C)sc2nc(SCCCCC#N)nc(O)c12 539548856 VAKRWGVWVQSWRY-NSHDSACASA-N 349.525 5.080 30 20 EKED C=CCCc1ccccc1NC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2 558590388 DORVMOXSAPPXOW-AJHHTPGJSA-N 327.443 5.052 30 20 EKED N#CCCCOc1cccc(CN[C@H]2CCCC[C@H]2c2ccccc2)c1 559072231 YQCGKTGHJNXEMI-GOTSBHOMSA-N 348.490 5.185 30 20 EKED CCCNc1ccc(CNC2CCC(C#N)(c3ccccc3)CC2)cc1 569193258 BMBHPRTYWWGUSW-UHFFFAOYSA-N 347.506 5.002 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1sc2cccc(C)c2c1Cl 604498397 VFBQKQBKXAFIOJ-UHFFFAOYSA-N 340.835 5.296 30 20 EKED C#CCOc1ccc(CN[C@H](C)c2ccc(SC(C)C)cc2)cc1 733326823 DSJJRPDHIQPCJI-QGZVFWFLSA-N 339.504 5.050 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)c1cccc(Cl)c1Cl 734978549 LXHKZJHERTYYNK-UHFFFAOYSA-N 348.155 5.243 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(Cl)cc1Cl 740764333 ROJASIZSLFAUQD-FPLPWBNLSA-N 328.198 5.438 30 20 EKED CCCOc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1OCCC 743466109 KDYGGQFMGYJLAZ-MRXNPFEDSA-N 338.451 5.309 30 20 EKED N#CCC[C@H](NCc1cc(-c2ccccc2)ccc1O)c1ccccc1 747927772 DGHQESXEONTXMZ-QFIPXVFZSA-N 342.442 5.194 30 20 EKED O=C1/C(=C\c2nc(Cl)cs2)CCc2c1sc1ccccc21 759084849 YMDSYFPLJUGZRN-CLFYSBASSA-N 331.849 5.224 30 20 EKED CCc1ccc([C@H](CC)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772984560 OLBADFLFNOVZAC-IRLDBZIGSA-N 336.479 5.171 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(-c2c(F)cccc2F)cc1 811699202 YHYFCKSHSHNELQ-ZHACJKMWSA-N 339.341 5.133 30 20 EKED C=CCC[C@@H](NCc1nccn1C1CC1)c1ccc(C(F)(F)F)cc1 893185212 WOHQZCJJDRHLJZ-QGZVFWFLSA-N 349.400 5.034 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)Nc1ccc(C#N)cc1 914687004 CXSUAJQHMDZEIX-UHFFFAOYSA-N 327.387 5.178 30 20 EKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1ccc(O)cc1 916134841 KLPPDEVJBUSSEP-PKNBQFBNSA-N 347.395 5.158 30 20 EKED Cc1ccc(-c2ccccc2C=NNc2ccccc2C(=O)O)c(C)c1 1776031470 IIWKUTMAJLHKCZ-UHFFFAOYSA-N 344.414 5.115 30 20 EKED CCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 57526923 UOBGMBKQJHKEBB-GOSISDBHSA-N 346.455 5.171 30 20 EKED CC(C)N(Cc1ccc(-c2ccccc2C#N)cc1)Cc1ccccn1 64629122 PMCNRXDABWIQLU-UHFFFAOYSA-N 341.458 5.031 30 20 EKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccc(OCC#N)cc1 181724733 POAOAHHWRNVSSB-GJZGRUSLSA-N 336.460 5.215 30 20 EKED CC(C)c1nc([C@H](C)Nc2cccc(OCCCC#N)c2)cs1 186454557 FNRFNNGXVZTVAD-AWEZNQCLSA-N 329.469 5.122 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1sccc1C 189884370 HTSNQEVUSUZQLE-ROUUACIJSA-N 339.504 5.651 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccccc1 191467093 ZLYHIPUWSCYCGH-KRWDZBQOSA-N 336.479 5.763 30 20 EKED Cc1c([C@@H](C)Nc2cccc(OCCCC#N)c2)oc2ccccc12 195656658 RWABBRZBELXIET-MRXNPFEDSA-N 334.419 5.597 30 20 EKED CC(C)CCOc1ccc(NCc2ccc(O[C@@H](C)C#N)cc2)cc1 236580960 XHQRTLJXHMLROV-KRWDZBQOSA-N 338.451 5.014 30 20 EKED C=CCC[C@@H](NC(=O)c1ccccc1C(F)(F)F)c1ccccc1 435301071 VVWRGOMCLSEEGT-QGZVFWFLSA-N 333.353 5.143 30 20 EKED C=CCn1c(S[C@H](C)c2cccc(C)c2)nnc1-c1ccccc1 462982355 VDIPTBSWTQORKA-MRXNPFEDSA-N 335.476 5.293 30 20 EKED CC[C@@H](C(=O)Nc1cc(C(C)(C)C)sc1C#N)c1ccccc1 464407495 QZXSBOOAYWVYEQ-CQSZACIVSA-N 326.465 5.050 30 20 EKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1c(Cl)cccc1Cl 483852281 DMNVLSTYEHKDNU-CQSZACIVSA-N 347.245 5.044 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@](C)(CC)c1nc(C)cs1 505046736 YDCPZURMLOFLBH-LJQANCHMSA-N 343.496 5.017 30 20 EKED C[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1F 512277680 CHNIPJSFYPHBFW-MNOVXSKESA-N 337.225 5.416 30 20 EKED CCCCN(CCCC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 517473710 RIXOMGINOLBRES-INIZCTEOSA-N 347.528 5.372 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)N[C@H](CCC#N)c1ccccc1 536841588 WMDFIBYJOXANPL-HNAYVOBHSA-N 342.870 5.434 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc2cc[nH]c12 547528166 ZYQNHKWHUBBUJX-UHFFFAOYSA-N 345.855 5.103 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 550827116 KIRLAAKPDHBVGA-KXBFYZLASA-N 344.405 5.374 30 20 EKED N#Cc1ccc2c(c1)[C@H](NC(c1cccs1)c1cccs1)CC2 584201668 FNIIZRUQPSSNNV-MRXNPFEDSA-N 336.485 5.048 30 20 EKED C=CCCC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 588034424 GTRVYMHPKRQXOH-UHFFFAOYSA-N 336.460 5.544 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(C)c1 596710129 ICKYBBPCFCZCCV-HOTGVXAUSA-N 345.512 5.043 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)cc1C(F)(F)F)c1cccc(C#N)c1 599029153 CVSZYRANSPGEGF-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)F)cc1 609428395 MVYCWJSPTOTCGP-GFCCVEGCSA-N 346.402 5.271 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Cl)cc1 609432814 FQQWJWOMTRCBAT-GFCCVEGCSA-N 345.855 5.378 30 20 EKED C[C@@H](CCC(C)(C)C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609929573 FDKDSKHAJCATJJ-LSDHHAIUSA-N 347.528 5.417 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)[C@@H]1C[C@H]1c1ccc(Cl)s1 618988271 HOGVWWZPWREMBP-BEMMVCDISA-N 342.895 5.042 30 20 EKED C=CCC[C@@H](NCc1cc(-c2ccc(OC)cc2)no1)c1ccccc1 678785591 LQTGNJJCKYWOMJ-OAQYLSRUSA-N 348.446 5.147 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734059816 IWTFVKFIIUIJQK-UTKZUKDTSA-N 347.462 5.138 30 20 EKED C[C@@H]1CCC[C@@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 741537420 DMKSGTOGAJHVDT-BSIFCXSSSA-N 332.447 5.107 30 20 EKED CCCCc1ccc(CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747198439 HKONIMOZKUQPKD-KRWDZBQOSA-N 340.492 5.028 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1coc(-c2ccccc2)n1 749894559 SGOYFWZIBWRSNT-ZRRZQRFHSA-N 339.441 5.164 30 20 EKED CC(C)[C@@H]1CCc2ccccc2[C@H]1N[C@@H](C)c1ccc(OCC#N)cc1 765809324 MDFCRGVBXKHCNU-HYVJGQCMSA-N 348.490 5.199 30 20 EKED C#CCN(C(=O)Nc1cccc(CSC(C)C)c1C)C1CCCC1 776300112 UHPMYRXTAHVRLU-UHFFFAOYSA-N 344.524 5.046 30 20 EKED CCc1oc2ccccc2c1C=NOCc1cc(F)cc2cccnc12 914683960 UNBYKWPVWLBQLO-UHFFFAOYSA-N 348.377 5.233 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccccc2-c2ccccc2)c1 917517115 ITZNNGDXYVPLRO-PFONDFGASA-N 341.410 5.208 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C\c2cccs2)cc1 919864503 RSYNUPRRSXMAIC-QXMHVHEDSA-N 346.411 5.064 30 20 EKED Cc1ccccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777465335 RSVNJPNYUNZNED-BENRWUELSA-N 348.423 5.318 30 20 EKED N#Cc1ccc(Oc2cccc(NCc3cnc(Cl)s3)c2)cc1 89660177 NNXQCUPMIQAQBD-UHFFFAOYSA-N 341.823 5.073 30 20 EKED Cc1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 302951807 ANTQLIWNEAPPGC-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CCC(CC)CN(CCC#N)C(=O)Nc1ccc(Cl)cc1Cl 426586255 AXYQUPJJQGRYAG-UHFFFAOYSA-N 342.270 5.177 30 20 EKED CCCc1ccc(-c2ccc(NC(=O)N(C)[C@H](C)CC#N)cc2)cc1 444396285 JGIHDDZOWDCJHH-MRXNPFEDSA-N 335.451 5.072 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1cccc(Br)c1 444592083 DZVZLAAWAOEWDG-QGZVFWFLSA-N 349.316 5.306 30 20 EKED C[C@H](NC(=O)c1cccc(CC#N)c1)c1ccc(Cl)c2ccccc12 462720408 JDHCPLBXJXPGOU-AWEZNQCLSA-N 348.833 5.050 30 20 EKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cc2cccc(F)c2o1 473908289 DWLPPXQHNACJTN-VIFPVBQESA-N 349.287 5.030 30 20 EKED Cc1csc(-c2cccc(NCc3ccccc3C(C)(C)C#N)c2)n1 486458281 JXSAXGUSLZDYCU-UHFFFAOYSA-N 347.487 5.532 30 20 EKED C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 510075764 WCJIUWHBOSVWNL-HZPDHXFCSA-N 349.434 5.003 30 20 EKED C=CCn1c(SCc2ccc(SC(C)C)cc2)nnc1C1CC1 510263015 AQDMYQHNRQMARV-UHFFFAOYSA-N 345.537 5.134 30 20 EKED C=C[C@H](CC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 535334241 ZJPYRKGCTYDVBX-MRXNPFEDSA-N 333.456 5.714 30 20 EKED C[C@@H](Cc1ccc(Cl)cc1)N[C@@H](CCCC#N)c1ccccc1 590069239 LDUATWVREHCEGV-JXFKEZNVSA-N 326.871 5.296 30 20 EKED COCCCC[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1 619465942 LRLOOBIXWWBYEO-PKTZIBPZSA-N 348.490 5.083 30 20 EKED C#Cc1cccc(NC(=S)Nc2cccc(-c3cccs3)c2)c1 726490444 YNCJEUHTDYVZOI-UHFFFAOYSA-N 334.469 5.205 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl 734981504 RJUQEFSTOKMSBQ-LWUHNEAVSA-N 348.185 5.354 30 20 EKED C=C(Cl)CNC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 736972141 NMDGOEFTMIZRMC-OAHLLOKOSA-N 344.842 5.009 30 20 EKED CCCN(CC(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746658259 FCVHIFUQEPSBTK-OAQYLSRUSA-N 349.478 5.242 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Cl)c(F)c2)c1 772983420 HSXGFLQKXHTEAB-XJKSGUPXSA-N 346.833 5.011 30 20 EKED CC(C)C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccs1 776157566 CMGZCVQIRXGVOY-QAPCUYQASA-N 328.481 5.088 30 20 EKED C=CCCC[C@@H](C)NC(=S)Nc1ccc(SC(F)F)cc1 776203366 PIQZJGGBZSCOKC-LLVKDONJSA-N 330.469 5.033 30 20 EKED CCCCCCCCC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1 779702072 RYZFODYJFRTVID-QGZVFWFLSA-N 349.519 5.387 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1cccc(C(F)(F)F)c1 788100935 YIDJJUKYCHRNIZ-SREVYHEPSA-N 349.333 5.318 30 20 EKED CC(C)(C)c1ccc(-c2nnc(SCC3(C#N)CCCC3)o2)cc1 806585380 BRFYVDVVUYZYPZ-UHFFFAOYSA-N 341.480 5.210 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1O 815636457 VOSNUMVKVBYAFV-RTBURBONSA-N 326.415 5.007 30 20 EKED N#CCc1ccc(NC(=O)N[C@H](c2ccccc2)C2CCCCC2)cc1 915330062 AIFHAUHEJPUEKK-OAQYLSRUSA-N 347.462 5.196 30 20 EKED CC(=NNc1nc(-c2ccccc2)cs1)c1cc(C)sc1C 916545497 LBHSNJZPOXLVQD-UHFFFAOYSA-N 327.478 5.325 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(NC(C)=O)cc1 918722805 JZZFGXVCDBHPEQ-UHFFFAOYSA-N 349.544 5.024 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1ccc(Cl)c2cccnc12 63750686 AOPBBFYLWHBZMO-UHFFFAOYSA-N 349.865 5.170 30 20 EKED CCC(CC)CN(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 108528834 DRUFJVMPFCOOQQ-OAHLLOKOSA-N 347.528 5.228 30 20 EKED CCCCCCCCCCCCCCCCCCNC(=O)C(=O)O 202088058 BDKFNENWCCTTOR-UHFFFAOYSA-N 341.536 5.449 30 20 EKED CCc1ccc(C(=O)/C=C\c2ccccc2OCc2cccnc2)s1 208115796 FCJURWBSBJFUQT-LUAWRHEFSA-N 349.455 5.181 30 20 EKED Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 285329274 BRTFTNVHOKFSMH-ZDUSSCGKSA-N 342.464 5.216 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1ccc(Cl)cc1 303115137 CXNCLHDCESMKMW-ZHACJKMWSA-N 325.820 5.360 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C)CCC#N 411526240 DCZRISJURNDLQC-NWDGAFQWSA-N 333.888 5.115 30 20 EKED CCC[C@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 460341756 XFPVTKDXNOROLC-HNNXBMFYSA-N 340.854 5.181 30 20 EKED C=C(C)[C@H](NCc1csc(C(C)(C)C)n1)c1ccc(F)c(F)c1 479404085 CGWCYTVUDCAKQO-INIZCTEOSA-N 336.451 5.126 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 516984699 QTHRXQQXUCWSQL-DNVCBOLYSA-N 344.405 5.374 30 20 EKED CCSCc1cccc(NCc2cccc(OCCCC#N)c2)c1 533218169 APZNPSJDOOHHTP-UHFFFAOYSA-N 340.492 5.234 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 536838693 MBIPKBBZVAZGLO-FZKQIMNGSA-N 333.262 5.689 30 20 EKED Cc1nc(-c2ccc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 538152139 ZJMOQPICTQVRHW-GJZGRUSLSA-N 347.487 5.402 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 539497206 YOCSPCROMONZAV-JLTOFOAXSA-N 336.435 5.199 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C1CCOCC1 543034304 IAWXYBDMXKTZFS-SBUREZEXSA-N 348.490 5.081 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 554364531 HXSMLRXBGCHNFN-DLBZAZTESA-N 338.417 5.261 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccc(Sc2ccccc2)cc1C 574074522 SZWBTUNASZRONZ-OAHLLOKOSA-N 326.465 5.232 30 20 EKED N#CCCC[C@@H](NC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1)c1ccccc1 599969991 GUSIRJYGYCQBGG-YPAWHYETSA-N 346.474 5.122 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)Cc1ccccc1CC#N 776726463 JSORPDJDEDICEU-UHFFFAOYSA-N 334.463 5.181 30 20 EKED N#Cc1c(Cl)cccc1SCc1ccc(Cl)nc1Cl 799888914 JISQKEIQZFXPKL-UHFFFAOYSA-N 329.639 5.206 30 20 EKED C=CCCc1ccccc1NC(=O)c1sccc1SC(F)F 800158190 OANMDZHUMBLRTM-UHFFFAOYSA-N 339.432 5.434 30 20 EKED CCCCCCCOc1ccc([C@@H](C)N[C@@H]2CCn3ccnc32)cc1 834836101 LIKVAXFZEWKLBG-YLJYHZDGSA-N 341.499 5.028 30 20 EKED N#CC1(c2ccc(CNc3cccc(SC(F)F)c3)cc2)CC1 850211316 IMXXFJVWIWLUDH-UHFFFAOYSA-N 330.403 5.169 30 20 EKED Cc1cc2oc(=O)cc(CSc3ccc(C#N)cc3)c2cc1C(C)C 916672229 OGERSCBCHJOTKN-UHFFFAOYSA-N 349.455 5.389 30 20 EKED C[C@@H]1CCCC[C@H]1CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 920791687 CEIGTVHOSJHFPB-PVAVHDDUSA-N 338.476 5.203 30 20 EKED N#CC1(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CCCC1 30180647 HIPZRAAOUVBADC-UHFFFAOYSA-N 340.810 5.155 30 20 EKED N#CCCCOc1cccc(NCc2cnc(C3CCCC3)s2)c1 135931464 BMOQSIDQFRQKOB-UHFFFAOYSA-N 341.480 5.095 30 20 EKED CC(C)c1ccccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 190914566 IQYSHIMXWOKGAW-OAHLLOKOSA-N 338.476 5.115 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)c1ccccc1 194559354 OFCDQDYCWVCEAY-KRWDZBQOSA-N 335.451 5.148 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 296129584 IBQINQZJLNTWLL-HOTGVXAUSA-N 327.472 5.137 30 20 EKED C[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)C(O)=Nc1ccccc1 329193821 SQCOOUFDTGSNCN-CWLKWCNXSA-N 328.456 5.226 30 20 EKED C=CCC[C@@H](NC(=O)[C@@H](C)CC(F)F)c1ccc(C(F)(F)F)cc1 412210814 ZQXQPWZWCHVKNI-SMDDNHRTSA-N 349.343 5.120 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)cc1Cl)c1ccccc1 432486491 WHDJFJRMGFPHOD-MRXNPFEDSA-N 345.805 5.036 30 20 EKED CC[C@@H](N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(C#N)cc1 447583649 CAIVYRZVBFWSMC-RTBURBONSA-N 338.426 5.040 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2CCC2)cc1Cl 463391029 JWYPKFRCBGYMCB-GOSISDBHSA-N 338.838 5.124 30 20 EKED C=CCCCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 470200627 NATCBPLFVDGIFF-MRXNPFEDSA-N 325.374 5.115 30 20 EKED CC(C)CN(C(=O)c1ccc2sccc2c1)c1ccc(C#N)cc1 471157642 SIIAPAFXMJFKEB-UHFFFAOYSA-N 334.444 5.076 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc2ccccc2c1 500326037 DKVQDORLNYAAMB-UHFFFAOYSA-N 342.442 5.010 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1C(F)(F)F 540711022 RXOVQOHFIYWRIG-NEPJUHHUSA-N 336.332 5.128 30 20 EKED N#Cc1ccc(CSCc2cc(-c3ccc(Cl)cc3)no2)cc1 603502553 ZMGRGUJUSWVFIS-UHFFFAOYSA-N 340.835 5.300 30 20 EKED N#CCCCOc1cccc(NCc2cccc(-c3ccccc3)c2)c1 603934185 LVQGOCUQOSQXNP-UHFFFAOYSA-N 342.442 5.648 30 20 EKED CCC(CC)[C@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1ccccc1 610400725 CQSBCUPTEYSRBM-KKSFZXQISA-N 349.478 5.096 30 20 EKED CC(C)Oc1cccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741471611 BYAPVJHXVUBEEX-KTKRTIGZSA-N 343.426 5.432 30 20 EKED C[C@@H]1CCC[C@H](CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C1 750667159 CHBBSXHSHUADHC-HLLBOEOZSA-N 338.476 5.203 30 20 EKED CCCCOc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)c(C)c1 776860674 WTYKEAZQYNLBDL-QGZVFWFLSA-N 338.451 5.249 30 20 EKED Cc1nc(-c2ccc(N[C@H](C)c3ccc(C#N)c(F)c3)cc2)oc1C 777652718 NWWNPOPGPWDSKE-CYBMUJFWSA-N 335.382 5.142 30 20 EKED C=CCC[C@@H](N[C@H]1COCc2cccc(Cl)c21)c1ccccc1 788668479 BEETZKNOYOSAPH-MOPGFXCFSA-N 327.855 5.208 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CC2(CCOCC2)[C@H]1C1CC1 818796550 WVCPFXCOBBOMCH-GHTZIAJQSA-N 349.559 5.181 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cccc(F)c1 1776785064 BKKGBZMJDSUQJO-LJQANCHMSA-N 337.479 5.414 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(F)cc1F 189907485 HIUJQAYZHCGQQF-UHFFFAOYSA-N 343.417 5.388 30 20 EKED C[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1cccc(C#N)c1 193002077 RJLUMNRTQPDUKP-PXAZEXFGSA-N 328.868 5.099 30 20 EKED CCc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)s1 303199614 YYVLBQKPKJEZKW-CSKARUKUSA-N 325.458 5.330 30 20 EKED C=CCC1(C(=O)Nc2ccc(S[C@H](C)CC)cc2C)CCOCC1 425478515 PFPMZYOKPIMZCQ-MRXNPFEDSA-N 347.524 5.197 30 20 EKED CCN(C(=O)Nc1cccc(C#N)c1C)[C@@H](C)c1cc2ccccc2o1 431728068 WPWRGIQRHOFPBK-HNNXBMFYSA-N 347.418 5.228 30 20 EKED C=CCC[C@H](NC(=O)C[C@H](C)c1ccccc1OC)c1ccccc1 435300148 FRSYZPBAIUVUMG-PXNSSMCTSA-N 337.463 5.013 30 20 EKED Cc1cscc1NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 439314320 MVQHTPKQRVQLQN-UHFFFAOYSA-N 349.415 5.365 30 20 EKED N#CCCC[C@H](N[C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 449341874 XCYSEQILLOTSFF-DLBZAZTESA-N 344.380 5.116 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 469517452 PUOQPYNXXMQKAR-QGZVFWFLSA-N 338.417 5.562 30 20 EKED N#Cc1ccc(Oc2ccc(Oc3ncc(C#N)cc3Cl)cc2)cc1 479441955 BPLKFKIBZPTKEV-UHFFFAOYSA-N 347.761 5.063 30 20 EKED C=CCCCC(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 480892445 APTXNYJNUUEHFN-INIZCTEOSA-N 325.374 5.115 30 20 EKED N#CCCCCN[C@@H](CCSc1ccccc1)c1ccc(F)cc1 482460944 RGGUCQVWZOKFBL-FQEVSTJZSA-N 342.483 5.333 30 20 EKED C=CCC(CC=C)C(=O)N(C(CC)CC)[C@@H]1CCCc2cccnc21 511305374 ZKTMBCQLSZHPMI-HXUWFJFHSA-N 340.511 5.245 30 20 EKED C=C[C@H](CC(=O)N1[C@H](C)Cc2cc(F)ccc2[C@H]1C)c1ccccc1 537692588 JKRNICNKYBWPTH-BRWVUGGUSA-N 337.438 5.020 30 20 EKED N#CCCC[C@@H](NCc1ccc(C2CCCC2)cc1)c1ccccc1 552083456 GFFAOKCHUJVCNY-HSZRJFAPSA-N 332.491 5.869 30 20 EKED C[C@@H]1C[C@@H]1[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 564426560 CPQQNVSKNCQWLH-LGWKTVDISA-N 336.866 5.186 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H](C)c1ccc(C#N)cc1 583715961 IBILJWSMSAKZRO-QVKFZJNVSA-N 329.447 5.076 30 20 EKED N#CC1(c2ccc(-c3csc(C(F)(F)F)c3)cc2)CCOCC1 598930614 XWCMXDCYIRSTAH-UHFFFAOYSA-N 337.366 5.006 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2ccccc2)cc1 642391838 JGZYOKHWEMLXPC-UHFFFAOYSA-N 348.471 5.635 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036523 BAZASYABAILDRS-NVXWUHKLSA-N 340.492 5.593 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nc2ccccc2o1 744039199 KKFWBUMBZNFTEQ-FOIQADDNSA-N 326.440 5.391 30 20 EKED C=C(C)COc1cc(/C=C\C(=O)c2c[nH]c3ccccc23)ccc1OC 747064420 VWGGHQSMUIVWJX-NTMALXAHSA-N 347.414 5.028 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCCC[C@@H]1c1noc(C)n1 775490079 VISIYRUVALONET-FUHWJXTLSA-N 349.519 5.208 30 20 EKED C[C@@H](C#N)Oc1ccccc1NC[C@@H](C)c1ccc(C(F)(F)F)cc1 809636602 CPORABCZYYEQQJ-KGLIPLIRSA-N 348.368 5.212 30 20 EKED C#CCCCSC1=NC(=O)/C(=C\c2csc3ccccc23)S1 814770944 IMLFCOKTPRVTSJ-XNTDXEJSSA-N 343.498 5.018 30 20 EKED CCCCCCCCCC(=O)N1CCC(C(=O)c2ccccc2)CC1 886452261 YJZYQPJRZSQCCH-UHFFFAOYSA-N 343.511 5.249 30 20 EKED CSc1ccc(CN[C@@H](C)c2sc(C(C)C)nc2C)cc1C#N 886688186 MDWCQWKTCORUKO-LBPRGKRZSA-N 345.537 5.019 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)C12CC3CC(CC(C3)C1)C2 915918742 JIBDLMUSPHAYHE-UHFFFAOYSA-N 337.389 5.105 30 20 EKED O=C(/C=C\c1cccc(C(=O)O)c1Cl)c1ccc2ccccc2c1 1776131546 UQJUNNQCQXCAAL-KHPPLWFESA-N 336.774 5.088 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(C)cc2)ccc1SC(F)F 63874738 QVPYGCSSRAMXMW-VQHVLOKHSA-N 334.387 5.214 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/c2ccc3ccc(Cl)cc3n2)cc1 110972597 GYWAWGFWXQFBCQ-LPSTVZDBSA-N 334.806 5.349 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cnc2ccsc2c1 340450389 YAGKIKCVGIWCMD-YJBOKZPZSA-N 335.476 5.382 30 20 EKED N#Cc1c(F)cccc1CNc1cccc(COC2CCCCC2)c1 427420733 MEUNYXZRJWUQEB-UHFFFAOYSA-N 338.426 5.159 30 20 EKED CC(C)(C)CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 460326806 DCZQTXRMYCWVRY-UHFFFAOYSA-N 340.854 5.181 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@@H](c2ccc(Cl)cc2)c2ccsc2)C1 463300690 LCDDBVJHRJKMFP-XWIAVFTESA-N 330.884 5.163 30 20 EKED C=C(C)[C@H](NC(=O)Nc1ccc(C)cc1C)c1ccc(F)c(F)c1 479762665 DGJNJZPMYQKKKP-SFHVURJKSA-N 330.378 5.021 30 20 EKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1cc(C)sc1C 485455459 LLQUXHSAHXAWLX-ZDUSSCGKSA-N 331.506 5.134 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 511727934 DFKPYIHZVZCMNJ-UHFFFAOYSA-N 345.402 5.054 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(C(F)(F)F)nc1C)c1ccccc1 512410444 GVWYFHSCPVDMES-OAHLLOKOSA-N 348.368 5.097 30 20 EKED N#Cc1ccc(N2CCC(c3c[nH]c4ccccc34)CC2)cc1Cl 517639247 FCDWRAMMCXJJRL-UHFFFAOYSA-N 335.838 5.077 30 20 EKED CCc1c(C)sc(NC(=O)c2cc(Cl)cc(Cl)c2)c1C#N 524105415 BYBNTJVCTGIFMN-UHFFFAOYSA-N 339.247 5.050 30 20 EKED CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1cccc2ccccc12 537165470 GUPOBGGAXAZFHO-UHFFFAOYSA-N 334.806 5.032 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 540151219 PADFESCRGZTEPZ-WFASDCNBSA-N 340.414 5.520 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(F)c2ccccc12 556151005 SGRHHACVZSEROS-OAHLLOKOSA-N 330.406 5.190 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCC(C)(C)CCC#N)cc1 558244527 BXMRUZIOEQHYLM-KRWDZBQOSA-N 336.479 5.343 30 20 EKED CC[C@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 581041692 YNCALAHYHYESTA-OALUTQOASA-N 346.396 5.020 30 20 EKED N#Cc1csc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1 581339043 FQJMVLRWALLTEW-MRXNPFEDSA-N 337.275 5.167 30 20 EKED CC(C)(C)c1ccc([C@@H](NCc2cccc(C#N)c2)C(F)(F)F)cc1 604484034 MWGIFQZAQBULSM-GOSISDBHSA-N 346.396 5.249 30 20 EKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1cccc(C#N)c1 610009965 LGTRINPBFYDVLS-LJQANCHMSA-N 342.870 5.097 30 20 EKED N#C[C@H](C(=O)c1ccc(F)c2ccccc12)c1ccc2ccccc2n1 684629828 HLZSUTQQNWKIJL-SFHVURJKSA-N 340.357 5.017 30 20 EKED COc1ccc(C)cc1C(=O)/C=C/c1nc(-c2ccccc2)cs1 726876423 RNTWTFFGQNCBGH-PKNBQFBNSA-N 335.428 5.023 30 20 EKED C[C@H]1CC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 731110004 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5.080 30 20 EKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932567025 JURSJAYGAPGDKV-UTKZUKDTSA-N 347.462 5.148 30 20 EKED Cc1cc(CCCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)s1 84695994 VCBKABCKTAHXAW-OAHLLOKOSA-N 346.521 5.144 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2coc3ccccc23)c1 159011574 KUNBQPCBMPNSGG-ZHACJKMWSA-N 331.371 5.011 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2Cl)o1)c1cccc(C#N)c1 237578328 JBIUJKXIMXZCAE-AWEZNQCLSA-N 336.822 5.322 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccn(C2CCCC2)n1 268628462 PKWLXVGKPHUHEH-OAHLLOKOSA-N 340.496 5.005 30 20 EKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)[C@H](C)c1ccccc1 330009378 HGHSAUUGQKOJLU-GKVPXEHWSA-N 342.483 5.060 30 20 EKED CSc1cc(C)ccc1NCc1cccc(OCCCC#N)c1 414496309 QFDZCZNBYYRECV-UHFFFAOYSA-N 326.465 5.012 30 20 EKED CC[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 426303440 YBBDLNIILIWQSM-HZPDHXFCSA-N 330.884 5.391 30 20 EKED CC(C)c1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 431704405 XAYXPPHWKCSUOV-LJQANCHMSA-N 335.451 5.367 30 20 EKED N#Cc1ccc(NC(=O)c2c(F)cccc2Sc2ccccc2)cc1 463640763 YCCAQKQUSKLTON-UHFFFAOYSA-N 348.402 5.101 30 20 EKED Cc1ccc(Cl)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 474985333 KHGXFKJRGXDKGY-UHFFFAOYSA-N 346.817 5.439 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)CC2 476876662 HSOOHBSQSXNUSP-IRLDBZIGSA-N 346.474 5.001 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1coc2ccccc12 499452975 FBNDGOXFKBYFHG-UHFFFAOYSA-N 344.395 5.285 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1F 512632016 VWLZQMFIMJHDLT-RNODOKPDSA-N 326.390 5.028 30 20 EKED C=CCCC(=O)N(Cc1ccc(-c2ccccc2OC)cc1)C(C)C 525589628 BGCHLFYPRRDGPK-UHFFFAOYSA-N 337.463 5.065 30 20 EKED Cc1nc(C)c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542014984 DFSRNYDLWXBZJQ-CQSZACIVSA-N 347.487 5.149 30 20 EKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccccc2CC#N)c2ccccc21 558191552 ZFCFYFRHKGWNIX-PXNSSMCTSA-N 332.447 5.008 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H]3CCc4ccc(C#N)cc43)oc12 562095476 CJEDKGDZJUHJKR-IFXJQAMLSA-N 346.430 5.041 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 563643117 UBLPEWKZOPIDAL-AVRDEDQJSA-N 336.479 5.560 30 20 EKED CCCC[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(OC)cc1 565532660 LNWUCESFSWPRKG-VXKWHMMOSA-N 334.463 5.075 30 20 EKED N#Cc1ccc(SCc2coc(-c3cccc(Cl)c3)n2)c(F)c1 610165834 YVMKGAIECYIMHF-UHFFFAOYSA-N 344.798 5.298 30 20 EKED N#CCc1ccc(C(=O)Nc2cccc(Sc3ccccc3)c2)cc1 611149490 YUMOYRVMNZRHTE-UHFFFAOYSA-N 344.439 5.156 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 611465506 WDGOGRIHKGACQD-RYUDHWBXSA-N 336.332 5.128 30 20 EKED Cc1cc(F)cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 742537155 HXIUGKAAOYJPSF-NRFANRHFSA-N 344.389 5.042 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)(C)C 744034896 FXENSNLSZSUYPH-MQGYJPLLSA-N 332.856 5.118 30 20 EKED C[C@H]1/C(=C\c2ccccc2OCc2ccccn2)C(=O)c2ccccc21 809156607 MTWJQRBADCCVSF-ZFMLPXDISA-N 341.410 5.044 30 20 EKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1ccccc1C(=O)O 1776030611 WXTJMGRDHOLEIK-UHFFFAOYSA-N 349.434 5.022 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1 116609404 DYUDIGXZQWVPEP-OFFHKIPUSA-N 346.213 5.180 30 20 EKED C[C@H](S[C@@H](C)c1nc(Cc2ccccc2)no1)c1ccc(C#N)cc1 173829705 JBUALKHNTDVZJW-GJZGRUSLSA-N 349.459 5.087 30 20 EKED C=C(C)[C@H]1OCC[C@H]1CNC(=O)Nc1c(C(C)C)cccc1C(C)C 280971199 IMYZQFHCIQWITL-OXJNMPFZSA-N 344.499 5.036 30 20 EKED N#CCCC[C@H](NCc1ccc(Br)s1)c1ccccc1 353916232 PHKVOCSFZGQNTH-HNNXBMFYSA-N 349.297 5.035 30 20 EKED Cc1oc2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2c1C 360664263 OANUXSNSLNVJKL-LJQANCHMSA-N 347.418 5.216 30 20 EKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC(C)(C)C1 416805861 FHSOERUJKUWPBW-CQSZACIVSA-N 345.512 5.123 30 20 EKED C=CCC[C@@H](NC(=O)N(Cc1cccs1)C1CC1)c1ccccc1 435763480 WBGRHLOWJRFONI-LJQANCHMSA-N 340.492 5.130 30 20 EKED C=CCC[C@@H](N[C@H](C)c1nccnc1C)c1ccc(C(F)(F)F)cc1 446941615 MBBRWFNSQPPSNI-RHSMWYFYSA-N 349.400 5.162 30 20 EKED CC[C@H](NCc1cccc(COC(C)(C)C)c1)c1ccc(C#N)cc1 447564297 WNUUDOQESYQMIM-NRFANRHFSA-N 336.479 5.114 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 474583353 FKJGOMBGPUHXBX-KRWDZBQOSA-N 346.455 5.441 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccccc1SC 505058241 ROBKHGSLTLCCHO-UHFFFAOYSA-N 340.492 5.191 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 537948128 XWPLMZJHRYFPKP-SWLSCSKDSA-N 340.414 5.520 30 20 EKED C=CCC[C@H](N[C@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 540151216 PADFESCRGZTEPZ-DOMZBBRYSA-N 340.414 5.520 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)CCCCCC#N)C1CC1 588892659 ACOWYHWMMHDXHM-QGZVFWFLSA-N 334.463 5.366 30 20 EKED COc1cccc2cc([C@@H](C)NC3(c4ccc(C#N)cc4)CCC3)oc12 594520031 XZXUTANVCUWUFP-OAHLLOKOSA-N 346.430 5.043 30 20 EKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1ccc2ccccc2n1 613290954 PVUGXNUCVQQYDT-OAHLLOKOSA-N 346.386 5.079 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@@H]1c1ccncc1 726883878 NOKGHXONXOYROZ-XEDBTPMOSA-N 328.500 5.442 30 20 EKED CSc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1 727264579 SNGVIWAULBONBC-QXMHVHEDSA-N 337.469 5.428 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1c[nH]c2cc(F)ccc12 727266807 GGQFJJQPDGHGGL-CLFYSBASSA-N 348.402 5.327 30 20 EKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 728764617 SZBBXVLYIOJKMT-SJORKVTESA-N 348.471 5.302 30 20 EKED CC(=NNc1nc(-c2ccccc2)cs1)c1cc(F)c(F)c(F)c1 730430084 CDIGRGNBXITUGR-UHFFFAOYSA-N 347.365 5.064 30 20 EKED CCCCCCCCCC(=O)NC1(c2cccc(F)c2)CCOCC1 742884623 CGLBTYGQEXFGEB-UHFFFAOYSA-N 349.490 5.088 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(F)c(Cl)c2)ccc1SC 746341622 DOSJGDIPDSMTNU-CLTKARDFSA-N 336.815 5.106 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(Cl)c(C(F)(F)F)c1 754688866 AROISMRCOVEUHW-PLNGDYQASA-N 331.746 5.020 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc2ccccc2n1 756518017 ASLDQBOLMHMBTB-OWYHZJEWSA-N 332.447 5.018 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(SC2CCCC2)cc1 765011404 ALQPQQBVFCRPMN-MRXNPFEDSA-N 336.504 5.444 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C\c2cncc3ccccc23)cc1Cl 773163685 YUHXFSUPYAKJSU-WAYWQWQTSA-N 343.213 5.020 30 20 EKED CC(C)c1ccc([C@H]2CCCN2c2nc(Cl)c(C#N)s2)cc1 804577595 FBRCIAMHWQBYDG-CQSZACIVSA-N 331.872 5.133 30 20 EKED CCCCC[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)C(C)C 813212659 FJMXAYXWGUUDFR-LSDHHAIUSA-N 340.389 5.129 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)cc(Cl)c1O)c1ccccc1 814304576 OFQJTVLAHPXLSA-KRWDZBQOSA-N 349.261 5.224 30 20 EKED CC(=NNc1cc(Cl)ccn1)c1sc(-c2ccccc2)nc1C 814897918 GSHZNGFMJOKLQB-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CCN(C)c1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 815636320 SNWWJMJMUXSYQL-AVRDEDQJSA-N 335.495 5.228 30 20 EKED CCCCCCCCCC(=O)N1CCCCC[C@H]1c1ccncc1 915870904 SCQPSBIJRWOROI-FQEVSTJZSA-N 330.516 5.666 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccncc1)C1CC1 931058652 CGRBMZLBVOWIBS-HXUWFJFHSA-N 349.478 5.206 30 20 EKED C[C@@H]1C(=Nn2c3ccccc3c3ccccc32)CC[C@H](C(=O)O)C1(C)C 1776113014 SRZLIOSLFWFPRL-RHSMWYFYSA-N 348.446 5.156 30 20 EKED N#Cc1cccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c1 7956039 LVFAHAGSLFAXQB-UHFFFAOYSA-N 347.226 5.332 30 20 EKED CCN(c1ccccc1)c1ccc(CNCc2cc(C#N)cs2)cc1 237064108 XKICTOARMNFPES-UHFFFAOYSA-N 347.487 5.068 30 20 EKED Cc1sc([C@H](C)N[C@@H](C)CCC#N)nc1-c1ccc(Cl)cc1 411545347 WYOHAXMXRSAKPB-RYUDHWBXSA-N 333.888 5.115 30 20 EKED N#Cc1cc(F)ccc1NCc1cccc(COCc2ccccc2)c1 462932224 ZLQIUAUVLUVWTM-UHFFFAOYSA-N 346.405 5.026 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H](c2ccc(Cl)cc2)c2ccsc2)C1 463300678 LCDDBVJHRJKMFP-BVGQSLNGSA-N 330.884 5.163 30 20 EKED CCCc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)sc1C 474424165 FWFFPVBCBIBDKX-ZDUSSCGKSA-N 332.494 5.079 30 20 EKED CC[C@H](C)CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 480110620 QGTKYGPQOGSXNY-NSHDSACASA-N 344.402 5.086 30 20 EKED Cc1cc(Cl)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1Cl 483804924 KOWSBEBCNRNQLN-UHFFFAOYSA-N 347.245 5.355 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc2ccc(C)nc12 486251883 PDFHEXMHHGNLKS-UHFFFAOYSA-N 334.444 5.074 30 20 EKED C=CCNC(=O)Nc1ccc(N[C@H](C)c2ccc3ccccc3c2)cc1 495609132 NZWSULAWBMRWDK-MRXNPFEDSA-N 345.446 5.320 30 20 EKED FCCCCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510770240 ZHPYDOBTCUKVTG-LBPRGKRZSA-N 331.275 5.038 30 20 EKED CCSc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 540728658 KGGFPQCJESXKEX-MRXNPFEDSA-N 340.492 5.654 30 20 EKED C[C@H](SCCCC1(C#N)CCOCC1)c1cccc2ccccc12 541881394 TUNCZHQVEDGYOX-KRWDZBQOSA-N 339.504 5.735 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2ccccc2)cc1 570136356 QAXZUEYNSZMTIJ-FQEVSTJZSA-N 347.462 5.247 30 20 EKED C=C[C@@H]1CCCCN1C(=O)c1ccc(-c2cccc3cccnc23)cc1 578921599 GKLBTFXEBABKOX-HXUWFJFHSA-N 342.442 5.083 30 20 EKED CC[C@H]1CCCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 609755461 JHUAWCOUNPBMTI-KRWDZBQOSA-N 348.446 5.003 30 20 EKED Cc1cccc([C@H](NCc2ccc(C#N)cc2F)c2cccc(F)c2)c1 619753518 IDBNCHFNIFQBRB-QFIPXVFZSA-N 348.396 5.024 30 20 EKED COc1ccc(CN[C@H](C)c2ccc(-c3ccccc3)cc2)cc1C#N 742366257 QGLCHUJEEACFCY-QGZVFWFLSA-N 342.442 5.085 30 20 EKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cccc2ccccc12 753134583 JVMACIOTESPHCM-HJWRWDBZSA-N 342.423 5.254 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccccc1C(F)(F)F 760263737 IAGAHIINOZJDLB-HJWRWDBZSA-N 337.366 5.326 30 20 EKED C/C(=C/C(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 773982963 NNQPOHKXJGRKOG-DNXIFWLFSA-N 338.476 5.287 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1ccncc1 776158356 SXXHKZGDOKPJGU-IIBYNOLFSA-N 342.442 5.949 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](F)CC1CCCCC1 793469346 SJIZQVZZSKSSAU-ZBFHGGJFSA-N 348.487 5.328 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C\c1ccnc2ccccc12 800158008 LOFZHJICHYNATH-YPKPFQOOSA-N 328.415 5.005 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@]3(C#N)CC3(C)C)sc2c1 813304141 XDRMVRCPHXHQLP-SFHVURJKSA-N 346.883 5.100 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)s1 1776339615 DWJFFABNOZEYOS-SOFGYWHQSA-N 348.851 5.194 30 20 EKED C=CCNc1nnc(SC(c2ccccc2)c2ccccc2)s1 11393818 KDEIQDLMCKFFNL-UHFFFAOYSA-N 339.489 5.018 30 20 EKED CCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538365 BVPVYYPXMHVGKT-LLVKDONJSA-N 339.247 5.093 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cccc2ccccc12)c1ccccc1 163565363 QIBRLFSFNGLRAP-LJQANCHMSA-N 329.403 5.006 30 20 EKED CC(C)c1nc([C@@H](C)Nc2cccc(OCCCC#N)c2)cs1 186454539 FNRFNNGXVZTVAD-CQSZACIVSA-N 329.469 5.122 30 20 EKED N#Cc1ccc(NC(=O)CCCCCc2cccs2)c(Cl)c1 430359630 NZMMYKZXFGOADB-UHFFFAOYSA-N 332.856 5.015 30 20 EKED CCC(CC)n1ccc(CNc2ccccc2SC[C@H](C)C#N)n1 433502426 PKTSCRCWCLWRSL-OAHLLOKOSA-N 342.512 5.108 30 20 EKED Cc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2ccccc2)cc1 470439549 WKLWDFQERLVZHD-INIZCTEOSA-N 348.475 5.027 30 20 EKED N#Cc1ccccc1-c1ccc(CSc2nnc(C3CC3)s2)cc1 470842000 RCCKVHUFMWSGOU-UHFFFAOYSA-N 349.484 5.246 30 20 EKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1CCC1CCCC1)c1ccccc1 476379278 VCTGCPTWCIGYPS-LEWJYISDSA-N 338.495 5.035 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)Cc1ccc(C#N)cc1 519905062 QMFKTQHEZZGSBY-KRWDZBQOSA-N 332.472 5.383 30 20 EKED N#Cc1ccc(CSCc2csc(-c3ccsc3)n2)c(F)c1 520029458 ZJVFLIOJKXJYGF-UHFFFAOYSA-N 346.477 5.316 30 20 EKED CC(C)CN(C(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(C#N)cc1 525114306 UZYZLIXFFYDZTK-OAHLLOKOSA-N 340.854 5.004 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1cccc(Cl)c1)c1ccccc1 535352962 CDDPJGJCTNYIEE-JXFKEZNVSA-N 339.866 5.363 30 20 EKED C=CCC[C@H](NCc1coc(-c2cccc(F)c2)n1)c1ccccc1 537158588 IQNGMZBZYRVOHG-FQEVSTJZSA-N 336.410 5.278 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC[C@@H](C(F)(F)F)C1 573824736 QKYOUPBRRIXIKD-LSDHHAIUSA-N 339.401 5.456 30 20 EKED CC[C@@H](NC[C@H](Cc1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 581041693 YNCALAHYHYESTA-RBUKOAKNSA-N 346.396 5.020 30 20 EKED N#CCCC[C@H](NCc1ccsc1Br)c1ccccc1 598980211 KQAPESGKAAVQHW-HNNXBMFYSA-N 349.297 5.035 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 612264669 XDQIJIHWHADMPM-NRFANRHFSA-N 348.446 5.130 30 20 EKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(C(C)(C)C#N)cc1 614170670 IQOQORSHGKIQHU-OAHLLOKOSA-N 349.503 5.290 30 20 EKED C=C(C)[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)c(F)c1 614206790 FOVWNYOZBPZQPF-HXUWFJFHSA-N 340.417 5.173 30 20 EKED CCCCc1nc(CON=C(C)CCc2ccc(OC)cc2)cs1 744179534 YSSZKKBWUGEBNQ-UHFFFAOYSA-N 346.496 5.020 30 20 EKED CC(C)c1cnc(COc2ccc(Oc3ccc(C#N)cc3)cc2)o1 748442430 CMILZWLRMBVVOP-UHFFFAOYSA-N 334.375 5.041 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 750683394 SVCUQPJBVFDSRO-BJRSVTDJSA-N 346.817 5.168 30 20 EKED CCCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCC1 759143763 JLCKUCKGCZFACO-FQEVSTJZSA-N 332.447 5.251 30 20 EKED CC(C)(C)C1C/C(=C/c2cncs2)C(=O)/C(=C\c2cncs2)C1 767718874 YDHKSQLTUBAREV-QXFGSWAMSA-N 344.505 5.092 30 20 EKED CCCCCCCC[S@@](=O)Cc1nc(-c2cccs2)oc1C 790138777 GNRWWBWKETUROU-JOCHJYFZSA-N 339.526 5.321 30 20 EKED C=CC[C@@H](C(=O)O[C@@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798671106 XMGICFGSDBPOOJ-XJKSGUPXSA-N 349.352 5.065 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1cc(OC)ccc1Cl 799901318 YOSLVQIWOUXVET-UHFFFAOYSA-N 346.883 5.276 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2c2nc(Cl)c(C#N)s2)cc1 804577591 FBRCIAMHWQBYDG-AWEZNQCLSA-N 331.872 5.133 30 20 EKED Cc1csc([C@H](C#N)C(=O)[C@H](CC(C)C)c2ccc(Cl)cc2)n1 850736418 JTBVTUHYRUUBLX-HZPDHXFCSA-N 346.883 5.111 30 20 EKED CCCC[C@](C)(F)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 850762864 PRHFJDOFPUTXNH-KXBFYZLASA-N 344.455 5.213 30 20 EKED C=CCC[C@H](NCc1cnc(CC(F)(F)F)s1)c1ccccc1 893191958 QWBPCHKSRPDMTC-HNNXBMFYSA-N 340.414 5.045 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C2CC2)c(C)c1 1776784331 WKRSEWYYVNULBD-IBGZPJMESA-N 331.500 5.166 30 20 EKED Cc1ccc(/C(=N\c2ccsc2C(=O)O)c2ccccc2)cc1C 1857777303 FIIMCFFTMBXABP-UZYVYHOESA-N 335.428 5.232 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(-c2nc3ccccc3s2)s1 24457831 AZJSAVWUEKZECW-UHFFFAOYSA-N 342.489 5.063 30 20 EKED CC(C)CCc1nc(CNc2ccccc2SCCC#N)cs1 83140395 KRQLWXYYXBBBEM-UHFFFAOYSA-N 345.537 5.350 30 20 EKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc2ccccc2c1 180066970 AIWUHXXTPZLEEY-UHFFFAOYSA-N 340.426 5.062 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCc1ccccc1 191417672 JTPKAEKEAWFNRN-UHFFFAOYSA-N 336.479 5.245 30 20 EKED C[C@@H](/N=C(/O)C1CCCCC1)C(O)=Nc1ccc(F)c(C2CC2)c1 329840354 OCWXKGZZCTYQMA-GFCCVEGCSA-N 332.419 5.216 30 20 EKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)cc1Cl 352175391 VCDCPFQRCPDGBP-IBGZPJMESA-N 340.854 5.122 30 20 EKED CSc1ccc(OCCS[C@@H](C)c2ccc(C#N)cc2)cc1 437275215 KKHVFNLOKZCDND-AWEZNQCLSA-N 329.490 5.153 30 20 EKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1ccc(C#N)cc1 523391287 IPQAREIWMIJZTL-LJQANCHMSA-N 342.870 5.097 30 20 EKED C=CCN(C(=O)Nc1cccc(CSC2CCCC2)c1)C1CC1 536794040 AXKZSIOSYNNMPH-UHFFFAOYSA-N 330.497 5.045 30 20 EKED CCC(CC)c1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)on1 539175667 YGTSYAPXEXZRBF-UHFFFAOYSA-N 345.468 5.061 30 20 EKED C=CCC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 539356524 CLVXTHITNOYQEL-QGZVFWFLSA-N 330.815 5.045 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1cccc(COC(C)(C)C)c1C 539456410 KTFQINKDOAINCK-HNNXBMFYSA-N 332.488 5.176 30 20 EKED C=CCC[C@@H](N[C@H]1CCCc2nc(CC)sc21)c1ccccc1 540146140 AKJMYNVQXNNEIA-SJORKVTESA-N 326.509 5.380 30 20 EKED N#Cc1cc(Oc2ccc(NCc3cc4ccccc4o3)cc2)ccn1 576197056 STJWILSOJLEUIP-UHFFFAOYSA-N 341.370 5.104 30 20 EKED C[C@H](Cc1cccs1)N(CCCC#N)Cc1ccc(Cl)cc1 611523399 NVHXLQFDIAOHMD-OAHLLOKOSA-N 332.900 5.138 30 20 EKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1ccc2ccccc2n1 613290807 MLPXIWXWAQBULF-HNNXBMFYSA-N 346.386 5.079 30 20 EKED Cc1ccc(-c2nc(/C=C3/CCc4sccc4C3=O)cs2)cc1 726892550 NEWYSEJTPDGJPK-UVTDQMKNSA-N 337.469 5.393 30 20 EKED COc1cc(C)ccc1C(=O)/C=C/c1csc(-c2cccs2)n1 728439779 FPCXVCOVYARQNR-SOFGYWHQSA-N 341.457 5.085 30 20 EKED CC(=NNc1ncc(Cl)cc1Cl)c1ccc(F)cc1Cl 730550402 SLIIOIYUYISICK-UHFFFAOYSA-N 332.593 5.017 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@@H]1c1cccnc1 735632222 ZCRILHLYEHGICS-XMUSRXTASA-N 328.500 5.442 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)s1 765013710 IOPYABRLBZTZQV-CQSZACIVSA-N 336.435 5.277 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C#N)C(C)(C)C)cs2)cc1 765630263 VECBEWWJNMQDHY-INIZCTEOSA-N 342.464 5.029 30 20 EKED C#CC[C@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccccc1 773104744 FSODCPUVURPPRK-ZWKOTPCHSA-N 327.880 5.231 30 20 EKED Fc1cccc(C=NOCc2nc(-c3ccccc3Cl)cs2)c1 774722728 ADBGHAAUOPKGCA-UHFFFAOYSA-N 346.814 5.153 30 20 EKED N#C[C@H]1CC[C@@H](COC(=O)Cc2coc3ccc4ccccc4c23)CC1 809092981 WHBQYXHWDGFZSP-IYBDPMFKSA-N 347.414 5.002 30 20 EKED CC[C@@H](NCc1cn(C(F)F)c2ccccc12)c1ccc(C#N)cc1 858537136 BSWSLNZPUZWTEV-GOSISDBHSA-N 339.389 5.149 30 20 EKED CCC(C)(C)OCc1cccc(N[C@@H](C)c2cc(C#N)ccn2)c1C 902904040 IUEWIRHFYABJKU-INIZCTEOSA-N 337.467 5.140 30 20 EKED COc1cccc(-c2nc(/C=C\C(=O)c3cccc(C)c3)cs2)c1 916153151 BXFQTXKWDFRXJF-KTKRTIGZSA-N 335.428 5.023 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1c[nH]c2ccccc12 920069194 WTIUUMWMKJWRHN-WAYWQWQTSA-N 336.441 5.249 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)cc1F 108408297 BNNOTSPMHSNHJO-QWHCGFSZSA-N 332.419 5.390 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1nc(C(C)(C)C)cs1 121803674 BFRQRPBXTJDKGV-ZDUSSCGKSA-N 345.537 5.304 30 20 EKED COc1c(Cl)cc(Cl)cc1CN[C@@H](CCC#N)c1ccccc1 130472002 NIKMNFBOXJMZKL-KRWDZBQOSA-N 349.261 5.137 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc(Cl)c1 189873659 JTIFMCHZQGIYFG-UHFFFAOYSA-N 328.843 5.148 30 20 EKED N#Cc1ccc(CSc2ncc(C(F)(F)F)cc2Cl)c(F)c1 217459968 PMJUYOBVSUSUOB-UHFFFAOYSA-N 346.736 5.057 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 236787015 BMNRLYAFEBIKMP-SFHVURJKSA-N 332.369 5.064 30 20 EKED N#CCCC[C@H](Nc1nccc(Oc2ccccc2)n1)c1ccccc1 431491898 ZSEGUWVGAFHAHU-IBGZPJMESA-N 344.418 5.116 30 20 EKED COc1ccccc1Oc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1 439551059 NVPKDAQYHBTRRQ-MRXNPFEDSA-N 344.414 5.532 30 20 EKED N#C[C@H]1CC[C@H](Nc2cc(Cl)ccc2SCC(F)(F)F)C1 442856636 OLSZTQQJPSNNCX-ONGXEEELSA-N 334.794 5.099 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 447602144 SQDYCNGTFDGZAQ-SMDDNHRTSA-N 349.297 5.184 30 20 EKED C[C@H](CC(C)(C)c1c[nH]c2ccccc12)NCC(C)(C)CCC#N 462812416 NPBHMWLQCGFWAF-MRXNPFEDSA-N 325.500 5.144 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C 466440273 FQZUUFYGMZVNMP-NEPJUHHUSA-N 326.267 5.041 30 20 EKED Cc1cccc(OC(F)F)c1NCc1ccccc1C(C)(C)C#N 486430283 HERKQQMMDNJSKY-UHFFFAOYSA-N 330.378 5.010 30 20 EKED CCN(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 509584376 CJDNVXDRODKMMK-LBPRGKRZSA-N 347.245 5.088 30 20 EKED CC(C)CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CC1 518466479 GFQLTPWOSMDTSN-UHFFFAOYSA-N 349.434 5.003 30 20 EKED CC1CCC(CC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 523714034 ZXLUBIQTRFYETO-HWOWSKLDSA-N 330.497 5.236 30 20 EKED Cc1cccc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1Cl 535091928 MKEOFGGSNLBTKF-UHFFFAOYSA-N 344.867 5.103 30 20 EKED N#Cc1c(Cl)cccc1SCc1coc(-c2cccs2)n1 536736573 SHVRXJAWBZIYTL-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(OC)cc1OC)c1ccccc1 537945973 HKVHCJRFDMTEQA-UZLBHIALSA-N 325.452 5.062 30 20 EKED Cc1ccc(C)c(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 538645908 IATFVBBCVNLRHE-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C[C@H](Nc1cccc(Br)c1Cl)c1cccc(C#N)c1 600854309 ROIRLDQUVSZLIQ-JTQLQIEISA-N 335.632 5.147 30 20 EKED C[C@H](SCc1cc(C#N)ccc1F)c1ccc(OC(F)F)cc1 609391026 GSZLCYADHVCTFH-NSHDSACASA-N 337.366 5.293 30 20 EKED C=CCC(C)(C)c1noc(Cc2sc(C)nc2-c2cccs2)n1 645627112 CKGLXGXUYQJSHO-UHFFFAOYSA-N 345.493 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C2CCC2)C1 669367351 DLWLIFXXBGOQTP-SFHVURJKSA-N 326.484 5.192 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3ccc(F)cc3s2)n1 673813676 GNHNCBLZIDVSEI-GFCCVEGCSA-N 344.436 5.110 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1cccs1 727267841 STUVJOHOCWWTTH-HJWRWDBZSA-N 329.421 5.215 30 20 EKED O=C(/C=C/c1cnc2ccccn12)c1ccc(-c2ccc(F)cc2)s1 740764955 LKUJNWDHOITISY-CMDGGOBGSA-N 348.402 5.098 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cn1 754690387 TZNWHFGLKDUDPC-ZZXKWVIFSA-N 342.748 5.032 30 20 EKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 784834110 URYIEFWKQMDXKC-UONOGXRCSA-N 347.409 5.214 30 20 EKED CCC/C(C)=C/C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920805500 LPKCHZHAQGTIDT-OBIHZWKSSA-N 346.402 5.011 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1Cl 66801519 ZDUBWOWWVGANOR-LLVKDONJSA-N 348.830 5.126 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cc2ccccc2o1 78481787 CKEVCTABXRLNGT-BQYQJAHWSA-N 337.425 5.514 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(Cl)c1Oc1cccnc1 126067495 BVPJOZPIXDSPBC-UHFFFAOYSA-N 342.826 5.234 30 20 EKED CC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(OC)cc1 360822287 PPRAOJZHXQZAKG-YADHBBJMSA-N 334.463 5.075 30 20 EKED C[C@H](NCc1sc2ccccc2c1Cl)c1ccc(C#N)cc1 386995754 GULPHHLLAWUSRA-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C[C@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccc(C#N)cc1 429433048 VLDBBZMRKFNREJ-ZDUSSCGKSA-N 332.369 5.571 30 20 EKED N#CCC1(CN[C@H](c2ccccc2)c2cccc3ccccc23)CC1 430750196 MUUCOWITVGLYMY-JOCHJYFZSA-N 326.443 5.213 30 20 EKED CC(C)CC[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458806828 WOQNDFPDOAWVPL-UXHICEINSA-N 341.499 5.032 30 20 EKED Cc1sc(NC(=O)CSc2ccc(C(C)C)cc2)c(C#N)c1C 479249544 ROWHBCKFCJFBMC-UHFFFAOYSA-N 344.505 5.091 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccc(F)cc1C#N 488557760 VNQWGOAHPBGROQ-UHFFFAOYSA-N 344.436 5.156 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1oc2ccccc2c1C 517689106 FEBDFNZIBLZAKO-KRWDZBQOSA-N 348.446 5.200 30 20 EKED CN(CC1CCCC1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 521209588 BDEOTTKJJRGPQY-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)Cc1ccccc1C#N 521815438 GYBSUAZUTPZWEM-QGZVFWFLSA-N 332.472 5.383 30 20 EKED N#CCc1ccc(C(=O)Nc2ccc(SC3CCCC3)cc2)cc1 536240969 UOQKZTKPYXUOOB-UHFFFAOYSA-N 336.460 5.040 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 551210132 WFZTWZDSANRMIM-IFXJQAMLSA-N 347.289 6.079 30 20 EKED Cc1c([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)oc2ccccc12 594920885 BJSCIAWEVBKFSG-INIZCTEOSA-N 330.431 5.147 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@@H](C#N)c1ccc(Cl)cc1 595414567 FFOXWHNZESIHPJ-KSSFIOAISA-N 328.843 5.043 30 20 EKED N#CCc1ccc(NC(=O)CC2CCC(c3ccccc3)CC2)cc1 609371602 HAXYPKJMRSTOAW-UHFFFAOYSA-N 332.447 5.055 30 20 EKED COc1ccc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)cc1C#N 742374302 MQFISAWWECGHSE-LJQANCHMSA-N 342.870 5.097 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 768388061 DTUMNRWLXUHTOU-MSOLQXFVSA-N 337.463 5.084 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc(O)c(Cl)c1 768751585 HEMVSWUJIBPINW-XQRVVYSFSA-N 347.848 5.127 30 20 EKED CCCCCCCC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1 781842752 RJZUPTDEEPWKRB-UHFFFAOYSA-N 342.483 5.203 30 20 EKED CCCCCCCC(=O)Nc1ccccc1-c1nc2ccccc2[nH]1 791099127 CHNCUALJZMYOBM-UHFFFAOYSA-N 335.451 5.529 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1nc2ccccc2o1)c1ccc(F)c(F)c1 187774006 QJCUWXKRLJSIPV-KPZWWZAWSA-N 328.362 5.074 30 20 EKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2)nnc1-c1ccccc1 255927505 WIJBWGJAKMTGAI-AWEZNQCLSA-N 339.439 5.124 30 20 EKED CN(Cc1cccc2ccccc12)C(=O)Nc1ccc(C#N)cc1Cl 426145135 YDFZKCIWQNWNHU-UHFFFAOYSA-N 349.821 5.029 30 20 EKED C[C@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 429463208 BELZSZICGJOPLJ-MAUKXSAKSA-N 349.434 5.003 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(C(F)(F)F)cc1 439428925 GVNBZRGDDZBCBM-NSHDSACASA-N 338.760 5.081 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1ccc(SCC(F)F)cc1 442871606 XBEHBCYWBSFQMR-NFOMZHRRSA-N 338.467 5.024 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1CC 479971604 SMQOEZYIOWDAKT-UHFFFAOYSA-N 334.872 5.184 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 523022084 IULCWGLTVGTUMF-UHFFFAOYSA-N 330.378 5.062 30 20 EKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 550831235 UQEASSWSSHFIKR-BEFAXECRSA-N 342.870 5.434 30 20 EKED COc1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)c2ccccc12 556597013 TVVYUXYTRHTEJI-MRXNPFEDSA-N 342.442 5.060 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cc(C)cc(C)c2)c1 727284820 MFHNFMACHPOJHW-UHFFFAOYSA-N 326.465 5.067 30 20 EKED CCC(CC)CN(CCC#N)C(=S)Nc1ccc2ccccc2c1 729643052 YSTIWIAGSNEWGL-UHFFFAOYSA-N 339.508 5.188 30 20 EKED CCCCCCCCCN(C)C(=O)c1nc(C(C)C)ncc1Cl 743636830 HAPZNUFXUGVKDL-UHFFFAOYSA-N 339.911 5.076 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc3ccc(C)cc3o2)c1 756043714 UHMUHQGZWMLOON-LPHOPBHVSA-N 348.446 5.273 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(OC(C)(C)C)cc2)cc1 764921344 RXNIAYXBDKCZDM-SNQWNFELSA-N 349.430 5.051 30 20 EKED CCCC(=CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)CCC 771260389 GRLWRGTXDSFRFJ-CQSZACIVSA-N 345.393 5.134 30 20 EKED CC[C@@H](CC#N)NC(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 771752596 CORRQSDYQBDEDI-KRWDZBQOSA-N 341.842 5.129 30 20 EKED C#CC[C@H](N[C@H](C)c1cc(C)ccc1OC(F)F)c1ccccc1 773106951 NHLFGESNVKXICW-QAPCUYQASA-N 329.390 5.012 30 20 EKED C[C@H](C#N)Oc1ccccc1NCCCOc1cccc2ccccc12 779745721 GGJMEMVPRYJAGU-QGZVFWFLSA-N 346.430 5.012 30 20 EKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1coc(C(C)C)n1 799473543 IDYCRLDWAZWVGD-UHFFFAOYSA-N 342.830 5.144 30 20 EKED N#CCSc1ccccc1C(=O)Nc1ccc(-c2ccccc2)cc1 911608680 DUCXHBNAPPUQCE-UHFFFAOYSA-N 344.439 5.222 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCCc2ccccc21 920063082 YMCNRIJESAQJRF-UVTDQMKNSA-N 337.469 5.474 30 20 EKED CCC/C(C)=C\C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 920224826 NCAVKHIBKVNSMU-QINSGFPZSA-N 334.419 5.344 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(CC2CCC2)c1 1776783690 DRQJOGBOPNTQMH-NRFANRHFSA-N 345.527 5.323 30 20 EKED CCN(Cc1csc(CCC(C)C)n1)[C@@H](C)c1ccc(C#N)cc1 65041259 PLAUPGNICHBCRM-INIZCTEOSA-N 341.524 5.186 30 20 EKED N#Cc1ccc(-c2csc(-c3ccc(Br)s3)n2)cc1 70213210 KHUGCDYZGCYNAG-UHFFFAOYSA-N 347.262 5.173 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc2ccccc2o1 96291573 SYADMQBJVBXBOC-WAYWQWQTSA-N 337.425 5.514 30 20 EKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)N[C@H](CCC#N)c2ccccc2)c1 151288828 UFKXKWGPWSODIZ-WIYYLYMNSA-N 349.478 5.051 30 20 EKED CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 159296746 KDICODRPZHKJLI-JKSUJKDBSA-N 345.512 5.267 30 20 EKED N#CCCC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccc1 340445184 LSTZDBAOFJJRJW-XZOQPEGZSA-N 343.474 5.351 30 20 EKED Cc1cc(CN[C@@H](CCC#N)c2ccccc2)ccc1C(F)(F)F 414358503 GXEXATZWXOWCBZ-SFHVURJKSA-N 332.369 5.149 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 417361583 JDGVUFJCVSBHQR-ACJLOTCBSA-N 339.508 5.175 30 20 EKED N#Cc1ccc(CSCc2coc(-c3cccs3)n2)c(Cl)c1 438877224 OYERGRHCCMHKBA-UHFFFAOYSA-N 346.864 5.362 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC(C)(C)C1 475550892 SMGDQMNEWWTPKH-MRXNPFEDSA-N 328.500 5.438 30 20 EKED C=C(C)[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(F)c(F)c1 481620543 INTJBFZKJUKCTC-QGZVFWFLSA-N 336.451 5.126 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(OCCC)c1 485463188 IVRJPBSOERNDCG-UHFFFAOYSA-N 327.449 5.006 30 20 EKED C[C@@H](N[C@H](COc1ccccc1)c1ccccc1)c1cccc(C#N)c1 540609557 UPJZSCZJEGUNRM-WZONZLPQSA-N 342.442 5.029 30 20 EKED CC(C)[C@@H](NCc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)cc1 544120185 ITDYOZFEQSLCRZ-LJQANCHMSA-N 346.396 5.258 30 20 EKED CCSc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)cc1 578556287 RUDOPXGHUSJOEK-KRWDZBQOSA-N 349.459 5.089 30 20 EKED N#C[C@@H](N[C@@H](COCc1ccccc1)c1ccccc1)C1CCCCC1 583328797 DBIAIOWEGPWIDH-PKTZIBPZSA-N 348.490 5.007 30 20 EKED CCCC[C@@H](CC)CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609435450 OOWJGOHXCAQZJA-JKSUJKDBSA-N 347.528 5.419 30 20 EKED C[C@@H](SCc1csc(C2CCCC2)n1)c1ccc(C#N)cc1 609825590 HFZVOHGIEUGIQI-CYBMUJFWSA-N 328.506 5.667 30 20 EKED CCCCC[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1 728133470 HFVGWXWTMBMNQO-NRFANRHFSA-N 349.478 5.021 30 20 EKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 736348801 YBMSFFQEONIEOF-MRXNPFEDSA-N 346.405 5.449 30 20 EKED Cc1sc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)c(C#N)c1C 746091234 QWYLRJAHZLHZEN-UHFFFAOYSA-N 344.439 5.060 30 20 EKED COc1cc(C)ccc1C(=O)/C=C\c1csc(-c2ccccc2)n1 797285203 NFPJSCPAPFAQBN-LUAWRHEFSA-N 335.428 5.023 30 20 EKED CCC(CC)N(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 808815416 DZNCEEUJFVEPDY-OAQYLSRUSA-N 349.478 5.384 30 20 EKED Cc1ccc(N(CC(C)C)C(=S)Nc2ccccc2C#N)c(C)c1 844568791 DGNIAAPJKCEOSI-UHFFFAOYSA-N 337.492 5.035 30 20 EKED FC(F)(F)c1ccccc1ON=C[C@@H]1CCC[C@H](C(F)(F)F)C1 853324429 GDNYERZQITUJMW-MNOVXSKESA-N 339.279 5.439 30 20 EKED COc1cccc(/C=C/C(=O)c2ccc(SC)cc2)c1OC(C)C 916133434 OGGFJXDPKUZEBY-JLHYYAGUSA-N 342.460 5.100 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1csc(C2CC2)n1 920356387 KHXVCDVFYYXFPX-UHFFFAOYSA-N 333.460 5.061 30 20 EKED O=C(O)c1ccc(/C=C\C(=O)c2ccc3ccccc3c2)c(Cl)c1 1776131106 HUYQKOYFZGRCJP-KTKRTIGZSA-N 336.774 5.088 30 20 EKED C=CCC[C@@H](CC(C)C)C(=O)Nc1ccc2sc(C(=O)O)cc2c1 1776165772 CCKSIBLTPGFESM-ZDUSSCGKSA-N 345.464 5.167 30 20 EKED C[C@H](Sc1cccc(C#N)c1)c1nnc(-c2cccc(Cl)c2)o1 158747027 LYXGXLJGQIIAKZ-NSHDSACASA-N 341.823 5.115 30 20 EKED CC[C@H](C(=O)Nc1cc(C#N)ccc1C)c1cccc(C(F)(F)F)c1 437546414 JXAGXBLBGYHEGD-INIZCTEOSA-N 346.352 5.018 30 20 EKED C=C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)CC1 468913521 KDAIXUKSUMTSLM-UHFFFAOYSA-N 345.801 5.064 30 20 EKED C=C[C@H](CC(=O)N(CCC)[C@@H]1CCCc2cccnc21)c1ccccc1 475953221 HPDUMYQRQXUZLJ-WIYYLYMNSA-N 348.490 5.058 30 20 EKED CC[C@H](C)n1c(SCc2cccc(C#N)c2)nnc1-c1ccccc1 504283124 ZCIAQDKXQQWAAL-HNNXBMFYSA-N 348.475 5.080 30 20 EKED CCN(C(=O)c1ccc(Cl)c(Cl)c1)[C@H](C)c1ccc(C#N)cc1 509584372 CJDNVXDRODKMMK-GFCCVEGCSA-N 347.245 5.088 30 20 EKED CC(C)[C@@H](NCc1ccccc1C#N)c1ccc(C(F)(F)F)cc1 537125934 OAAXYLHIKLWQFP-GOSISDBHSA-N 332.369 5.064 30 20 EKED C=CCC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 539356523 CLVXTHITNOYQEL-KRWDZBQOSA-N 330.815 5.045 30 20 EKED N#C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(Cl)cc1 585718055 XHWGPSBEMWCIIT-RBUKOAKNSA-N 328.818 5.175 30 20 EKED N#CCCC[C@@H](NCc1cc2cc(Cl)cnc2o1)c1ccccc1 590654515 WWMMWFQFFLQXSZ-GOSISDBHSA-N 339.826 5.006 30 20 EKED CC(C)c1ccc(CCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 603755040 KFRKBBWUPKVKAY-UHFFFAOYSA-N 334.463 5.182 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccccc2CC(F)(F)F)cc1 614058555 CTHOFLZHJZYPEJ-UHFFFAOYSA-N 332.369 5.205 30 20 EKED Cc1cc(C)c(NN=Cc2ccccc2OCc2ccncc2)c(C)c1 743445369 RJOMRVUYZLRJLP-UHFFFAOYSA-N 345.446 5.032 30 20 EKED COc1cc(/C=C\C(=O)c2cc3ccc(C)cc3o2)cc(Cl)c1O 754825934 SQHBASDUUWQTTK-XQRVVYSFSA-N 342.778 5.005 30 20 EKED CC1(C)CCC[C@@H](CC(=O)[C@H](C#N)c2nc3ccccc3s2)C1 756506084 SUVRQOMPUDWFNY-KBPBESRZSA-N 326.465 5.079 30 20 EKED CCCCCC[C@](C)(CC)C(=O)Nc1ccc(F)cc1OCC#N 760785432 ANCBWKNBXJKHNT-IBGZPJMESA-N 334.435 5.053 30 20 EKED O=C(/C=C\c1nccn1Cc1ccccc1)c1cc2ccccc2s1 780188330 LSOPSIDPIJSSLY-KHPPLWFESA-N 344.439 5.042 30 20 EKED FC(F)(F)c1csc(NN=C2CC(c3ccc(Cl)cc3)C2)n1 783855692 PLLJLTHJKUSBOB-UHFFFAOYSA-N 345.777 5.161 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(Cl)c(F)c1 789146660 AVVNGRKNUZYJJJ-GQCTYLIASA-N 333.771 5.092 30 20 EKED O=C(/C=C\c1sccc1Br)c1c(F)cccc1Cl 809158924 FSOVGBHTJPWNDY-PLNGDYQASA-N 345.620 5.199 30 20 EKED CC(=NNc1nccc2sccc12)c1ccccc1C(F)(F)F 915978083 BACHBLZSRYKBFX-UHFFFAOYSA-N 335.354 5.151 30 20 EKED CCCCCCCCC[C@@H](C)CC=NNc1ccccc1C(=O)O 1776030542 NJHGOBTZYJTEIR-QGZVFWFLSA-N 332.488 5.949 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(-c2ccncc2)c1 90665485 XQCUSJLZYNRKKD-FDDCHVKYSA-N 341.458 5.444 30 20 EKED Cc1cc2nc(/C=C/c3ccc(O[C@H](C)C#N)cc3)sc2cc1C 110655634 HSHKDJCLEPELLI-RZIFZGNASA-N 334.444 5.374 30 20 EKED CC(C)(C)[C@H](NCc1ccc(C#N)o1)c1cccc(C(F)(F)F)c1 179431677 YXXRBCXAMBCVQZ-MRXNPFEDSA-N 336.357 5.047 30 20 EKED C=CC[C@H](C)[C@@H](C)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 246218831 YPWGKTBETKYBHW-HOOSLVGPSA-N 341.520 5.148 30 20 EKED C[C@@H](Sc1nc2ccccc2n1C(F)F)c1ccc(C#N)cc1 303702608 OHUFWXQIGNGNNX-LLVKDONJSA-N 329.375 5.156 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1Cl 320934102 GDXJTFDFRYNLPH-CYBMUJFWSA-N 349.261 5.849 30 20 EKED O/C(=N/C1CCC(C(F)(F)F)CC1)c1coc(C2CCCCC2)n1 328756851 UPKXQBCOEGTGQZ-UHFFFAOYSA-N 344.377 5.148 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 328984023 FYAJGHRRWUKLLC-CWRNSKLLSA-N 332.419 5.628 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)c1ccc(-c2ccccc2)cc1 414283418 FMYAIYPZGIULRQ-HSZRJFAPSA-N 325.477 5.181 30 20 EKED CC(=O)c1c(C)cc(C)c(CN[C@@H](CCCC#N)c2ccccc2)c1C 433010829 CWUXRBJQNWJNMN-QFIPXVFZSA-N 348.490 5.339 30 20 EKED Cc1ccc(-c2cc(CN[C@@H](CCCC#N)c3ccccc3)on2)cc1 433012720 LNVGEZDFOODZKF-NRFANRHFSA-N 345.446 5.175 30 20 EKED C=CC[C@@H](CC)NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 439420692 ZMSJGDBCLKIJPM-CYBMUJFWSA-N 328.378 5.003 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cccc(Cl)c1Cl 439462252 OPFNGFSEWHNJDU-JTQLQIEISA-N 339.653 5.369 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 439571900 OEABIQABOSCMIV-ROUUACIJSA-N 342.442 5.762 30 20 EKED C[C@H](C#N)C(=O)Nc1ccc(Cl)cc1-c1cccc2ccccc12 447631164 XZQAHCQWOUJVSP-CYBMUJFWSA-N 334.806 5.258 30 20 EKED N#CC[C@@H](CC(=O)N1CCCC2(CCCCC2)CC1)c1ccccc1 476938910 ITKWUFHUAOGBQD-FQEVSTJZSA-N 338.495 5.037 30 20 EKED C=C(C)[C@H](NC(=O)Nc1c(C)cc(C)cc1C)c1ccc(F)c(F)c1 479786521 USMZVKSQKIVVQE-SFHVURJKSA-N 344.405 5.329 30 20 EKED N#CCCCCN[C@H](CCc1ccccc1Cl)c1ccccc1 482461465 SFEBKVLXJQFAPW-HXUWFJFHSA-N 326.871 5.297 30 20 EKED N#CC[C@@H](CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 483040423 MDDJWMRMDOEXDY-ZDUSSCGKSA-N 333.218 5.019 30 20 EKED CCCCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)C1CCCCC1 510581679 AGFQCGULQJBPGE-UHFFFAOYSA-N 344.503 5.081 30 20 EKED C[C@H](CCc1ccc(Cl)s1)N[C@@H](CCCC#N)c1ccccc1 522018819 GEXJIGUJRJNJFR-QAPCUYQASA-N 346.927 5.747 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccc(Cl)s2)cc1 536889044 FOGPDKBUCZLLPU-UHFFFAOYSA-N 338.863 5.230 30 20 EKED C=CCC[C@H](NCc1csc(C2CCCC2)n1)c1ccccc1 538258507 ZFVOYAYKLRTMMQ-IBGZPJMESA-N 326.509 5.598 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 539052274 TWDRPIKUKLONIF-ACJLOTCBSA-N 333.262 5.689 30 20 EKED Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c(F)c1 539789065 MBKZESKPGBDVBX-UHFFFAOYSA-N 346.361 5.050 30 20 EKED N#Cc1ccc(Oc2ccc(Oc3nccc(C#N)c3Cl)cc2)cc1 557630534 RWQHVEHZJSRURD-UHFFFAOYSA-N 347.761 5.063 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C)(C2CC2)CC1 558496664 ANXAEMXIGJFMQQ-UHFFFAOYSA-N 340.511 5.583 30 20 EKED CCc1cc(C#N)c(NC(=O)c2ccc3c(c2)Cc2ccccc2-3)s1 604028781 OELKRNRSKVEHLA-UHFFFAOYSA-N 344.439 5.006 30 20 EKED N#C[C@H](NC(=O)CCC1CCCCC1)c1ccc(Cl)c(Cl)c1 609460549 PTNWHVYYSWOHLF-INIZCTEOSA-N 339.266 5.035 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1F 612204211 OLNYTHSZIFXTHW-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 728764615 SZBBXVLYIOJKMT-IRXDYDNUSA-N 348.471 5.302 30 20 EKED O=C(/C=C\c1ccnc2ccccc12)c1cccc(C(F)(F)F)c1 731835506 GNABFVAAZVIFOR-HJWRWDBZSA-N 327.305 5.150 30 20 EKED CCC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)C1CC1 741163632 OJBPGAWHBUPKFU-UHFFFAOYSA-N 340.427 5.085 30 20 EKED CC1(C)CCC[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C1 756516256 GEGDEXCHFXTDLB-HZPDHXFCSA-N 338.476 5.203 30 20 EKED C=CCC(CC=C)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 758509909 LNMOPSBJXNBYTN-KRWDZBQOSA-N 336.460 5.063 30 20 EKED C=C[C@@H](CC(=O)O[C@@H](c1ccccc1)c1ccncc1)c1ccccc1 759275451 MEYRBQPYVLSITD-MBSDFSHPSA-N 343.426 5.074 30 20 EKED CC(=NNc1cccc2ccccc12)c1nc(C(F)(F)F)cs1 767380427 RIOGFJVGZHXALV-UHFFFAOYSA-N 335.354 5.151 30 20 EKED CCC(C)(CC)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 767966395 PRJGZCUVEUCPLO-LLVKDONJSA-N 348.418 5.091 30 20 EKED CCC(F)(F)c1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1 828990926 JPKSIYPAMOXJBG-MRXNPFEDSA-N 342.389 5.214 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(O[C@@H](C)CC)c1 63164638 GVFFXBLDEQGNMR-HNNXBMFYSA-N 344.480 5.146 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2c1 97465037 YGJCTCBIPURUGW-QGZVFWFLSA-N 330.431 5.695 30 20 EKED C[C@H](SCc1csc(-c2ccccn2)n1)c1ccc(C#N)cc1 118444217 XVDFWVDDXXXLLI-ZDUSSCGKSA-N 337.473 5.071 30 20 EKED C=C(C)[C@@H](NCc1ccc(SC)c(OC)c1)c1ccc(F)c(F)c1 187368810 QUQZCUDCYNEGLX-LJQANCHMSA-N 349.446 5.102 30 20 EKED C/N=C(/O)c1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1C 328974688 BBBMLNGKANCNLA-BHYGNILZSA-N 328.456 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)nc1C 410756834 XTOCGFFRAAPJOF-UHFFFAOYSA-N 336.479 5.618 30 20 EKED Cc1nc(CNc2cccc(Oc3ccc(C#N)cc3)c2)c(C)s1 443465189 GGNDPAQKIRZEJQ-UHFFFAOYSA-N 335.432 5.036 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 467606188 SVFFXYFYEFTPQZ-UXHICEINSA-N 337.438 5.420 30 20 EKED C=CCCC1(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)CC1 474430117 YNJXGLFTWVQBEB-UHFFFAOYSA-N 349.434 5.016 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC(C)(C)OC1(C)C 475548422 QNNOUYVCSLIFDU-KRWDZBQOSA-N 344.499 5.006 30 20 EKED CC1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 497770881 CCUYQFXSANCBFD-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2F)nnc1-c1ccccc1 501575471 OSVCVRHHTPYREE-CQSZACIVSA-N 339.439 5.124 30 20 EKED Cc1ccc(-c2ccc(CN(CCC#N)Cc3cccnc3)s2)cc1 505913915 XRFFZUHWPOEAIW-UHFFFAOYSA-N 347.487 5.034 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 511825628 PMGMIRSZZUJASU-IRXDYDNUSA-N 338.417 5.261 30 20 EKED N#Cc1cnc(Oc2ccc(OC3CCCCC3)cc2)c(Cl)c1 513615197 OHCLRWUOIXYLGG-UHFFFAOYSA-N 328.799 5.110 30 20 EKED CCN(C(=O)c1cccc(-c2ccoc2)c1)[C@H](C)c1ccc(C#N)cc1 535528588 ISPKGYUXRUHYKE-MRXNPFEDSA-N 344.414 5.042 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)c(Cl)c1C 543079041 VZOKSQSSDMPNCA-UHFFFAOYSA-N 344.867 5.215 30 20 EKED C=CCC(C)(C)c1noc(-c2c(-c3ccccc3Cl)noc2C)n1 551497611 VPCCCLKMBHFREQ-UHFFFAOYSA-N 343.814 5.207 30 20 EKED C[C@@H](CC#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 597132723 VBFHHFSWGLZWNK-UONOGXRCSA-N 341.842 5.001 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1 605166554 ZWEQBSFJMMAAFD-CYBMUJFWSA-N 336.262 5.409 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(Cl)cc1 609387256 VKZHFAVUCWNGQO-UONOGXRCSA-N 330.884 5.765 30 20 EKED C[C@H](Nc1ccccc1COCc1ccccc1)c1ccc(C#N)cc1 609824984 FDQZIRVYPJPXES-SFHVURJKSA-N 342.442 5.448 30 20 EKED Cc1c(Cl)cc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1Cl 610325298 ZQJOYTWPYILMQM-NSHDSACASA-N 348.233 5.056 30 20 EKED CC[C@@H](C)n1ncc(N[C@@H]2CCCc3cc(C#N)ccc32)c1C1CC1 611477228 ABDGWFKYYCJNTD-AUUYWEPGSA-N 334.467 5.093 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@@H]1c1cc(C)no1 737801420 CDCZOZBRWSBRRF-DEQJRXDXSA-N 332.488 5.343 30 20 EKED Cc1ccc(Oc2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2)nc1 743476581 LMYUNGTUHQVKRY-MRXNPFEDSA-N 329.403 5.227 30 20 EKED C#CCC(C)(C)C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 767092704 YCLGWBPAEYXFCJ-UHFFFAOYSA-N 344.414 5.015 30 20 EKED CCC[C@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@H](C)C#N 780156051 COFHZUOTWOVGFK-SJLPKXTDSA-N 342.483 5.303 30 20 EKED CCC(=NNc1nccc2sccc12)c1ccc(OC(F)F)cc1 915980220 QHVOHVZDTYWUCL-UHFFFAOYSA-N 347.390 5.124 30 20 EKED O=C(O)c1cccc(/C=C/C(=O)c2cccc3ccccc23)c1Cl 1776114664 WJRZLBRCZVQBRE-VAWYXSNFSA-N 336.774 5.088 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 210334382 YTRUCUOHYRBHOS-CLFYSBASSA-N 339.372 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)cn1 276497033 WIGDAMBRRBDINR-UHFFFAOYSA-N 348.368 5.205 30 20 EKED N#Cc1csc(C(=O)Nc2ccccc2Sc2ccccc2)c1 437425044 HXHTUZQIRBTSTO-UHFFFAOYSA-N 336.441 5.023 30 20 EKED C[C@H](S[C@@H](C)c1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 443142520 PPVHQDISROMLLX-GJZGRUSLSA-N 334.444 5.769 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COC/C=C/c1ccccc1 476141060 IPRKIDGVAHRSCY-UKTHLTGXSA-N 349.474 5.207 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cc(F)c(F)c(F)c1)c1ccc(F)c(F)c1 480667161 FXTZRYFKQJFATF-MGNBDDOMSA-N 341.323 5.350 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)c(F)c1 489889971 XMVPRXZGWMSSSO-UONOGXRCSA-N 336.385 5.401 30 20 EKED CC(C)c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 521420694 WCDOZKDOEHXVCE-UHFFFAOYSA-N 335.451 5.124 30 20 EKED Cc1ccc(F)c(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 538690658 YCEUIOXOABCVJE-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC(CC#N)CC2)c(C(C)C)c1 541043811 YXVMLKACZJHQCE-UHFFFAOYSA-N 327.472 5.091 30 20 EKED CCCc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609377931 RUXOPHGHJZKNRV-OAHLLOKOSA-N 338.476 5.143 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@]12CCCC[C@@H]1C2(F)F 613902278 ZATIJLYCPOSKOT-FXAWDEMLSA-N 347.449 5.693 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(C(F)(F)F)c1 614179852 PKWWRZAYUQJFCR-AWEZNQCLSA-N 346.396 5.357 30 20 EKED CC(=NNc1ccc(C)nn1)c1ccc(-c2ccc(Cl)cc2)s1 729935976 ZVYBOGFFNFAWMD-UHFFFAOYSA-N 342.855 5.003 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cc(Cl)ccc1Cl 740764182 NJNIMYFHFIHUMD-BQYQJAHWSA-N 328.198 5.438 30 20 EKED C[C@@H]1CCC[C@@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 741537422 DMKSGTOGAJHVDT-OZOXKJRCSA-N 332.447 5.107 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCc2cc(F)ccc21 747439462 FQFIIELLZORNAB-WQLSENKSSA-N 341.432 5.223 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(C#N)s1 749371131 JQLVNNNELJNURM-UHFFFAOYSA-N 330.478 5.071 30 20 EKED C[C@H]1C/C(=C\c2ccc(Oc3cnccn3)cc2)C(=O)c2ccccc21 751535904 NGZSDMCEDXPIAU-XOAFGZPJSA-N 342.398 5.042 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(Cl)nc3)s2)cc1 759081923 CYTGQYABYXVUCA-BQYQJAHWSA-N 340.835 5.063 30 20 EKED CC(C)c1cnc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 782523841 MDEOKGZKRIBQSN-INIZCTEOSA-N 345.446 5.187 30 20 EKED CCCC[C@H](CC)CCCN(C)C(=S)Nc1ccccc1C#N 853054956 DGKGMXDHLNMTGC-INIZCTEOSA-N 331.529 5.183 30 20 EKED Cc1ccc(-c2ccccc2NCc2ccc(C#N)cc2[N+](=O)[O-])s1 864033515 VIGRWPMPODHLSZ-UHFFFAOYSA-N 349.415 5.116 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1c[nH]c2ccccc12 915271688 QCGAOSNHDMHTCL-KTKRTIGZSA-N 348.402 5.327 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)cc1 916140249 HRIMSQOQCYDSPO-XFXZXTDPSA-N 349.336 5.209 30 20 EKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccccc2)cc1OC 916545476 KGPHEBIHZYLDAC-MDZDMXLPSA-N 330.811 5.034 30 20 EKED Clc1ccccc1CNN=Cc1c(Cl)ccc(Cl)c1Cl 918153456 VELLIPPHPFLVFO-UHFFFAOYSA-N 348.060 5.424 30 20 EKED O=C(/C=C/c1cc(Br)cs1)c1ccc(Cl)s1 6339850 XXLONZAPNUHLRT-OWOJBTEDSA-N 333.659 5.122 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc2ccccc12 51472112 DTSABWOTPHXCSF-UHFFFAOYSA-N 343.430 5.156 30 20 EKED C=CCOc1ccc(CN[C@@H](CC)c2cccc(Cl)c2)cc1OC 60524158 JLXOZYODIXUUDI-SFHVURJKSA-N 345.870 5.154 30 20 EKED N#Cc1cccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 67253629 JAIVWCIZPOYUPC-LJQANCHMSA-N 338.863 5.152 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1 174067385 HHTJAXOPIUKPGL-CABCVRRESA-N 333.460 5.094 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)ccc2CC1 329191914 RROKIGFIZNGZLP-KBRIMQKVSA-N 326.440 5.415 30 20 EKED CCCCCCCCC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 377441185 DYSMHEDFCVNYLM-QGZVFWFLSA-N 347.503 5.141 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)S[C@@H](C)c3cccc(C#N)c3)o2)cc1 419467149 RWUGBMJPRWZNNM-LSDHHAIUSA-N 349.459 5.472 30 20 EKED N#C[C@H]1CC[C@@H](Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 442860816 SRCJVBLUFXFAQW-MAUKXSAKSA-N 326.827 5.023 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@H]1C(C)C 455245976 MFGQEWIOROVUDZ-HXUWFJFHSA-N 340.511 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C 475552844 JCFASMGRSKEXOZ-KPFFTGBYSA-N 340.511 5.723 30 20 EKED C(#Cc1ccccc1)CSc1nnc(-c2ccc3ccccc3c2)o1 478550160 OEKITYXXIMKFFM-UHFFFAOYSA-N 342.423 5.034 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC(CC(F)(F)F)CC1 500176733 KTROCWZCWGCOPI-UHFFFAOYSA-N 340.389 5.002 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 511825598 PMGMIRSZZUJASU-DLBZAZTESA-N 338.417 5.261 30 20 EKED Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1ccc(C#N)cc1F 512289327 SCFSWRIXECPXSB-OAHLLOKOSA-N 340.442 5.494 30 20 EKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C#N)cc2)c1 522755337 FXCCUPKGXSLGLN-FQEVSTJZSA-N 333.435 5.016 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)CCC=C2 551507397 QAFGQURLSSRMJV-HNNXBMFYSA-N 348.471 5.150 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cc(C)on1)c1ccc(C(F)(F)F)cc1 569654118 YZELVQHMODXYJE-CZUORRHYSA-N 338.373 5.360 30 20 EKED Cc1cccc(N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 572659847 RBMQQVNNJNIXCC-OAHLLOKOSA-N 339.464 5.058 30 20 EKED C[C@@H](Oc1ccccc1NCc1ccccc1C#N)c1ccccc1 609671174 GMUKNNAKHDYSLU-QGZVFWFLSA-N 328.415 5.310 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 756058279 KNBUFNVITORINZ-JWNTYJGQSA-N 343.474 5.036 30 20 EKED C=CC[C@@H](NCc1ccc(-c2ccccc2)cc1OC)c1ccncc1 781413650 HBVRHXDCPCQKRW-JOCHJYFZSA-N 344.458 5.164 30 20 EKED Cc1cccc([C@H](NCc2cc(C#N)ccc2F)c2cccc(F)c2)c1 800975271 ZKADDPDWMCMKJJ-QFIPXVFZSA-N 348.396 5.024 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1c(F)cccc1Cl 809159903 ZBHWUYPNGPASAQ-SREVYHEPSA-N 333.771 5.092 30 20 EKED CC[C@H](NCc1cn(C(F)F)c2ccccc12)c1ccc(C#N)cc1 858537139 BSWSLNZPUZWTEV-SFHVURJKSA-N 339.389 5.149 30 20 EKED Clc1cccc(-c2ccc(C=Nn3cnc4ccccc43)s2)c1 914695002 AIDQMFSYIHHAHK-UHFFFAOYSA-N 337.835 5.300 30 20 EKED O=C(O)c1ccc(/C=C/C(=O)c2cccc3ccccc23)c(Cl)c1 1776114188 IOYLCWSLTXWKQT-ZHACJKMWSA-N 336.774 5.088 30 20 EKED C=CCn1c(S[C@@H](C)c2cccc(F)c2)nnc1-c1ccoc1C 59832590 DEWOBNPQRSWRIM-ZDUSSCGKSA-N 343.427 5.025 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2n1 179824969 ATWSIPNURBLIRK-INIZCTEOSA-N 331.419 5.090 30 20 EKED CCC(CC)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccs1 236703669 DPELSCDOUJZQRR-YWZLYKJASA-N 342.508 5.306 30 20 EKED OC(=Nc1cc(N=C(O)[C@H]2CCCOC2)ccc1F)C1CCCCC1 328897497 XKWZIPZMVDROCP-AWEZNQCLSA-N 348.418 5.009 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cc(Cl)ccc1F)c1ccccc1 432632801 NCDTYOWKRKNYMS-MRXNPFEDSA-N 345.805 5.036 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C1CCCCC1 438047783 DVUIBUFXUVADMS-HUUCEWRRSA-N 345.512 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc2ccc(OC)cc12 440883498 SRQQLXVPIXTPHU-UHFFFAOYSA-N 349.430 5.546 30 20 EKED C[C@@H]1CCC[C@@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 482542055 FJQIEMNCVDALBI-VQIMIIECSA-N 348.446 5.001 30 20 EKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1Cl 483223206 AULXTVGIEZBVMT-SFHVURJKSA-N 348.833 5.502 30 20 EKED C/C=C\c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 497366069 ILHTWSMQJNMYQU-PLNGDYQASA-N 333.435 5.034 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1 538394588 GNNLERXLMKQBFQ-ORAYPTAESA-N 328.406 5.274 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(OC(C)C)cc1F 547944068 GLBUDPQVNUXMMH-UHFFFAOYSA-N 345.439 5.143 30 20 EKED C/C=C\c1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 570714967 JDAHUKNRXCLBJG-UQCOIBPSSA-N 343.430 5.230 30 20 EKED CCc1cc(C#N)c(NC(=O)c2sc3cc(F)ccc3c2C)s1 580915514 XDRVKEVTLJAWRT-UHFFFAOYSA-N 344.436 5.097 30 20 EKED CC(C)c1ccc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 609414751 VVXIHSWNDZWLCB-INIZCTEOSA-N 347.245 5.111 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H](C)c1cccc(C#N)c1 610830365 ODDHQIYBJLVTJN-STQMWFEESA-N 327.497 5.033 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2)s1 612571062 OYLVYQGVBKDTLX-CQSZACIVSA-N 336.435 5.277 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nccs2)cc1 642437166 DEVGLVHNZKKHOE-UHFFFAOYSA-N 349.459 5.030 30 20 EKED CC(CSC(C)(C)C)=NNc1ncc(C(F)(F)F)cc1Cl 729633653 QSYPRNWLDFFUGL-UHFFFAOYSA-N 339.814 5.073 30 20 EKED C[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 734080532 UXOIOUTUVUIKNR-PBHICJAKSA-N 338.476 5.203 30 20 EKED CCCCCCCCCC(=O)Nc1cccc(-c2nnc(C)o2)c1 741988349 WARJQNZRFKRFIG-UHFFFAOYSA-N 329.444 5.124 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccc(N2CCCCC2)cc1 754711843 CLIMLQJWEPMLAU-UHFFFAOYSA-N 348.368 5.109 30 20 EKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 776188540 VNJOMGOKSFUKIK-OWOJBTEDSA-N 345.242 5.015 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1c(F)cccc1Cl 809158940 FUUOWIFNEPVAIC-PLNGDYQASA-N 349.839 5.560 30 20 EKED Cc1cc(C(=O)/C=C\c2csc(-c3ccccc3)n2)c(C)s1 916155849 GRMNMCBCAMFKEU-HJWRWDBZSA-N 325.458 5.385 30 20 EKED CCCCCCCC(=O)O[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 919222131 JMADCDKIJPLGGA-HNNXBMFYSA-N 330.428 5.010 30 20 EKED CC(C)[C@H]1/C(=C/c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776308584 FMWAAFKMRQWTDK-LPYTZGJOSA-N 346.835 5.119 30 20 EKED Cc1sc(NC(=O)c2ccc3c(c2)Cc2ccccc2-3)c(C#N)c1C 33150906 XFXHCXNPJRNYMX-UHFFFAOYSA-N 344.439 5.060 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cccc3ccccc23)c1 113952572 IAUALLHGPYMQJR-XLIONFOSSA-N 344.458 5.372 30 20 EKED CC(C)c1nc(CNc2ccccc2S[C@@H](C)CC#N)cs1 153882353 WDRYPHDFGMTSBK-ZDUSSCGKSA-N 331.510 5.273 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CC[C@@H](C)c2ccccc2)n1 161084718 MNMZGAKEFCANGF-ZBFHGGJFSA-N 326.465 5.027 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N(CC2CC2)C2CCCCC2)cc1 303475111 OOQPUNNBCAIKHL-UHFFFAOYSA-N 339.483 5.064 30 20 EKED C[C@H](Nc1cccc(OCc2ccccc2)c1)c1cccc(C#N)c1 310877163 HHHPETCSJKASOJ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED C[C@@H]1Oc2ccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)cc2N=C1O 328988153 HMUOFOKGTCZNRI-SJXGUFTOSA-N 342.439 5.250 30 20 EKED OC1=N[C@H](C/C(O)=N/[C@@H](c2ccc(Cl)cc2)C2CCC2)CCC1 329319545 GCFWGJFWCFXXKS-MAUKXSAKSA-N 334.847 5.037 30 20 EKED N#CCCC[C@H](NC(=O)CC/C=C/c1ccccc1)c1ccccc1 352207128 UESNMCWGZUTRRO-RZBOESAMSA-N 332.447 5.031 30 20 EKED C=CCC[C@H](NCc1ccc(C)nc1)c1ccc(C(F)(F)F)cc1 360730146 WAAQMBISINYKNE-SFHVURJKSA-N 334.385 5.206 30 20 EKED C[C@H](SCc1coc(-c2cccs2)n1)c1cccc(C#N)c1 443134178 NWQAYYAHDDINHX-LBPRGKRZSA-N 326.446 5.269 30 20 EKED CCCC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCC1 467555642 UGZJLDAWPKPJIF-HNNXBMFYSA-N 345.512 5.173 30 20 EKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)c1cccc2ccccc12 475384694 ZQNOSJUSZGITPW-FQEVSTJZSA-N 342.442 5.280 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccccc1Oc1ccccc1 508080647 VUGBKEGICPGWAC-KRWDZBQOSA-N 328.415 5.201 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 512277683 CHNIPJSFYPHBFW-WDEREUQCSA-N 337.225 5.416 30 20 EKED C=CCC[C@H](NCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 532725908 GRBQHCRSKGGACA-IBGZPJMESA-N 344.380 5.374 30 20 EKED C[C@@H](Nc1ccc(CN2CCCC[C@H]2C)cc1)c1cccc(C#N)c1 538500312 WTYJXIOPNJSMIC-QZTJIDSGSA-N 333.479 5.106 30 20 EKED CSc1ccccc1C[C@H](C)N[C@@H](CCCC#N)c1ccccc1 556202893 UDUJAVZVQGHTJJ-PXNSSMCTSA-N 338.520 5.364 30 20 EKED CC[C@@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccc(C#N)cc1 562494904 FBAQPHMNBPCFSB-FOIQADDNSA-N 348.446 5.423 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1 581840559 PPICVVMGWYHOBF-XMMPIXPASA-N 340.470 5.878 30 20 EKED CC(C)c1ccsc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592973289 BXSNSJFLPSQIRL-GFCCVEGCSA-N 344.436 5.110 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 609209578 COABSSWBGVGDSN-MRXNPFEDSA-N 349.434 5.004 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)o1)c1ccc2c(c1)COC2 742437083 RHMLYSDYMQLJLH-CLFYSBASSA-N 334.346 5.012 30 20 EKED CCc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 750681936 SLFFAUSKJNTDDO-INIZCTEOSA-N 348.471 5.013 30 20 EKED C[C@@H](Nc1ccc(Cl)c(OC(F)F)c1)c1ccc(C#N)c(F)c1 780743590 GXKAVOHDYNKWOY-SECBINFHSA-N 340.732 5.125 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 785851742 MZKOPPNGMDBDPH-FQEVSTJZSA-N 344.414 5.311 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1O 815635707 IAKHZWPYCZTEQQ-JTSKRJEESA-N 344.458 5.631 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Cl)cc1Cl 54532555 ZAMWMWCTRPPVKR-UHFFFAOYSA-N 341.263 5.275 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C)cc3C)n2)cc1 60477353 QWYYGBGHBNCCKT-GOSISDBHSA-N 346.455 5.225 30 20 EKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)Nc2cccc(C#N)c2)cc1 96721472 XCBPXXFQXYJCHR-HXUWFJFHSA-N 347.462 5.225 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1C#N 184448039 KJRDKARFVJCYME-CYBMUJFWSA-N 341.867 5.218 30 20 EKED C=CCCCNc1ccccc1C(=O)Nc1ccc(F)cc1Cl 303815615 JCWBLYVZKVCRME-UHFFFAOYSA-N 332.806 5.110 30 20 EKED N#CCCCOc1cccc(NCc2cc(-c3ccccc3)cs2)c1 326849593 OGOPCWLAYYUSGQ-UHFFFAOYSA-N 348.471 5.710 30 20 EKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1ccccc1-c1ccccc1 433223770 SMQZMLUUBCGEEY-HXUWFJFHSA-N 340.426 5.065 30 20 EKED C[C@@H](SCCCCC(C)(C)C#N)c1nc(-c2ccccc2)no1 435893841 PEOOCACNBKNXSH-CQSZACIVSA-N 329.469 5.251 30 20 EKED Cc1cscc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 439181180 ZQFHSQQURWWQKF-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CC(C)c1ccc(NC(=O)Cc2c(F)cccc2C#N)c(C(C)C)c1 505276576 ICWGLSPOWFOJMR-UHFFFAOYSA-N 338.426 5.125 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@@H](C)c1cccc(C#N)c1 508998801 UZYLMUQDLIDIHL-KRWDZBQOSA-N 327.431 5.026 30 20 EKED C=CCOc1cccc(CN[C@H](CC)c2ccccc2OC(F)F)c1 518270258 ZSUBQJBHNWFDLB-GOSISDBHSA-N 347.405 5.094 30 20 EKED N#Cc1csc(CN[C@H](c2cccc(Cl)c2)C2CCCCC2)n1 518445522 PCKVGUJLAOOBMC-SFHVURJKSA-N 345.899 5.079 30 20 EKED CCN(Cc1csc(C2CCCC2)n1)[C@H](C)c1ccc(C#N)cc1 521188076 KTKVRTPXIXYRDD-OAHLLOKOSA-N 339.508 5.255 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@H]2C[C@H](c3ccc(F)cc3)C2)CC1 551210514 FSQTYHKQAJDCRU-OMCRWQCVSA-N 348.465 5.065 30 20 EKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)c1cccc([N+](=O)[O-])c1 552503611 GOIDNRDIXMDDCL-GFCCVEGCSA-N 336.844 5.059 30 20 EKED N#C[C@@H](C(=O)c1cccc(C2CCC2)c1)c1nc2ccccc2s1 566948577 LTVBZPHCWSMRHK-INIZCTEOSA-N 332.428 5.054 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC#N)C1 596628602 KIPZYWUOYOSFPW-MRXNPFEDSA-N 327.472 5.091 30 20 EKED C=C[C@H](CC(=O)N1CC2(CC=CC2)[C@H]1c1ccccc1)c1ccccc1 649154759 UMDFZTGAGBNVEB-AUSIDOKSSA-N 343.470 5.266 30 20 EKED CCn1nc(C)c(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c1C 727975298 CTLZMXDGSACLQG-CCEZHUSRSA-N 346.430 5.208 30 20 EKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2ccc(C)s2)ccc1OC 749450981 DGOLRXTZZQKYEG-BUUCAEBMSA-N 330.449 5.139 30 20 EKED CC(=O)Nc1ccc(/C=C2/CCc3c(sc4ccccc34)C2=O)cc1 763102667 ZPNXLOGZUAIPKO-QINSGFPZSA-N 347.439 5.072 30 20 EKED C=CCC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 775462892 GAFBLSFELIUEGX-QGZVFWFLSA-N 330.815 5.045 30 20 EKED CCCCCCCCCCC(=O)N1CCCCC[C@@H]1c1ncon1 787263912 YYLQXCSQVVGXNZ-QGZVFWFLSA-N 335.492 5.044 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1ccccc1SC(C)(C)C 788668056 WRWOHPOFGXOZBZ-AWEZNQCLSA-N 342.483 5.439 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)Cc1ccccc1 793949948 VUYPYNLBYJVLFC-UHFFFAOYSA-N 343.417 5.355 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2sccc2CC#N)c(C)c1 865071100 OECFYWBNOQVRIO-ZDUSSCGKSA-N 344.505 5.266 30 20 EKED CC(C)c1ccc([C@H](Nc2ccc(C#N)cn2)c2cccs2)cc1 58489077 JQDKHWDMGHZXCB-FQEVSTJZSA-N 333.460 5.340 30 20 EKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCCCC1 111766908 VKLUUFTYZOWOAG-OAHLLOKOSA-N 345.512 5.267 30 20 EKED Cc1nc([C@H](C)ON=Cc2cccs2)oc1-c1ccc(Cl)cc1 255521149 UWTNEAVPTXDULZ-LBPRGKRZSA-N 346.839 5.477 30 20 EKED CC[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(C)cc1 303839308 LTANKAXGMVGBKE-QGZVFWFLSA-N 334.463 5.319 30 20 EKED N#CCCC[C@@H](NC/C=C/c1ccc(F)cc1F)c1ccccc1 353914680 KZKHJACGLNQDRC-AQDCRGGLSA-N 326.390 5.003 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F 410378208 LHPRRKNPYXZSAA-UHFFFAOYSA-N 337.316 5.215 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416742379 YENDMWRAWZJVMC-LJQANCHMSA-N 347.462 5.055 30 20 EKED Cc1nc(N[C@H](CCC#N)c2ccccc2)c2c(C)c(C)sc2n1 439092120 OASLUQMTESTCQB-MRXNPFEDSA-N 336.464 5.074 30 20 EKED CC[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(C#N)cc1 447592837 NYEJDZFXPNANEP-QGZVFWFLSA-N 334.341 5.063 30 20 EKED N#CCCCC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 462136787 IPIGMCFILVCEST-UHFFFAOYSA-N 348.324 5.130 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 464653835 XLQZGRJFGMRSEI-SUMWQHHRSA-N 333.884 5.209 30 20 EKED C[C@H]1CC[C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc21 507434532 MYZVPPMRHVPMCX-MGPUTAFESA-N 347.462 5.248 30 20 EKED C[C@H]1CC[C@H](C)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 510048761 IHFFJFWSAZVSIR-HOTGVXAUSA-N 349.434 5.003 30 20 EKED CCC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 511913588 BNEQVDQYWBTYMC-MRXNPFEDSA-N 332.403 5.005 30 20 EKED N#Cc1ccc(F)c(CSCc2ccc(Cl)c3cccnc23)c1 521566744 DIUAKDLSEKVNGY-UHFFFAOYSA-N 342.826 5.332 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc2cc[nH]c12 530500139 VYEXMTHBTMPOAJ-UHFFFAOYSA-N 333.435 5.664 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1)c1ccccc1 536157199 GXXKVEOLGZSOTB-KNQAVFIVSA-N 333.475 5.327 30 20 EKED N#Cc1ccc(F)c(CN[C@H](CCc2ccccc2)c2ccccc2)c1 537077162 GGKXKEMMCSPGSF-HSZRJFAPSA-N 344.433 5.161 30 20 EKED CCSc1ccc([C@H](C)NCc2ccccc2C(C)(C)C#N)cc1 537103016 FYCIFPMXXRQGTM-INIZCTEOSA-N 338.520 5.451 30 20 EKED C[C@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1 546687629 JUXNANROQSBGIS-LBPRGKRZSA-N 331.246 5.205 30 20 EKED N#CCCC[C@H](NCc1cccc(Cl)c1Cl)c1ccccc1 556908057 IFTVMLLWMVUBTP-KRWDZBQOSA-N 333.262 5.518 30 20 EKED CCSc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 561129959 DPIJIKYHQOQEBV-BTYIYWSLSA-N 336.504 5.398 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(-c2ccc(F)cc2)s1 562034924 GWRUSKBACUBSBV-AWEZNQCLSA-N 330.472 5.535 30 20 EKED N#Cc1ccc(C(=O)Nc2cc(C(F)F)ccc2Cl)cc1Cl 570434129 YLQQRFJJVKNTGY-UHFFFAOYSA-N 341.144 5.055 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)Nc3cc(C#N)cc(C)n3)s2)cc1 587973458 CTYQYVSNZKATQL-AWEZNQCLSA-N 348.475 5.175 30 20 EKED C[C@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)CC(C)(C)C 609377886 QJVNXHUBDVWQOY-HUUCEWRRSA-N 332.513 5.339 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCC1CCCCC1 609427567 KUPCXVTWAPPWFN-HNNXBMFYSA-N 330.497 5.380 30 20 EKED C[C@@H]1CCC[C@H](CNC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 609438548 JZFSYVFDIIOTII-OAGGEKHMSA-N 345.512 5.029 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc2cc(OC)ccc2c1 610829871 QCYQYAYRSDGRMV-QMHKHESXSA-N 344.458 5.522 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(F)c(Cl)cc1Cl 618801423 AUUZEYDVTVLJOU-YPMLDQLKSA-N 349.236 5.342 30 20 EKED N#Cc1ccc(F)c(CNCc2c3ccccc3cc3ccccc23)c1 742381819 LJSUJRZNLYJQJA-UHFFFAOYSA-N 340.401 5.294 30 20 EKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 776081291 MQWAIRDXOSCHLW-KBPBESRZSA-N 347.409 5.214 30 20 EKED C[C@@H](Cc1ccccc1C(F)(F)F)Nc1ccccc1O[C@H](C)C#N 795811256 SSGGLKNQFVBWAK-UONOGXRCSA-N 348.368 5.039 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccccc2)cc1 915124251 AEDRCNNWWDXMLP-HXUWFJFHSA-N 343.455 5.151 30 20 EKED CCCCn1nc(C)c(/C=C/C(=O)c2cc3ccccc3o2)c1Cl 916138361 GWMUEZGCPUGHFX-MDZDMXLPSA-N 342.826 5.287 30 20 EKED O=C(/C=C\c1cccc(OC2CCCC2)c1)c1ccc(F)cc1F 917517902 TYQIYMYJKIWDMI-FLIBITNWSA-N 328.358 5.182 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCc2cccnc21 931061871 MOHSAZPHNDCIIU-LJQANCHMSA-N 349.478 5.133 30 20 EKED CC(C)(C)[C@H]1CCCC(=NNc2ccc(Cl)c(C(=O)O)c2)CC1 1776033563 ADXJABMFUPQHMW-LBPRGKRZSA-N 336.863 5.433 30 20 EKED Cc1oc2ccccc2c1C(=O)/C=C/c1cc(C(=O)O)c(Cl)s1 1777559913 XZBDWZDZICQNHT-VOTSOKGWSA-N 346.791 5.050 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 112735196 IXROJZNZISSTFW-HXUWFJFHSA-N 349.478 5.349 30 20 EKED Cc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1NC(=O)C(C)(C)C 179847659 DEKBZRYCOOBYGO-OAHLLOKOSA-N 335.451 5.024 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(C(C)(C)C)cc2)cc1 208013501 BMTGTWAKTIYNPT-ACQAZONXSA-N 333.431 5.171 30 20 EKED Cc1[nH]c2ccccc2c1C1CCN([C@H](C)c2ccc(C#N)cc2)CC1 303732551 VPIDAFNJZPIAGT-QGZVFWFLSA-N 343.474 5.289 30 20 EKED C[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCC[C@@H]2C1)/N=C(/O)C1CCCCC1 329536678 BFHWGWUZCWANKC-CYGHRXIMSA-N 334.504 5.227 30 20 EKED Cc1cc2occ(/C(O)=N/[C@H]3CCOC4(CCCCC4)C3)c2cc1C 329974400 DANFIJFVPNCZNV-INIZCTEOSA-N 341.451 5.236 30 20 EKED CCSc1cccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)c1 426578920 JMCSHSXFDAIKEF-INIZCTEOSA-N 349.459 5.089 30 20 EKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(C#N)s1 462602601 FZAJHFXEYMFOPY-INIZCTEOSA-N 346.455 5.023 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(Cl)c1F 466847752 UBAORTDEQIMPLY-LBPRGKRZSA-N 334.847 5.485 30 20 EKED C=C(C)[C@@H](NCc1ccc2nc(C)sc2c1)c1ccc(F)c(F)c1 494845797 JEUKLMBBTBCVFR-LJQANCHMSA-N 344.430 5.290 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(C)CCCCCC1 511028978 OBIJBYUQBGTRNA-OAHLLOKOSA-N 330.497 5.237 30 20 EKED C[C@@H](Nc1ccc(Cl)cc1OC(F)F)c1ccc(C#N)cc1F 545866468 YHERVSGJCNDDSI-SECBINFHSA-N 340.732 5.125 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(-c2ccccc2)c1)c1ccccc1 553691349 YQXMUOAABBXUPZ-NRFANRHFSA-N 340.426 5.380 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1F 559834331 VCLNWVYEGJMQNP-CVEARBPZSA-N 345.421 5.171 30 20 EKED C=CCC[C@H](NCc1cncc(F)c1)c1ccc(C(F)(F)F)cc1 580057454 LPARQBBSBZWJKN-KRWDZBQOSA-N 338.348 5.037 30 20 EKED Cc1cc(C)cc(Oc2cccc(Cl)c2NC(=O)CCCC#N)c1 593312996 QRKQMKLDYYDUFO-UHFFFAOYSA-N 342.826 5.382 30 20 EKED N#Cc1cc(Cl)ccc1NCc1ccnc(Oc2ccccc2)c1 609149794 NHIPAPBAXWDJHY-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](C)C1CCCCC1 609378149 SLMCKQPUJIVINK-HOTGVXAUSA-N 344.524 5.483 30 20 EKED CO[C@H](C/N=C\c1c(O)ccc2ccccc12)c1ccc(Cl)cc1 741755258 AKKYBWAIMLDRPH-CXFFPLRNSA-N 339.822 5.005 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C/c1nc(-c3ccccc3)cs1)CC2 741848167 MOUIJXNDBBAXSO-LFIBNONCSA-N 347.439 5.031 30 20 EKED N#CCCCCOC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 746083886 FEJNQDLOVBHNRQ-UHFFFAOYSA-N 347.773 5.122 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc2nc(C3CC3)sc2c1 746340942 WVAUOBZZQVOKMA-UHFFFAOYSA-N 345.427 5.178 30 20 EKED CCOc1ccc(/C=C/C(=O)c2oc3ccccc3c2C)cc1OC 747139767 OGPWSGMSBBIZHA-PKNBQFBNSA-N 336.387 5.045 30 20 EKED CC(C)CC(C)(C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 753400415 NESWGBANNHGYLK-GFCCVEGCSA-N 334.872 5.198 30 20 EKED CC(C)[C@H]1CCc2ccccc2[C@@H]1NCc1ccc(O[C@H](C)C#N)cc1 764977298 NBTNNGIQRZMRRY-ODOSVJCGSA-N 348.490 5.027 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccc(C(F)F)cc3)c2c1 794941894 BDXMYOTVESESPI-RUDMXATFSA-N 327.330 5.010 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCC(C)(C)c3ccccc32)c1 795804456 WEJPXOGRNZXDGL-PGRDOPGGSA-N 348.490 5.270 30 20 EKED CC[C@@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1O 806178369 SMZLXGVJUOGAQG-CYBMUJFWSA-N 329.271 5.070 30 20 EKED CCCCCCCC[S@](=O)[C@@H](C)c1nccn1-c1ccccc1 806641345 DHEVECMLLKIRAS-SBUREZEXSA-N 332.513 5.043 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ccccc2Cl)n1 810606158 SXFGBQWLTXVVPB-CQSZACIVSA-N 346.883 5.119 30 20 EKED N#C[C@H](C(=O)CC(C1CCC1)C1CCC1)c1nccc2ccccc12 860701964 KLZVJSOWHNJFGG-HXUWFJFHSA-N 332.447 5.018 30 20 EKED CC(C)CC[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351476 CUFRNYQPLYBMLL-DYESRHJHSA-N 349.478 5.288 30 20 EKED Cc1cccc2cc(C=NNc3ccc4ccccc4n3)c(Cl)nc12 916285964 SCAGSMXETXUTKI-UHFFFAOYSA-N 346.821 5.191 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCC3CCCC3)n2)cc1 916627356 OATWHNRRWZIKOF-QGZVFWFLSA-N 338.476 5.265 30 20 EKED C=CCN(Cc1csc(-c2cccs2)n1)Cc1cccs1 60942758 QCMNOFAOCMEGNE-UHFFFAOYSA-N 332.519 5.121 30 20 EKED CC(=O)c1ccc(OCc2ccc(-c3ccccc3C#N)cc2)cc1F 78530904 ISMILEBERHSZIC-UHFFFAOYSA-N 345.373 5.146 30 20 EKED N#CCCCSCc1csc(-c2ccc(C(F)(F)F)cc2)n1 190905645 ATCOJNWITMJLQG-UHFFFAOYSA-N 342.411 5.366 30 20 EKED C[C@H]1CC[C@@H](/C(O)=N/[C@H]2CC[C@H](/N=C(/O)[C@H]3CC[C@@H](C)C3)CC2)C1 329268344 ICAFOJOVZFFZKE-ARGUKQJISA-N 334.504 5.083 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)c(F)c(F)c1 340450326 MMSVDIXPYCFBIN-ACJLOTCBSA-N 332.369 5.190 30 20 EKED CC[C@@H](N[C@@H](c1cccc(C)c1)c1ccccn1)c1ccc(C#N)cc1 364662046 OWKKGRGTBOSTNI-GGAORHGYSA-N 341.458 5.092 30 20 EKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cccc(C(F)F)c2)s1 411008505 TUVZGBRRGKHECY-UHFFFAOYSA-N 334.391 5.107 30 20 EKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C(C)(C)C1 472743003 AFWUWPTVWOESLL-OAHLLOKOSA-N 349.434 5.003 30 20 EKED C[C@@H](SCCCc1nc(-c2ccccc2)no1)c1cccc(C#N)c1 479545012 RJCITFYVRRWWIR-OAHLLOKOSA-N 349.459 5.035 30 20 EKED CC(C)(C#N)CCCSCc1coc(-c2cccc(Cl)c2)n1 480360052 FAHSKDTUJAPRJY-UHFFFAOYSA-N 334.872 5.558 30 20 EKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1Cl 486248379 DJBLHNNBSYZMIA-CYBMUJFWSA-N 341.842 5.024 30 20 EKED CC1(C)CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 497761793 ROGNENPCJMSZNU-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2c3c(cccc13)CC2 510684943 UQVKTAHXYVSZLU-UHFFFAOYSA-N 348.471 5.220 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(Nc3ccccc3)c2)c1 512692718 HFDTUDPXLYTJIU-UHFFFAOYSA-N 347.805 5.208 30 20 EKED Cc1sccc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 550198604 AZCVLBKMQWOQBB-OAHLLOKOSA-N 332.472 5.446 30 20 EKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(C3CCC3)c2)c(Cl)c1 589990660 DXTIDBRFEATSGD-UHFFFAOYSA-N 345.229 5.385 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)F)nc1 595038134 JOGKHLDPORBXEZ-RHSMWYFYSA-N 329.394 5.105 30 20 EKED CCCN(C(=O)c1cc(C)c(CC)s1)c1cc(Cl)ccc1C#N 609286217 NXJYRPRNRIGIOY-UHFFFAOYSA-N 346.883 5.201 30 20 EKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1nccc2ccccc12 682994563 JRNFWHCNUGZHBM-INIZCTEOSA-N 346.386 5.079 30 20 EKED CCOc1ccc(C=Nc2ccc(Oc3ccc(C)cn3)cc2)c(O)c1 733204836 BOPZQSOIOGVBFA-UHFFFAOYSA-N 348.402 5.037 30 20 EKED CC(C)(C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 737319563 YLMPATZAENOHGC-QGZVFWFLSA-N 348.833 5.042 30 20 EKED N#C[C@@H](C(=O)C1CCCCCCC1)c1nc(-c2ccccc2)cs1 744037281 SHTSUUCONOEFBY-KRWDZBQOSA-N 338.476 5.347 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1cccc(Br)c1 760264694 NJXXNPLDYUMZKQ-FPLPWBNLSA-N 348.265 5.069 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2cnc(-c3cccs3)s2)c1 763292600 QFESNTPTUOJNDA-FNORWQNLSA-N 329.421 5.215 30 20 EKED Cc1ccoc1C(=O)/C=C/c1csc(-c2ccc(Cl)cc2)n1 769783936 JTZKSODNKCQDFT-VOTSOKGWSA-N 329.808 5.261 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 776073830 ANBJMQFBOUQIMP-NVXWUHKLSA-N 348.471 5.132 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(N2CCCCC2)cc1 782302073 GVWULXRIXLTALU-WZUFQYTHSA-N 342.442 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](O)CC[C@@H](C)CC 793950035 WHJOHWCTIXCUNL-FUHWJXTLSA-N 331.500 5.054 30 20 EKED COc1cc2c(cc1N[C@@H](C)c1cccc(C#N)c1)oc1ccccc12 863997405 YFOKWDTVTXRPMZ-AWEZNQCLSA-N 342.398 5.639 30 20 EKED CCC/C(C)=C\C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920805499 LPKCHZHAQGTIDT-NXIHDVOMSA-N 346.402 5.011 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC1=CCCCC1 66955111 WXDDLHBSVIBOBZ-HNNXBMFYSA-N 343.496 5.093 30 20 EKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 80457953 WVHNJGGIFCSSCY-CVEARBPZSA-N 326.465 5.027 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Br)s1 90664494 MIXGBDJZJJBIOY-TZMCWYRMSA-N 349.297 5.206 30 20 EKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(Cl)cc1 96032412 JSGDILNOOKCXBA-RAXLEYEMSA-N 349.817 5.210 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CSc2ccccc21 189871287 GWXCMZBWTPNKGC-GOSISDBHSA-N 337.488 5.367 30 20 EKED OC(=Nc1cc(N=C(O)[C@@H]2CCCOC2)ccc1F)C1CCCCC1 328897503 XKWZIPZMVDROCP-CQSZACIVSA-N 348.418 5.009 30 20 EKED C[C@@H](NCc1sc2ccccc2c1Cl)c1ccc(C#N)cc1 386995751 GULPHHLLAWUSRA-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(CC)c2ccccc12 476809393 VQZOEMBDYLUBMB-UHFFFAOYSA-N 346.474 5.765 30 20 EKED N#Cc1ccc(F)c(CSCc2cc(Cl)cc3cccnc23)c1 560840539 BFZCSELDTYLSKN-UHFFFAOYSA-N 342.826 5.332 30 20 EKED CC[C@](C)(C#N)C(=O)N[C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 567376044 UCSNQFRIWHCJGL-KPZWWZAWSA-N 346.883 5.186 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)ccc1Cl)c1ccccc1 578459016 WNMWXWRMVJAOLI-SFHVURJKSA-N 333.262 5.518 30 20 EKED CC[C@@H](C)n1c(S[C@@H](C#N)c2ccccc2)nnc1-c1ccccc1 581201785 GRBIPMAASZIEHZ-QAPCUYQASA-N 348.475 5.273 30 20 EKED N#CCCCCCC(=O)N1CCCc2cc(-c3ccccc3)ccc21 588944802 WHSYMSRLEYQGSA-UHFFFAOYSA-N 332.447 5.107 30 20 EKED Cc1nc(-c2ccccc2)oc1CN[C@@H](CCCC#N)c1ccccc1 602838625 GGLKBWNXZHVZKY-FQEVSTJZSA-N 345.446 5.175 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)cc(C)cc1F 622851660 GIHVGLXQDBZBBB-UHFFFAOYSA-N 329.390 5.377 30 20 EKED Cc1ccc(-c2ccncc2)cc1N=Cc1cc2ccccc2nc1O 726119103 VCNNSGDSQOZFBO-UHFFFAOYSA-N 339.398 5.061 30 20 EKED Cc1ccccc1NC(=S)Nc1ccccc1SC[C@@H](C)C#N 730954716 IMJVGOPRIFROJJ-ZDUSSCGKSA-N 341.505 5.056 30 20 EKED CC(C)=CCCC(C)=Nn1cnnc1SCc1ccc(Cl)cc1 749158410 OENOGHMZVGYHGO-UHFFFAOYSA-N 348.903 5.194 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccncc1 766017376 ATEYUYDKGABYSI-VGOFRKELSA-N 329.447 5.112 30 20 EKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccco1 769770284 GTMQTRNMSDWJER-BQYQJAHWSA-N 349.333 5.318 30 20 EKED Cc1cc(Cl)cc([C@H](C)N[C@@H](CCC#N)c2ccccc2)c1O 808709630 YHIGRFMGCCIVMB-KSSFIOAISA-N 328.843 5.050 30 20 EKED COc1cc(/C=C/C(=O)c2c(F)cccc2Cl)ccc1SC 809158840 FAJYUQCXIUFITQ-SOFGYWHQSA-N 336.815 5.106 30 20 EKED CCCOc1c(/C=C/C(=O)c2ccc(F)cc2F)cccc1OCC 916128102 KYRAVBVHFLHDNC-DHZHZOJOSA-N 346.373 5.048 30 20 EKED CCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916627193 DPPVYCDRNVTJGP-WBVHZDCISA-N 340.492 5.511 30 20 EKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cccc(C(=O)O)c2)c1 1777461785 SZELYKNEKJTLQL-SEYXRHQNSA-N 342.394 5.256 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc2ccccc12 66856338 NPYVPFHQKPMORH-OAHLLOKOSA-N 346.455 5.486 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1nc2ccccc2o1 182069988 RYVVHINLUHSXTR-UONOGXRCSA-N 337.448 5.253 30 20 EKED CCOc1cc(/C=C2/C(=O)c3ccccc3C2(C)C)cc(Cl)c1O 195651376 SJBQZTGSIIMYPT-DHDCSXOGSA-N 342.822 5.002 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1OC 358343394 HJCVXQWATCUAJT-MOPGFXCFSA-N 342.870 5.434 30 20 EKED C=C[C@](C)(CC)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 467997477 BWDSDCQPCULZMQ-BFUOFWGJSA-N 346.471 5.037 30 20 EKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCCC1 487387198 INYMMXOKPTVIBV-YLJYHZDGSA-N 326.484 5.144 30 20 EKED CC1(C)CCCC[C@H]1CC(=O)N[C@@H](CCCC#N)c1ccccc1 487498517 FMKRWFVDKLSHME-OALUTQOASA-N 326.484 5.144 30 20 EKED Cc1ccc(-c2ccc(C)c(NCCCC3(C#N)CCOCC3)c2)o1 540834951 BWTYWLTUQZKEHO-UHFFFAOYSA-N 338.451 5.076 30 20 EKED C=CCC[C@H](CC)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 545189541 DQKKZGROLCYIOK-GBXCKJPGSA-N 341.520 5.292 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)cc(Cl)c1 556611244 UVVYWUGUXDXUAM-GFCCVEGCSA-N 331.246 5.205 30 20 EKED CCCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@@H](C)c1ccccc1 604495652 XEPYRHQVOMKQJW-MSOLQXFVSA-N 349.478 5.192 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)ccc1OC 610829806 MYLMGYNTOZNFKA-FZKQIMNGSA-N 328.843 5.022 30 20 EKED CC(C)(C)C1C/C(=C\c2nccs2)C(=O)/C(=C/c2nccs2)C1 730086153 YGPYUHPSSFOESS-DCIPZJNNSA-N 344.505 5.092 30 20 EKED Cc1cc(/C=C\C(=O)c2ccc(F)cc2F)c(OC(F)F)cc1C 742431362 JMNLCOCGPCIISU-UTCJRWHESA-N 338.300 5.079 30 20 EKED C=C[C@@H](CC(=O)O[C@H](c1ccccc1)c1ccccn1)c1ccccc1 759276532 XDHUKGVTTTUKEN-FDDCHVKYSA-N 343.426 5.074 30 20 EKED CCc1cnc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)s1 783710925 PJWPPJWPUVFFEP-OUKQBFOZSA-N 349.455 5.277 30 20 EKED CC(C)CC1(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)CCCC1 797571568 PHDCFVVAYQCFCF-AWEZNQCLSA-N 332.513 5.223 30 20 EKED Cc1ccc2c(c1)C/C(=C/c1csc(-c3ccc(F)cc3)n1)C2=O 921270014 QVUYYEQERTWCIQ-GDNBJRDFSA-N 335.403 5.080 30 20 EKED O=C(O)c1cccc(NN=Cc2c3ccccc3cc3ccccc23)c1 1776036684 TWHBBYUWYKPRTH-UHFFFAOYSA-N 340.382 5.137 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776114492 RBFXFAHDNKOPSB-ZRDIBKRKSA-N 348.423 5.318 30 20 EKED CCCc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)s1 1776832220 UZQWEGKIRLETBH-OWBHPGMISA-N 340.444 5.001 30 20 EKED Cc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)oc2c(C)cccc12 80456885 SRLJLOZKGBQVKW-AWEZNQCLSA-N 338.432 5.120 30 20 EKED CCCCCCCC[S@](=O)Cc1coc(-c2cccs2)n1 190757125 DKUFQGPLIRFTKQ-NRFANRHFSA-N 325.499 5.012 30 20 EKED Cc1c([C@H](C)Nc2cccc(OCCCC#N)c2)oc2ccccc12 195656660 RWABBRZBELXIET-INIZCTEOSA-N 334.419 5.597 30 20 EKED Cc1c(Cl)cccc1NC(=O)c1sc2ccc(C#N)cc2c1C 429915075 XMHKSRWLFKARDM-UHFFFAOYSA-N 340.835 5.296 30 20 EKED CCN(C(=O)C[C@H](C)C1CCCCC1)[C@@H](C)c1ccc(C#N)cc1 508941055 HBKQWMQZXXSUQF-IRXDYDNUSA-N 326.484 5.074 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1C 509703395 BKNGYDOPONFUMU-JKSUJKDBSA-N 349.434 5.003 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1)c1ccccc1 536171043 ZZUKHYOIGJWUPL-GSHUGGBRSA-N 337.438 5.095 30 20 EKED COc1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)c2ccccc12 556597010 TVVYUXYTRHTEJI-INIZCTEOSA-N 342.442 5.060 30 20 EKED C[C@@H](c1ccc(Oc2ccccc2)cc1)[S@@](=O)CCC(C)(C)C#N 583073971 QJHAOJWAINBNKS-FYSMJZIKSA-N 341.476 5.228 30 20 EKED N#C[C@@H](C(=O)c1ccc(F)c2ccccc12)c1ccc2ccccc2n1 684629827 HLZSUTQQNWKIJL-GOSISDBHSA-N 340.357 5.017 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](c2ccccc2)C(C)C)n1 747198483 XOHCUTRREDRNEO-IAGOWNOFSA-N 340.492 5.273 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccncc1 766021921 VMGVOCBJEZKTQD-SJORKVTESA-N 332.394 5.041 30 20 EKED C=CCC[C@H](NCc1cc(=O)oc2c(C)c(C)ccc12)c1ccccc1 775463193 JGQIGBRZEPIUQS-NRFANRHFSA-N 347.458 5.207 30 20 EKED C[C@H](Nc1cccc(-c2cccs2)c1)c1ccc(OCC#N)cc1 777625428 NIYOTRMERVFRDD-HNNXBMFYSA-N 334.444 5.491 30 20 EKED CC(C)C(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784491667 GQUXXYCQZFRDGS-AWEZNQCLSA-N 346.883 5.322 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2ccc3ccccc3c2)s1 797572506 AXBULFSFIUEUMC-QGZVFWFLSA-N 348.471 5.013 30 20 EKED CC(C)CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(F)cc1 1776034044 JDSNOVVLZXJBEA-UHFFFAOYSA-N 348.805 5.040 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)s1 176949395 KMLQDKSHPFQSNP-KRWDZBQOSA-N 344.892 5.214 30 20 EKED Cc1ccccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 479534782 XXSJZMTWEBLLQL-UHFFFAOYSA-N 344.439 5.270 30 20 EKED CCC(C)(C)c1ccc(CS(=O)(=O)CCCCC(C)(C)C#N)cc1 507858230 CGGZGYPRICHKHK-UHFFFAOYSA-N 349.540 5.009 30 20 EKED C=C(C)CCc1noc(CCC(=O)c2ccc(-c3ccccc3)cc2)n1 508643654 MHIHFNAAGONFOZ-UHFFFAOYSA-N 346.430 5.061 30 20 EKED CCCCN(C(=O)c1sccc1C#N)[C@@H](CC)c1ccccc1 513283430 BVEBPSDSMSDROG-KRWDZBQOSA-N 326.465 5.013 30 20 EKED COc1ccc(Cl)cc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 550826142 AJJPGDMZZKPIBP-HNAYVOBHSA-N 342.870 5.434 30 20 EKED C=CCC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 563574792 BCLVWIXUMYLDOJ-LJQANCHMSA-N 344.380 5.374 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCCc2sc(Cl)cc21 589949253 BVBAQMNAVPWLKH-DLBZAZTESA-N 342.895 5.318 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(Cl)ccc1C(F)(F)F 667077650 BDRFQWCEYWZRIE-TXEJJXNPSA-N 344.764 5.074 30 20 EKED Cc1cc(C)c(NN=Cc2ccccc2OCc2cccnc2)c(C)c1 743445449 VCDJFPLLIJNQPP-UHFFFAOYSA-N 345.446 5.032 30 20 EKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc2ccccc2c1 753135465 RBZCETXMJRUVMG-BQYQJAHWSA-N 342.423 5.254 30 20 EKED C[C@@H](Nc1cccc(C(F)F)c1Cl)c1ccc(OCC#N)cc1 757661859 UKRXFQUXLKBTEV-LLVKDONJSA-N 336.769 5.353 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)CCC2 762625753 PVTAJCBPBSPWHS-HXOBKFHXSA-N 348.490 5.268 30 20 EKED CCCCCCC[S@](=O)Cc1csc(-c2ccc(F)cc2)n1 764438378 NVHVXJKUMJQKPQ-QFIPXVFZSA-N 339.501 5.168 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1csc2ccccc12 775665918 BSJUUCLUGIMSRD-HNNXBMFYSA-N 334.488 5.553 30 20 EKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792095623 WBHGPSURYSYZPF-RTWAWAEBSA-N 342.442 5.241 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(Br)ccc1C)c1ccncc1 858364500 FVBPFOHZBXFBRX-KDOFPFPSSA-N 345.284 5.121 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)CC(C)(C)C 917041580 VNKMDOFTZIAMGN-STQMWFEESA-N 347.409 5.070 30 20 EKED CC1(C)C/C(=C\c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776526540 NZMBWVQDQHPTRY-XNTDXEJSSA-N 346.382 5.079 30 20 EKED C=CCOc1ccc(CN[C@H](CC(C)C)c2ccccc2)cc1OC 60844270 VURCVYABGOTVAS-HXUWFJFHSA-N 339.479 5.137 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCCCc1ccc(C)cc1 63576196 OJQRXEPGBNJPLB-UHFFFAOYSA-N 348.490 5.018 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2cccc(CCC(F)(F)F)c2)cc1 151043677 ZMLCIFRXKLRMMW-CQSZACIVSA-N 348.368 5.084 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 159276044 KYWCYUUZZOTQJE-MRXNPFEDSA-N 345.512 5.148 30 20 EKED C[C@H](Nc1cccc(NC(=O)c2cccs2)c1)c1cccc(C#N)c1 182854625 MQQWQPJBIRENQW-AWEZNQCLSA-N 347.443 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)n1cnc2ccccc21 189899528 NMHLCXYRGWXBBS-INIZCTEOSA-N 347.462 5.088 30 20 EKED O/C(Cc1ccccc1)=N/CC/C(O)=N\[C@@H]1CCCCC12CCCC2 329638379 WCBNBQDABAGBAD-GOSISDBHSA-N 342.483 5.035 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1Cl 426123037 LIPWVKVNNQCBEV-CQSZACIVSA-N 341.842 5.044 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cc(F)ccc1Cl 438331738 YMDZXUTYSIARET-GFCCVEGCSA-N 334.847 5.343 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CC1CCCC1 510875935 BFMKZKXSMSCDPW-GJZGRUSLSA-N 330.497 5.236 30 20 EKED C=CCC[C@H](NCc1cccc(NC(=O)[C@@H](C)CC)c1)c1ccco1 513678533 OQMZHHJBEZYANH-LPHOPBHVSA-N 340.467 5.061 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc2cc(Cl)ccc2o1 551570313 MQUZLWGUCASESO-CYBMUJFWSA-N 336.822 5.298 30 20 EKED CC(C)c1sc(NC(=O)CCCCCC#N)nc1-c1ccccc1 588289787 SYLVCNKRLBEJRQ-UHFFFAOYSA-N 341.480 5.346 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1ccccc1 604360445 OFGLKMHDECSJDV-UHFFFAOYSA-N 343.386 5.303 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1sccc1C#N 609182819 BMFKJZFJJBXSKP-UHFFFAOYSA-N 336.869 5.026 30 20 EKED Cc1cc(Cl)ccc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611092744 LBRGUPGHURWJIK-UHFFFAOYSA-N 339.609 5.079 30 20 EKED Oc1nc2ccccc2cc1C=Nc1cccc(SC(F)F)c1 727264110 MXVGXFUKJXKVPE-UHFFFAOYSA-N 330.359 5.006 30 20 EKED CC(C)(C)Oc1ccc(C(=O)/C=C/c2scnc2C2CC2)cc1 782350607 BGQGEWANBYTOFK-ZHACJKMWSA-N 327.449 5.094 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1csc(Cl)c1 787186679 RGFYFMKBVJYFHM-ONEGZZNKSA-N 337.878 5.483 30 20 EKED C=CC[C@H](C(=O)O[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803066366 CTHIXLVMKLDGQI-CJNGLKHVSA-N 349.352 5.065 30 20 EKED CCC/C(C)=C\C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 920805496 LPKCHZHAQGTIDT-KGTBHZDVSA-N 346.402 5.011 30 20 EKED C=CC[C@@H](CNc1nc2ccccc2c(C)c1C(=O)O)c1ccccc1 1776151799 CIRIKALMNWOTBD-KRWDZBQOSA-N 346.430 5.013 30 20 EKED C=CCCCCCCCCNc1nc2ccccc2c(C)c1C(=O)O 1776207880 ALOJNEWRJVFVEP-UHFFFAOYSA-N 340.467 5.570 30 20 EKED Cc1ccc(-c2cccc(/C=C/C(=O)c3cccc(C(=O)O)c3)c2)cc1 1777429667 DYSOKDWXIUJCLB-JLHYYAGUSA-N 342.394 5.256 30 20 EKED O=C(O)c1ccc(C(=O)/C=C/c2sc3ccccc3c2Cl)s1 1777671627 CFKHMGLFKIQLLR-AATRIKPKSA-N 348.832 5.211 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C(F)(F)F)c1 181609693 QTPKNHSSIGKCDI-AWEZNQCLSA-N 346.396 5.357 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]2CCC[C@H]21 191504204 VOZSHBVDAZHLPA-VQIMIIECSA-N 326.484 5.335 30 20 EKED C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc2ccccc2c1 439782780 PVMCXQDGPGBGER-MRXNPFEDSA-N 342.442 5.383 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnn1C1CCCC1 476124041 RXUUHGZJKRZCQM-UHFFFAOYSA-N 337.467 5.102 30 20 EKED CC(C)(C#N)c1ccccc1CNC(c1ccccc1)c1ccccc1 486434352 PIEYHAQMVJCCOB-UHFFFAOYSA-N 340.470 5.367 30 20 EKED CO[C@@H](CSCCCCC(C)(C)C#N)c1ccc(Cl)cc1 509147258 SCBYWMORWHPFKY-INIZCTEOSA-N 325.905 5.481 30 20 EKED C=CCCc1ccccc1NC(=O)c1sc2ccc(C#N)cc2c1C 512779248 ORFNPUWNOMMLRX-UHFFFAOYSA-N 346.455 5.452 30 20 EKED CN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2)cc1 548618214 UVHCMKMBCKWSSI-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C=CCN(Cc1ccc(C(F)(F)F)cn1)Cc1ccc(Cl)s1 579266154 RQSTYIJMMBZPHJ-UHFFFAOYSA-N 346.805 5.004 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(F)c2ccccc12 590254450 OQPPNHMXKNEWFX-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc2ccccc12 614179848 PJPLPICCUHRLAE-QGZVFWFLSA-N 328.459 5.492 30 20 EKED C=CCSc1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 681636956 OJUGOZIJXVWVTG-KRWDZBQOSA-N 344.439 5.003 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc3c(c2)oc2ccccc23)c1 726460448 BYQKBWBAZDPJID-UHFFFAOYSA-N 342.423 5.376 30 20 EKED N#CCCCOC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 730334220 QSEXOVJBXVYWQX-KRWDZBQOSA-N 345.851 5.020 30 20 EKED Cc1cccc(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)c1 730954888 NMLIXQGBWNHXCD-AWEZNQCLSA-N 341.505 5.056 30 20 EKED Cc1cc(F)cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 742537161 HXIUGKAAOYJPSF-OAQYLSRUSA-N 344.389 5.042 30 20 EKED CC(/C=C/C(=O)c1sccc1Br)=C\c1ccccc1 750904195 GQDWZUNDRSMDMM-NJHWEWLZSA-N 333.250 5.353 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCC[C@H]3C)n2)cc1 769282451 ODRXZLYLZGENNP-DJIMGWMZSA-N 338.476 5.121 30 20 EKED CC(C)OC(=O)Nc1ccc(OCCCC(C)(C)C#N)c(Cl)c1 844771430 TZPPNKUMFAIAQE-UHFFFAOYSA-N 338.835 5.006 30 20 EKED C=CCC[C@H](N[C@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 857858664 PMOJWRCOMPXXAC-IRXDYDNUSA-N 349.400 5.103 30 20 EKED C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1CCC#N 11408066 CYJWJBRQDICSNH-WMLDXEAASA-N 349.865 5.243 30 20 EKED Cc1ccc([C@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)cc1 105844500 BGNCIXQEDVBYBV-KRWDZBQOSA-N 340.426 5.025 30 20 EKED C[C@H](Nc1cccc(NC(=O)c2cccs2)c1)c1ccc(C#N)cc1 173864761 CPTMAOGCIYPYMQ-AWEZNQCLSA-N 347.443 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(F)F)c1 189911675 PREVYNJILOXDGC-UHFFFAOYSA-N 329.390 5.728 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(C)cc2)ccc1SC(F)F 214922137 QVPYGCSSRAMXMW-CLFYSBASSA-N 334.387 5.214 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1nc(C2CC2)cs1 342456171 SAKNGLUZSVIAPW-GFCCVEGCSA-N 329.494 5.027 30 20 EKED N#CCCC[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccccc1 352192330 LSOZNLPKRQEOIA-IRLDBZIGSA-N 346.474 5.048 30 20 EKED Cc1cc2sc(C(=O)Nc3ccc(CC#N)cc3)c(C)c2cc1C 445248447 LBGQVXYQKOIFHJ-UHFFFAOYSA-N 334.444 5.145 30 20 EKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(SCC(F)(F)F)cc1 453292758 OXJGQKVZTQHBFJ-YDHLFZDLSA-N 342.430 5.074 30 20 EKED CC(C)CCC1CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 470795012 RLJCENYWGKALMF-UHFFFAOYSA-N 341.499 5.168 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)C[C@@H](CC#N)c1ccccc1 475364942 CDQWYBHLCFLRDT-NHCUHLMSSA-N 334.463 5.074 30 20 EKED Cc1ccccc1-c1noc([C@H](C)S[C@@H](C)c2ccc(C#N)cc2)n1 476171422 XXLBINGBWDLQDX-GJZGRUSLSA-N 349.459 5.472 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1 481998813 JOIXQDKQHRPWEM-QFIPXVFZSA-N 345.446 5.120 30 20 EKED Cc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1C 482297468 UDIDBKMGGAZTDN-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1 505059922 CFLUVBFIEFEILX-UHFFFAOYSA-N 340.492 5.278 30 20 EKED C=C(C)COc1cc(CN[C@H](CC)c2ccc(C)cc2)ccc1OC 517549823 RWONGCSDJXTQKJ-HXUWFJFHSA-N 339.479 5.199 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCN(C)C1CCCCC1 548064719 JYDHZBPRNVARCF-UHFFFAOYSA-N 342.527 5.132 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549372737 QRDKFFUFVYAINV-HNNXBMFYSA-N 341.430 5.062 30 20 EKED N#CCCC[C@H](NC1CC(c2ccc(Cl)cc2)C1)c1ccccc1 556197885 NHXAUBUGLASONZ-MNLRITNHSA-N 338.882 5.611 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCc3c1ccc(Cl)c3Cl)CC2 565450215 LGHGGPHRUCCTRC-ROUUACIJSA-N 343.257 5.129 30 20 EKED CC(C)(C#N)CCCCS(=O)(=O)c1ccc(C2CCCCC2)cc1 581109741 FCVFWJZROPEFFN-UHFFFAOYSA-N 347.524 5.228 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1Cl 585764829 OVXPYEJCEDYOTK-HUUCEWRRSA-N 342.870 5.411 30 20 EKED CC(C)c1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)cc1 589071164 YUHRJRHIAZRHIH-LJQANCHMSA-N 331.419 5.100 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C\c1csc(-c3ccccc3)n1)CC2 741847622 IZEUETAZYPWBRY-WJDWOHSUSA-N 347.439 5.031 30 20 EKED C#CC[C@H](N[C@@H](CC)c1ccc(OC(F)F)cc1)c1ccccc1 773113887 GQGBHZVZESVSCE-OALUTQOASA-N 329.390 5.093 30 20 EKED CC1(C#N)CCC(Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)CC1 823543962 MDZBJENDMMXEOO-OOMBGRCJSA-N 348.490 5.237 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 90665295 YNOBGEXSQKRWGT-QFBILLFUSA-N 347.487 5.506 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2cccc(Cl)c2Cl)cc1 117951263 RXZMAGFJBWDDML-STQMWFEESA-N 349.261 5.135 30 20 EKED N#CCCCCSCCOC(c1ccccc1)c1ccccc1 161173843 KLHDFOPBQLIRDX-UHFFFAOYSA-N 325.477 5.220 30 20 EKED CCCCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 173115793 GMQHXPHJDHBVMU-MRXNPFEDSA-N 347.528 5.371 30 20 EKED C[C@H](CC#N)Sc1ccccc1N=Cc1cc2ccccc2nc1O 255647422 FRLXJOKHRVZSMP-CQSZACIVSA-N 347.443 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCO[C@H](C(C)C)C1 276460181 NTRKHCBUIOUPBP-XLIONFOSSA-N 343.511 5.318 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)C1CCCCC1 303344913 MKNKMBZFVGNZKT-HZPDHXFCSA-N 344.524 5.626 30 20 EKED C=CCCCN(C)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 303846673 MWBTUXBCPOYBFO-KRWDZBQOSA-N 338.451 5.257 30 20 EKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2cccs2)C2CC2)CC1)C1CC1 329985798 DPHBYTAYYMSUBD-DQPZFDDXSA-N 346.496 5.081 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)s1 421866710 BLKJOSSZYXSBKD-INIZCTEOSA-N 337.275 5.167 30 20 EKED CC(C)[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 431767876 BLJHKTOGJLBGFJ-RTWAWAEBSA-N 349.478 5.118 30 20 EKED CC(C)c1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cn1 435061966 VWCPHZZPDSHQAL-UHFFFAOYSA-N 347.443 5.057 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@H]1c1ccccc1 475565102 WAQACGPZYRULLL-PMACEKPBSA-N 334.463 5.216 30 20 EKED CCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 486754930 NRQSBOZNPKTOPP-QGZVFWFLSA-N 338.838 5.124 30 20 EKED CCCc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)sc1C 513654381 LENHFQHLSOYNCW-ZDUSSCGKSA-N 340.473 5.109 30 20 EKED N#CCc1ccc(CNc2cccc(COC3CCCCC3)c2)cc1 542236811 PRNXRVFJTKEIHW-UHFFFAOYSA-N 334.463 5.214 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)CC2 563287263 UBYYMBMSFSLTMZ-XZOQPEGZSA-N 342.417 5.064 30 20 EKED COCCSc1ccc([C@@H](C)Nc2ccc(Cl)cc2C#N)cc1 572506921 VCCZHXJJVSVQFX-CYBMUJFWSA-N 346.883 5.123 30 20 EKED C#Cc1cccc(NC(=S)Nc2cc(Cl)ccc2SCC)c1 729163434 ZBSWAJYLHBUZOB-UHFFFAOYSA-N 346.908 5.242 30 20 EKED O=C(/C=C\c1cnc2ccccn12)c1ccc(Oc2ccccc2)cc1 740764483 WRRZNODRTSCLJI-KAMYIIQDSA-N 340.382 5.023 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3c(F)cccc3s2)n1 747197166 BAOHOXNQGFMJRY-LLVKDONJSA-N 344.436 5.110 30 20 EKED Cc1ccc(-c2nc(/C=C3\CSc4ccccc4C3=O)co2)cc1 749885372 CBTLZKRUHATCLT-XNTDXEJSSA-N 333.412 5.022 30 20 EKED CCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 761046301 DUTFBVNHLHQKHP-CQSZACIVSA-N 344.867 5.220 30 20 EKED O=C(/C=C/c1cc(F)c(F)cc1F)c1ccc(-c2ccncc2)cc1 767729104 KWUJENFPHQAFNZ-AATRIKPKSA-N 339.316 5.062 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1sc2ccccc2c1Cl 776425943 QJODGXNUZYOPJK-UHFFFAOYSA-N 334.872 5.099 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C\c2scnc2C2CC2)cc1 782324998 JRKVOYULOBSTIF-KTKRTIGZSA-N 329.490 5.417 30 20 EKED Fc1ccc(C(C=NOCCC(F)(F)F)c2ccc(F)cc2)cc1 799885237 CSWGAYBNFFGEGN-UHFFFAOYSA-N 343.295 5.052 30 20 EKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 854174107 VCKKVOIUGPBVID-MRXNPFEDSA-N 347.422 5.260 30 20 EKED Clc1ccc(C=NOCc2c(Cl)ccc3cccnc23)cc1 917395387 LGDHCCYNFFQBPQ-UHFFFAOYSA-N 331.202 5.092 30 20 EKED O=C(/C=C/c1ccsc1)c1cc2cc(Br)ccc2o1 5127880 QZEHZTOGGUJEKV-HNQUOIGGSA-N 333.206 5.153 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)c2ccc3ccccc3c2)n1 84695993 XAIBETWTKWQCOH-RDTXWAMCSA-N 348.471 5.400 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cc(-c2ccccc2)no1 114452538 ZODKXAVKMPVXHH-HNNXBMFYSA-N 349.459 5.205 30 20 EKED N#CCC[C@@H](Nc1nc(C(F)F)nc2ccccc12)c1ccccc1 164346387 LMDVMBSAVHKWSF-OAHLLOKOSA-N 338.361 5.024 30 20 EKED C[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1ccc(OCC#N)cc1 179882503 MSVMBCVZHFAMND-AWEZNQCLSA-N 349.434 5.201 30 20 EKED C[C@H](Sc1nc2ccccc2n1C(F)F)c1ccc(C#N)cc1 303702609 OHUFWXQIGNGNNX-NSHDSACASA-N 329.375 5.156 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCCOc2c1ccc(Cl)c2Cl 348247441 VAOLWWWSKHRYJM-AWEZNQCLSA-N 341.282 5.127 30 20 EKED C[C@@H](SCc1ncc(-c2cccs2)o1)c1cccc(C#N)c1 443156490 VNDVNNMRFFLBBG-GFCCVEGCSA-N 326.446 5.269 30 20 EKED CCN(CCCC(C)(C)C#N)[C@@H](C)c1cccc(C(F)(F)F)c1 472256015 JKLOTPXXJURVNX-AWEZNQCLSA-N 326.406 5.418 30 20 EKED CCCn1ccc2cc(NC(=O)C[C@@H](CC#N)c3ccccc3)ccc21 475446018 DAKUCQSOHNQWGI-GOSISDBHSA-N 345.446 5.077 30 20 EKED C[C@H]1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)c2ccccc21 476719531 RYTDUGTXXCDDBS-INIZCTEOSA-N 332.447 5.032 30 20 EKED N#CC[C@@H](CC(=O)N(c1ccccc1)C1CCCC1)c1ccccc1 483478860 DAUMCTOAFYJFQF-IBGZPJMESA-N 332.447 5.050 30 20 EKED Cc1ccc([C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)cc1 504984190 ZTDHZNAICRSNPF-FQEVSTJZSA-N 347.462 5.069 30 20 EKED C[C@@H](F)CCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510765667 OIBDSHHNIMVRJN-BXKDBHETSA-N 331.275 5.037 30 20 EKED CC(C)(C)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)s1 552083467 GOKMFFHUEYLBIM-SFHVURJKSA-N 326.509 5.570 30 20 EKED C=CCC[C@H](Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 556894841 HTVYGZXTEBXMNT-IBGZPJMESA-N 338.451 5.025 30 20 EKED C=CCC[C@@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1ccco1 560548848 JJPXETYGJURQBC-MRXNPFEDSA-N 329.440 5.540 30 20 EKED C[C@@H](CN[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 583090482 TYKXXHCHPCOJKF-JXFKEZNVSA-N 326.871 5.468 30 20 EKED CC[C@@H](C)[C@@H](C(=O)Nc1sc(C)c(C)c1C#N)c1ccccc1 603444845 CQXJRFWMOYRLJG-SJKOYZFVSA-N 326.465 5.005 30 20 EKED CCCN(CC1CC1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209196 VIFGSDUQYXLBRU-UHFFFAOYSA-N 349.434 5.004 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(C)c1 612303428 LYRQZRQWUUVRGT-BEFAXECRSA-N 345.512 5.043 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619755751 RFKAOWDCVLHANN-LLVKDONJSA-N 338.760 5.081 30 20 EKED CCCCCCCCCC(=O)N1CCCO[C@H](c2ccccc2)C1 729836760 UFBZZRKCZAEPAI-FQEVSTJZSA-N 331.500 5.117 30 20 EKED C=CCN(C(=O)Nc1cccc(OCc2ccccc2C)c1)C(C)C 732701513 XRJHELXJCNGLLW-UHFFFAOYSA-N 338.451 5.002 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 756223910 HUCUKIOHBKADDX-DNVCBOLYSA-N 328.415 5.238 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N[C@@H]1CCCc2nc(O)ccc21 774812286 ZVKAWAOJBFPHQW-QFBILLFUSA-N 346.515 5.058 30 20 EKED C=CCC[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1 775464194 QYSJRKCRGIZSSS-IBGZPJMESA-N 340.854 5.039 30 20 EKED C=C(C)[C@H](NCc1ccc(Cl)nc1Cl)c1ccc(F)c(F)c1 801544810 VEILUOHCJXWIOB-HNNXBMFYSA-N 343.204 5.074 30 20 EKED N#CCCSc1ccccc1NC[C@H]1[C@H](c2ccccc2)C1(F)F 901984604 KAXLKLGBWABBRR-YJBOKZPZSA-N 344.430 5.153 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2ccccc2c1 66801500 ZYJDCFOIAZEDHA-HNNXBMFYSA-N 346.455 5.486 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](CC)c2c(C)noc2C)cc1 90886210 VTYFCMTXSSYSBJ-FZKQIMNGSA-N 348.874 5.225 30 20 EKED CC(C)c1noc([C@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 105402573 KUJUGBXIMJIDJZ-AWEZNQCLSA-N 348.406 5.030 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC(C)(C)CC1 173122448 PQIWKZREAKJJSE-HNNXBMFYSA-N 345.512 5.125 30 20 EKED C[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(OCC#N)cc1 193002365 UPCBFZVKQNRZTM-UONOGXRCSA-N 348.368 5.020 30 20 EKED Cc1cc(C(=O)N(CCC#N)CC(C)(C)C)c(C)n1C1CCCCC1 355144824 CLAJUEVKGCRHQX-UHFFFAOYSA-N 343.515 5.012 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 358329131 OEEBOPUFPBLQEU-WZONZLPQSA-N 341.458 5.444 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425686244 VSTPVZMLGNVLGU-INIZCTEOSA-N 349.478 5.216 30 20 EKED C=C[C@H]1CCCCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442796025 FNLWUXFXXAUJCN-LBPRGKRZSA-N 349.261 5.169 30 20 EKED CC1(C#N)CCC(NCc2cnc(-c3ccc(Cl)cc3)s2)CC1 449314084 YSKMRFIPQGEHQC-UHFFFAOYSA-N 345.899 5.026 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 459595952 SCEOTPUJWYDMFI-QGZVFWFLSA-N 344.890 5.073 30 20 EKED Cc1ccc([C@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1C 475174979 JSGFAMYOHKKZAZ-IFMALSPDSA-N 346.474 5.055 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccccc1 487182703 CHWKGBCBPBRBQP-WLRLJWMZSA-N 338.495 5.144 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1F 512641644 JBSAMKAVOINDBW-CWTRNNRKSA-N 346.396 5.414 30 20 EKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1F 512664580 AIPUHSIEWPAWSI-BLVKFPJESA-N 328.818 5.153 30 20 EKED C[C@@H](Nc1ccccc1NC(=O)c1cc(C#N)cs1)c1ccccc1 559252264 XMRWYQCBASICRJ-CQSZACIVSA-N 347.443 5.045 30 20 EKED C=CCC[C@H](C)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560264634 CHFLMIRDWSUUKL-KSSFIOAISA-N 341.417 5.117 30 20 EKED Cc1nc(C(C)C)sc1C(=O)Nc1sc(C(C)(C)C)cc1C#N 574539544 KLZWJBARLMZBGF-UHFFFAOYSA-N 347.509 5.058 30 20 EKED CC(C)=CCN(Cc1ccc(Cl)cc1)C(=O)CCCCCC#N 588728176 GUSKRJZTUUBBPT-UHFFFAOYSA-N 332.875 5.109 30 20 EKED CCCCC1CCC(C(=O)Nc2ccccc2SCCC#N)CC1 609375916 MPLKTUDQDSITBD-UHFFFAOYSA-N 344.524 5.627 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)C(C)(C)C 609651520 GVJXAPILRQBWDS-HNNXBMFYSA-N 336.435 5.280 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Cl)ccc1Cl 618806857 STKOJDVXLADHIU-ADLMAVQZSA-N 331.246 5.203 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@@](C)(C#N)C(C)C)sc2c1 732658536 QDFWRFSDZJNSRO-SFHVURJKSA-N 348.899 5.346 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C3/CC[C@H](C)C3)n2)cc1 753801720 LFAMEAMZVKYENQ-LZRUTDMSSA-N 336.460 5.041 30 20 EKED O=C(/C=C\c1cc(F)c(F)cc1F)c1ccc(-c2ccncc2)cc1 767729106 KWUJENFPHQAFNZ-WAYWQWQTSA-N 339.316 5.062 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Nc3ccccc3)cc2)c1 795021112 UDVJPPLDRVMQQW-UHFFFAOYSA-N 347.805 5.208 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CC[C@H](C)c3ccsc32)c1 834650988 SNMKABHKPOHRFS-ZSZQSSIHSA-N 340.492 5.157 30 20 EKED CON=Cc1ccc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)cc1 915197399 CVUFQTYOHXVTBV-UHFFFAOYSA-N 338.451 5.166 30 20 EKED O=C(/C=C\c1ccc2oc(C(=O)O)cc2c1)c1ccc2ccccc2c1 1776131364 PGXQAZFODXIJCK-UITAMQMPSA-N 342.350 5.180 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1cc(C#N)cs1 177704168 AUIHKQGLHRBVKC-SFHVURJKSA-N 338.501 5.063 30 20 EKED C[C@@H](CCSc1ccccc1)SCCCC1(C#N)CCOCC1 281754940 FVLPSFWKHKRFLV-KRWDZBQOSA-N 349.565 5.391 30 20 EKED CC(C)(C)c1cnc(CC/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@H]3C2)o1 328770762 CQEONAQAIKWGIX-HRCADAONSA-N 332.488 5.220 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1-c1cccs1 429036102 QWFXRGKTPXABGE-UHFFFAOYSA-N 341.480 5.209 30 20 EKED CC(C)CCc1nc(CN[C@@H](CCCC#N)c2ccccc2)cs1 433016110 NQWLPSDRGZDAEE-IBGZPJMESA-N 341.524 5.256 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)CC2CCCC2)cc1F 437486312 UOFZHWVGFFXPJM-UHFFFAOYSA-N 338.382 5.008 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 447509271 FFAVXWWDEUNVJJ-ACJLOTCBSA-N 332.369 5.379 30 20 EKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(SCC(F)(F)F)cc1 453292756 OXJGQKVZTQHBFJ-IPYPFGDCSA-N 342.430 5.074 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCCCC1(C)C 469198293 IYCMOWZAESMWLU-LSDHHAIUSA-N 330.497 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)c1cccs1 475565488 PXLSSMXMTNVWJU-KRWDZBQOSA-N 342.508 5.873 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1oc2ccccc2c1C)C(C)C 483776630 URMLSEZERXORBV-SFHVURJKSA-N 328.456 5.046 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 503132414 CRWNXSSMDNSDHK-NHCUHLMSSA-N 347.483 5.220 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(C(F)(F)F)cc1 512618903 KLHCTDUXXQHPQS-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cccc2ccccc12 519424722 BMQPTNDMVMCVID-INIZCTEOSA-N 332.472 5.704 30 20 EKED C[C@H](NC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccc(C#N)c1 537448918 FLQYJSLBIWDFPV-AWEZNQCLSA-N 344.380 5.307 30 20 EKED CC(C)c1ccc(-c2ncc(CSCC3(C#N)CC3)s2)cc1 538415585 CEPQMXWOSYSYAO-UHFFFAOYSA-N 328.506 5.470 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 550826197 BMASHXZRWDNELB-MBSDFSHPSA-N 328.459 5.926 30 20 EKED Cc1noc(C)c1-c1ccc(OCc2ccccc2C(C)(C)C#N)cc1 581921502 ZIDRYJYDGKYSHL-UHFFFAOYSA-N 346.430 5.339 30 20 EKED C=CCCC(=O)Nc1ccc(OCc2cccc(Cl)c2)cc1C 590237644 XBYLTNVACFQSHX-UHFFFAOYSA-N 329.827 5.132 30 20 EKED C=CC[C@H](NCc1ccc(-c2ccccc2Cl)o1)c1ccncc1 734509632 NFWDREQLZLRUJM-IBGZPJMESA-N 338.838 5.402 30 20 EKED CC(C)COc1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 740764337 RPPHNSLQLNJCGS-VAWYXSNFSA-N 331.415 5.166 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1ccc3cnccc3c1)C2=O 782325986 DWQMZXIXUCUNLA-GZTJUZNOSA-N 331.440 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CCC(OC)CC1 789719476 QTBKIFAPBDHCIH-UHFFFAOYSA-N 329.484 5.072 30 20 EKED Cc1ccc(-c2csc(CNc3ccccc3O[C@@H](C)C#N)n2)cc1 795257778 UWUQCVRFIIEVNH-HNNXBMFYSA-N 349.459 5.022 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)NCC1CCC(C#N)CC1 799384894 LDIICMCIBZSQCR-UHFFFAOYSA-N 347.462 5.114 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815636226 RDQZILVSJRNSOR-RBUKOAKNSA-N 342.870 5.521 30 20 EKED C=CC[C@@H](OC(=O)c1nc(C)oc1C)c1ccc(Cl)c(Cl)c1 816068348 QKYFIDDPHKZFQR-CQSZACIVSA-N 340.206 5.072 30 20 EKED CCC(=NNc1cccc2ncccc12)c1ccc(OC(F)F)cc1 915964846 QWUWJHPUHFPVOU-UHFFFAOYSA-N 341.361 5.062 30 20 EKED COc1cc(C)ccc1C(=O)/C=C\c1csc(-c2ccsc2)n1 920065673 DZQZJXHWFZBQPC-XQRVVYSFSA-N 341.457 5.085 30 20 EKED N#Cc1ccc(Oc2cc(Cl)c(Cl)cc2Cl)c([N+](=O)[O-])c1 18055405 ODGHPJKFGIQDAI-UHFFFAOYSA-N 343.553 5.219 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccccn1 188058031 OZGZNDRPWCGQGD-HNNXBMFYSA-N 340.492 5.053 30 20 EKED N#Cc1cc(C(F)(F)F)ccc1NCc1ccc(C(F)F)cc1 302041117 WLVMCXYWJGBTJZ-UHFFFAOYSA-N 326.268 5.127 30 20 EKED C[C@H](/N=C(/O)CC1CCCCC1)/C(O)=N/[C@@H]1CSc2ccccc21 328772679 DJORWYQVLRGWOO-XJKSGUPXSA-N 346.496 5.105 30 20 EKED N#CCCC[C@@H](NC(=O)CC/C=C\c1ccccc1)c1ccccc1 352207126 UESNMCWGZUTRRO-MNBXNJIQSA-N 332.447 5.031 30 20 EKED C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 467820096 WDNYYPIBWMHOTA-QGZVFWFLSA-N 338.278 5.425 30 20 EKED C[C@@H](S[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 471412244 PZZBWFWQJNWEOT-HUUCEWRRSA-N 334.444 5.769 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2cccs2)cc1 474586346 LPPAAMWBRUCJIU-UHFFFAOYSA-N 346.455 5.469 30 20 EKED CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(C#N)s1 487560579 OYTCJGIOGFTWMD-UHFFFAOYSA-N 336.869 5.026 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccc2nc(C(F)F)sc2c1 490597102 KVBBAGPYASXQKP-SNVBAGLBSA-N 339.411 5.100 30 20 EKED C[C@H](SCCCC1(C#N)CCOCC1)c1ccc(F)c(Cl)c1 507695245 QXRGLZMZWDFNQB-ZDUSSCGKSA-N 341.879 5.374 30 20 EKED CCN(C(=O)c1cc(C#N)ccc1Cl)c1cccc2ccccc12 509852120 IQMUZEDMAOHSJQ-UHFFFAOYSA-N 334.806 5.032 30 20 EKED CC(C)[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512643754 YDXYQNLQVUIHFG-CWTRNNRKSA-N 332.369 5.023 30 20 EKED N#CCC[C@@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1 533360184 RWYNYHVOJATEMU-HSZRJFAPSA-N 326.443 5.488 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@@H]1CCc2ccc(C#N)cc21 569513783 PXSAQWSONOSIOY-RTBURBONSA-N 344.380 5.137 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 578683532 ZAAUCULWZBNFDE-AOMKIAJQSA-N 334.463 5.074 30 20 EKED N#CCCC[C@H](N[C@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593628623 DQILSKPZDVDGPX-ROUUACIJSA-N 342.845 5.491 30 20 EKED CC(C)=CCCSCC(=O)Nc1ccccc1S[C@H](C)CC#N 596416095 ALHPNMYXUMYSRK-OAHLLOKOSA-N 348.537 5.109 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 605959588 QDJMPCAVPTUHKG-LJQANCHMSA-N 342.870 5.037 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 613290325 CHHDWEISSHOGCY-GOSISDBHSA-N 328.415 5.022 30 20 EKED Cc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1OC(F)F 614058721 SNWKIQAFERMCEI-UHFFFAOYSA-N 330.378 5.010 30 20 EKED C[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 734079638 FCVSLNSNUFUUMB-FZMZJTMJSA-N 346.883 5.342 30 20 EKED Cc1ccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)COC4)o2)cc1 742436948 OXFKGXHHCPOBRQ-NTMALXAHSA-N 330.383 5.181 30 20 EKED CCn1nc(C)c(C(=O)/C=C/c2ccccc2-c2ccccc2)c1C 750909264 KIHIJEHMQOLGJZ-CCEZHUSRSA-N 330.431 5.083 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(CC[C@H](O)c2ccccc2)c1 762991327 HDDAXFNKIFCLMX-QFIPXVFZSA-N 349.474 5.060 30 20 EKED CC(C)(C)c1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 762996181 UAFATXYYZACHCM-MRXNPFEDSA-N 348.471 5.013 30 20 EKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 764563259 XMHCVZGFMSQKDV-CHWSQXEVSA-N 334.872 5.198 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3(C)CCCC3)n2)cc1 808979833 NLMAHVSURWYZQH-MRXNPFEDSA-N 338.476 5.265 30 20 EKED Clc1cccc(C=NOCc2nc3ccccc3s2)c1Cl 821464978 UNYIPWPUBRVUOI-UHFFFAOYSA-N 337.231 5.154 30 20 EKED C=CC[C@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1ccncc1 925075313 NSZDTDBNEKUERA-RISCZKNCSA-N 326.387 5.130 30 20 EKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccccc1-c1ccccc1 1776064573 VEYWNRMKNPMJCK-UHFFFAOYSA-N 348.377 5.027 30 20 EKED Cc1ccc(-c2ccsc2C(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 33179640 PKZVSAIUYPIQET-OAHLLOKOSA-N 346.455 5.086 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1cccc(C#N)c1 181851009 VXKYZGPYZRSBED-SJORKVTESA-N 327.431 5.032 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(F)c(F)c1 212106060 PUVJAJDJCLCDOB-VURMDHGXSA-N 345.345 5.124 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1 268810456 NZWUVQHETQQKQL-CHWSQXEVSA-N 327.497 5.033 30 20 EKED CCCC(=O)Nc1cccc(N[C@@H](CC)c2ccc(C#N)cc2)c1C 278884669 YDORILWQRRZCHO-SFHVURJKSA-N 335.451 5.169 30 20 EKED CCCCCCCCC(=O)N[C@@H](c1ccccc1)c1nccs1 303210010 OFRGEAAUCGJLDL-SFHVURJKSA-N 330.497 5.099 30 20 EKED C=CCCc1ccccc1NC(=O)C[C@H](C)c1c[nH]c2ccccc12 410352384 OMYYAOIFALEKIT-INIZCTEOSA-N 332.447 5.419 30 20 EKED CC(C)c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 432475962 LFXJNCVLILLSCY-FQEVSTJZSA-N 335.451 5.367 30 20 EKED Cc1c(C)c(C)c(C[S@@](=O)CCCCC(C)(C)C#N)c(C)c1C 436112908 SKLVKDSWFCOVTP-QHCPKHFHSA-N 333.541 5.197 30 20 EKED COc1cccc(Oc2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2)c1 439571574 LJLZAGKDXVVPHK-INIZCTEOSA-N 344.414 5.532 30 20 EKED CC[C@@H](N[C@@H](c1ccc(F)cc1F)C(C)C)c1ccc(C#N)cc1 447589066 WKSHSTLEJBBNFK-WOJBJXKFSA-N 328.406 5.274 30 20 EKED Cc1cc2occ(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2cc1C 472538496 KCTJCJBEPDVYEC-UHFFFAOYSA-N 332.403 5.103 30 20 EKED Cc1cccc([C@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)c1C 476167573 SRIIYECMCYHHIQ-IFMALSPDSA-N 346.474 5.055 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(C)c1Br)c1ccccc1 490221189 FVYTWHVHOIOINU-OAHLLOKOSA-N 344.252 5.056 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(C#N)cc1 500438681 FIIMYQNVKDUROG-MRXNPFEDSA-N 346.455 5.023 30 20 EKED N#CCCC[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccccc1 566046742 MPOQCYIRGWZRQD-IBGZPJMESA-N 349.409 5.005 30 20 EKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCC1CCCC1 582505402 ISNNBSMNYFQHAP-UHFFFAOYSA-N 332.447 5.062 30 20 EKED C[C@@H](Nc1ccc(NC(=O)CCCCCC#N)cc1)c1ccccc1 588304093 PCHKWFMBKZSZIR-QGZVFWFLSA-N 335.451 5.272 30 20 EKED CC(C)Oc1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614179716 KSMYJTIEROCNEV-QGZVFWFLSA-N 336.479 5.126 30 20 EKED Cc1csc([C@@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)n1 642281950 VCNKHGSAFMDAIS-JTQLQIEISA-N 346.864 5.118 30 20 EKED N#Cc1ccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)s1 748999298 QZGQHEOJUMHBCC-AUWJEWJLSA-N 347.226 5.665 30 20 EKED C[C@H](Nc1ccccc1SCc1ccccc1)c1cccc(C#N)c1 863996819 HDYMBNLKXPQGCR-KRWDZBQOSA-N 344.483 6.024 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCC)c(C)c1 1776784796 XVTHABIWFFZAAG-IBGZPJMESA-N 349.515 5.077 30 20 EKED N#Cc1cccc(CSc2nnc(-c3ccc4ccccc4c3)o2)c1 42180863 ASLHGOPJNZZMOE-UHFFFAOYSA-N 343.411 5.054 30 20 EKED Cc1ccc(C)c(/N=C(\O)N2CCC[C@@H]2c2ccccc2Cl)c1 82095454 UWGIBTHNFFDSLJ-GOSISDBHSA-N 328.843 5.339 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 90666018 OMRHZGZUDAXABV-CXAGYDPISA-N 348.368 5.123 30 20 EKED CC(C)c1ccc([C@H](NCc2ccc(C#N)o2)c2cccs2)cc1 174249776 MKWWWOPDDBWETO-FQEVSTJZSA-N 336.460 5.215 30 20 EKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C#N)c1 182102884 LXMVGXVDBACJSI-PXAZEXFGSA-N 336.332 5.042 30 20 EKED OC(=Nc1scnc1C1CC1)c1ccc2[nH]c3c(c2c1)CCCC3 328944701 UWRJOMRAWSTKES-UHFFFAOYSA-N 337.448 5.017 30 20 EKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 352175570 VXZOJBAJEPOOHS-UKRRQHHQSA-N 346.883 5.056 30 20 EKED C[C@H](SCc1ccc(C#N)cc1Cl)c1nc2ccccc2o1 438874650 LCWCEMPWMHULGC-NSHDSACASA-N 328.824 5.347 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)NCCCCC(C)(C)C#N 444789038 ZAZCPMAJGPWPPN-MRXNPFEDSA-N 326.406 5.298 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 466419651 OYMNJFFBHKBOHS-ZDUSSCGKSA-N 330.815 5.068 30 20 EKED C=C(C)[C@H](N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccc(F)c(F)c1 467362376 OYVWYCRZAKTYHD-QUCCMNQESA-N 347.380 5.007 30 20 EKED C=CCn1c(S[C@H](C)c2ccc(Cl)cc2)nnc1-c1ccco1 498747654 QHEUWRVFYIBMED-GFCCVEGCSA-N 345.855 5.231 30 20 EKED C[C@@H](SCCCC1(C#N)CCOCC1)c1ccc2ccccc2c1 507692540 BSLQZYHPJFTSLW-QGZVFWFLSA-N 339.504 5.735 30 20 EKED N#Cc1ccc(CNc2cc(Cl)ccc2SCC(F)(F)F)o1 539933066 AJRQLYTTZRSDJN-UHFFFAOYSA-N 346.761 5.071 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(F)c1Cl 568426824 URAXMLSQULTDGW-LBPRGKRZSA-N 334.847 5.343 30 20 EKED CC[C@@H](C)n1ncc(N[C@H]2CCCc3cc(C#N)ccc32)c1C1CC1 611477230 ABDGWFKYYCJNTD-KUHUBIRLSA-N 334.467 5.093 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1Cl 727628001 FRINMFGFCPVEIQ-BHEFUSTPSA-N 346.817 5.168 30 20 EKED C=C(C)COc1cc(CN[C@@](C)(CC)c2ccccc2)ccc1OC 730817974 YEVQGMFMEKFVPT-QFIPXVFZSA-N 339.479 5.065 30 20 EKED C=C(C)COc1cc(/C=C/C(=O)c2c[nH]c3ccccc23)ccc1OC 747064418 VWGGHQSMUIVWJX-CSKARUKUSA-N 347.414 5.028 30 20 EKED C#CC[C@@H](N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 773108366 WYZPSYIXRIYDNU-OXJNMPFZSA-N 346.499 5.534 30 20 EKED CC(C)CCOc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1 777109268 QRCOVCYFPKXDRK-QGZVFWFLSA-N 338.451 5.187 30 20 EKED C=CCN(C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)C(C)C 788828995 KLHCPTPRJOWQCV-UHFFFAOYSA-N 337.341 5.002 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccncc1 793543783 WBMPQGRBYSRJDC-KXBFYZLASA-N 344.886 5.490 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 185911199 QKOXWKRWIYZALY-CYBMUJFWSA-N 344.505 5.518 30 20 EKED C[C@H](Nc1ccc(SC(F)F)cc1)c1ccc(OCC#N)cc1 192967912 CKLWEGNMOWBXDU-LBPRGKRZSA-N 334.391 5.077 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(SC)cc2)ccc1SC 207746632 HLEUFCMVTHRZJV-POHAHGRESA-N 330.474 5.035 30 20 EKED CC(C)c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 303916996 YAAIKZAOSSATAK-RTWAWAEBSA-N 346.474 5.353 30 20 EKED CC(O)=Nc1cc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)ccc1F 328975031 BECOLEZLGNVYAH-FVQBIDKESA-N 332.419 5.628 30 20 EKED CSc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1F 340439206 BYRQASRBUBWGIO-KXBFYZLASA-N 342.483 5.633 30 20 EKED C[C@@H](N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccc(C#N)cc1 435661189 CJXQVXAOEMGFDK-OMWUSAIZSA-N 344.380 5.174 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480673661 SBUMZDOJLIKNIM-ORAYPTAESA-N 346.377 5.149 30 20 EKED C=CCOc1ccccc1CN[C@@H](C)c1sc(C(C)(C)C)nc1C 482895209 GFQKDUYZWFDRLA-AWEZNQCLSA-N 344.524 5.165 30 20 EKED N#C[C@@H](C(=O)c1ccc(F)c2ccccc12)c1nc2ccccc2s1 483438993 JVTFPNKZHRGTEB-HNNXBMFYSA-N 346.386 5.079 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)C2(C#N)CCC2)cc1 531226568 HQVARUFDMHFEAD-HNNXBMFYSA-N 336.460 5.172 30 20 EKED C[C@H](NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccc(C#N)cc1 538553424 FEAXBDJMOONAOO-AWEZNQCLSA-N 344.380 5.307 30 20 EKED Cc1ccncc1[C@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543961582 XXUKMEURCXVTPO-MSOLQXFVSA-N 341.458 5.341 30 20 EKED C=CCOc1cccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)c1 551395026 OKMJLIKPVMJBCX-UHFFFAOYSA-N 347.380 5.049 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)sc1Cl 551802872 WCOOMDJEJNXAOC-JTQLQIEISA-N 337.275 5.266 30 20 EKED C=CCC[C@H](NCc1cccc(OCC(F)(F)F)c1)c1ccco1 552226010 SXIJMTCRIMDELY-INIZCTEOSA-N 339.357 5.018 30 20 EKED CC(C)c1ccc(NC(=O)NCC(C)(C)CCC#N)c(C(C)C)c1 558265912 BPWYCONSVBTZGB-UHFFFAOYSA-N 329.488 5.385 30 20 EKED N#C[C@H](C(=O)/C=C\C1CCCCC1)c1nc(-c2ccccc2)cs1 735594073 UIBBCBGMJKUGCU-WFTPILKQSA-N 336.460 5.123 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](C)c1csc2ccccc12 740050833 NBLSTESLFHEVNU-OAHLLOKOSA-N 330.497 5.350 30 20 EKED Fc1ccccc1C1CC(=NNc2nc(-c3ccccc3)cs2)C1 743431472 ZLRHHBIPGKVNDN-UHFFFAOYSA-N 337.423 5.295 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccc(Cl)c(Cl)c1)c1ccncc1 766021419 STCQJPANIIVTSK-MSOLQXFVSA-N 335.278 5.747 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(N2CCCCCC2)cc1 766348818 BPTVLGNONKJKSV-RBUKOAKNSA-N 347.506 5.350 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@@H]1c1cc(C)on1 775137074 SRYADAWBRAIACM-VQIMIIECSA-N 334.504 5.423 30 20 EKED Cc1cncc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)c1 789149076 UVZYHGNQGMKXRR-SREVYHEPSA-N 340.835 5.063 30 20 EKED CC[C@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 796800214 VWKWCWNLKXEZPG-XJKSGUPXSA-N 326.465 5.121 30 20 EKED C[C@@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC=CCC1 822495246 CLOQNUDHXYUHFY-IFMALSPDSA-N 330.431 5.027 30 20 EKED Cc1cc(C)c(C(=O)O)cc1/C=C/C(=O)c1ccc2ccccc2c1 1776130936 BCBMEOXIBVGSAQ-MDZDMXLPSA-N 330.383 5.051 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1COc2cc(C)c(C)cc21 189902604 DCUQKVMLLPEDNG-HXUWFJFHSA-N 349.474 5.270 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CCSc2ccccc21 360655871 FFEKVSUXSXFRJB-VQTJNVASSA-N 334.488 5.152 30 20 EKED Cc1ccsc1-c1nnc(SCCC2(C#N)CCCCC2)o1 412990179 DSWDEWJEUQNKCW-UHFFFAOYSA-N 333.482 5.063 30 20 EKED C=CCC[C@H](NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 435290889 SOYZKMRUVJYHOD-ZACQAIPSSA-N 339.401 5.179 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(CSC(C)C)c1C 438447196 HSOOXMIMSXKWAC-UHFFFAOYSA-N 348.556 5.847 30 20 EKED C=CC[C@H](CC)NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 439420710 ZMSJGDBCLKIJPM-ZDUSSCGKSA-N 328.378 5.003 30 20 EKED CCC1CCC(N(C)C(=O)N[C@H](CCCC#N)c2ccccc2)CC1 458804124 SCBFGECXQQJUBC-LYBXBRPPSA-N 341.499 5.032 30 20 EKED CCN(C(=O)c1cc2cc(C)c(C)cc2o1)[C@H](C)c1ccc(C#N)cc1 463170452 LGTQDVGJUHTYKD-MRXNPFEDSA-N 346.430 5.145 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)C[C@@H](CC#N)c1ccccc1 475364943 CDQWYBHLCFLRDT-RTWAWAEBSA-N 334.463 5.074 30 20 EKED C[C@@H](SCCCOc1cccc(C#N)c1)c1ncc(C(C)(C)C)o1 477345555 APAIUFMPIMGGHW-CQSZACIVSA-N 344.480 5.107 30 20 EKED C[C@H]1CCC[C@H](C)C1NC(=O)Nc1ccccc1S[C@H](C)CC#N 477777236 ZBINYUGGDXUBKH-SOUVJXGZSA-N 345.512 5.027 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC=C)Cc1ccccc1F 505017278 TVJFXRAISDIQAC-UHFFFAOYSA-N 338.426 5.164 30 20 EKED N#Cc1ccccc1CN[C@H](c1cccc2ccccc12)C(F)(F)F 510426810 QGFQCAFGTULFDN-LJQANCHMSA-N 340.348 5.105 30 20 EKED C[C@H](NCc1ccc(-c2ccc(F)cc2)s1)c1ccc(C#N)cc1 520216542 QHOSKGJPSONVKX-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1cccc(COC(C)(C)CC)c1C)OCC 535153136 LUUNGLMUWXTTEW-LJQANCHMSA-N 347.499 5.010 30 20 EKED CN(Cc1ccccc1NCC(C)(C)CCC#N)C1CCCCC1 538825705 MGNZMMUAWOBGJK-UHFFFAOYSA-N 327.516 5.193 30 20 EKED CCc1ccccc1NC(=O)c1ccccc1Oc1ccccc1C#N 539787787 CZNCXCRMJUPQMI-UHFFFAOYSA-N 342.398 5.165 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2c(F)cccc2F)cc1Cl 582305535 DMVGWAQARZYVTF-LBPRGKRZSA-N 337.797 5.034 30 20 EKED CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1S[C@H](C)CC#N 609438601 MFFANHVHYMOKHM-OAGGEKHMSA-N 345.512 5.171 30 20 EKED CC(C)(C)OCc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1 611475506 BYGLRGSCCFMVQR-OAQYLSRUSA-N 334.463 5.363 30 20 EKED Cc1cccc2cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)sc12 685143040 ITRPFLBNQMSPGW-MRXNPFEDSA-N 342.423 5.248 30 20 EKED CCSc1cccc(C=NOc2ccccc2C(F)(F)F)c1 769799955 QRLUTXFQABGVPB-UHFFFAOYSA-N 325.355 5.230 30 20 EKED C=C(C)CN(Cc1ccccc1)Cn1ccc(=S)c2ccccc21 794650336 JDKQFTVJMFZCPM-UHFFFAOYSA-N 334.488 5.407 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(-c2ccccc2)n1 189883439 NHDBMAJTNCVDIN-UHFFFAOYSA-N 346.430 5.446 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCSc3c(F)cccc32)c1 193906792 RTUBVKZEMKAHJB-SFHVURJKSA-N 342.439 5.157 30 20 EKED COc1ccc(C(C)(C)C)cc1N[C@@H](C)c1ccc(OCC#N)cc1 326865391 WMKGAFYEJRTJJR-HNNXBMFYSA-N 338.451 5.068 30 20 EKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)cc2cccnc12 353918588 YVVHTCXYMRTBRH-OAQYLSRUSA-N 329.447 5.068 30 20 EKED C[C@H](N[C@@H](CC(C)(C)C)c1ccccc1)c1ccc(OCC#N)cc1 392270333 LADIAKOBQZYVGC-UWJYYQICSA-N 336.479 5.417 30 20 EKED CC[C@@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccc(C#N)cc1 447527726 GZVCFFLOBQJBSI-QZTJIDSGSA-N 344.405 5.352 30 20 EKED CC[C@H](N[C@@H](c1ccc(F)cc1F)C(C)C)c1ccc(C#N)cc1 447589046 WKSHSTLEJBBNFK-VQTJNVASSA-N 328.406 5.274 30 20 EKED C=CCOc1ccc(CC(=O)Nc2c(CC=C)cccc2C(C)C)cc1 451336494 WHYQBUWZCFPGQO-UHFFFAOYSA-N 349.474 5.285 30 20 EKED C=CCCC[C@@H](C)Sc1nnc(COc2ccc(Cl)cc2)o1 462362201 ALIFKZNTXUJWLK-GFCCVEGCSA-N 338.860 5.139 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccc(F)cc1 476162637 ULUBWEMXTCOERZ-MRXNPFEDSA-N 339.454 5.810 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCNc1ccccc1C 476804028 ZVCCHPRKKSKXIQ-UHFFFAOYSA-N 336.479 5.288 30 20 EKED CC(C)C[C@H]1CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 486080096 YMFZKWJFWYBISX-LJQANCHMSA-N 348.446 5.001 30 20 EKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CC(C)(C)C#N 497067494 VPULLKSVQCNWED-INIZCTEOSA-N 336.435 5.013 30 20 EKED CCN(C(=O)c1oc2c(C)cccc2c1C)[C@H](C)c1ccc(C#N)cc1 509574090 INVXJISHIQXJGQ-MRXNPFEDSA-N 346.430 5.145 30 20 EKED N#CCC[C@H](N[C@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 527876630 TWHHDIZUXDWNQW-OALUTQOASA-N 328.818 5.101 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C(CC)CC)C1CC1 530555511 UGWHQOSGRZVDHR-UHFFFAOYSA-N 328.500 5.723 30 20 EKED Cc1c(Cl)cnc(NC(c2cccs2)c2cccs2)c1C#N 541347864 URYYKHGHUXRGEC-UHFFFAOYSA-N 345.880 5.240 30 20 EKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2c1 552072499 MTFDZSQLSMKGTL-CQSZACIVSA-N 338.432 5.065 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1cccc(Cl)c1)C1CCCC1 588654520 XXSQLTCXPNDUBD-LJQANCHMSA-N 332.875 5.162 30 20 EKED CN(C(=O)CCCCC#N)[C@@H](c1ccc(Cl)cc1)C1CCCC1 594017073 QFMISVABPPHWCL-LJQANCHMSA-N 332.875 5.114 30 20 EKED Cc1ccc(N(C(=O)[C@H](C)CC#N)c2nc3ccccc3s2)c(C)c1 598810934 SKWFSBDFKGOHRI-CQSZACIVSA-N 349.459 5.128 30 20 EKED C[C@H]1CCCC[C@H]1CC(=O)Nc1ccccc1S[C@H](C)CC#N 609428311 LTJUDBMYJINLRT-XHSDSOJGSA-N 330.497 5.236 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2s1 614185217 WBRMHFOQPMQVPT-HNNXBMFYSA-N 334.488 5.553 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C\C1CCCCC1 735440038 BXBADYTZQSPLGZ-SSCKCOOKSA-N 328.481 5.156 30 20 EKED CC[C@H](CC(=O)N(CCC#N)c1ccc(C)cc1)c1ccc(C)cc1 737819279 RYRGQMRDGHLOFS-LJQANCHMSA-N 334.463 5.134 30 20 EKED CC(C)c1cnc(SCCCOc2ccc(C#N)cc2)n1C(C)C 739435095 DXFXEMKJQKHJJF-UHFFFAOYSA-N 343.496 5.020 30 20 EKED CCOc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1 741473176 NRGBFKDMWVKVOV-DHZHZOJOSA-N 329.399 5.043 30 20 EKED CCC(CC)CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 759550837 FAIKCNVCSNVQGV-GFCCVEGCSA-N 348.418 5.091 30 20 EKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1cc2ccccc2o1 796891774 USKPATQEDBXTLR-RDJZCZTQSA-N 333.387 5.125 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568366 QWNVSNQOCJSJPX-GDBMZVCRSA-N 340.492 5.119 30 20 EKED FC(F)(F)CCON=C1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 799485825 WLUHLGJPFVYPBG-NSHDSACASA-N 339.279 5.298 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1nccc2ccccc12 811698177 IVSCJMHSCUYRGB-FPLPWBNLSA-N 348.452 5.316 30 20 EKED Cc1c([C@H](N[C@@H](C)c2cc(C#N)ccn2)C(C)C)oc2ccccc12 902800815 UMYKMLDPZLEOMW-MGPUTAFESA-N 333.435 5.056 30 20 EKED C#CCCCCCc1nc(-c2ccccc2OCc2ccccc2)no1 904463507 MGDVBQVOQNHWFU-UHFFFAOYSA-N 346.430 5.052 30 20 EKED Cc1ccc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915086197 IEXKUDVWYRPYET-JOCHJYFZSA-N 340.426 5.211 30 20 EKED O=C(/C=C\c1ccc2oc(C(=O)O)cc2c1)c1ccc(C2CCC2)cc1 1777569922 FRRKUMLERIBEAO-WMZJFQQLSA-N 346.382 5.295 30 20 EKED CCN(C(=O)Nc1cccc2ccccc12)[C@@H](C)c1ccc(C#N)cc1 51474091 CMYITDCALCYEOG-INIZCTEOSA-N 343.430 5.326 30 20 EKED COc1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc1 60241329 ABXNCFBPWLNXPF-DTQAZKPQSA-N 347.439 5.031 30 20 EKED Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 124125556 IEHDRQFTQUXYCU-CRAIPNDOSA-N 346.455 5.099 30 20 EKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C#N)cc1 182102832 CXBZPBLJBSQTNI-SJKOYZFVSA-N 336.332 5.042 30 20 EKED C=CCOc1ccc(C(=O)Nc2c(CC=C)cccc2C(C)C)cc1 189887814 XJZJLNMITBINTH-UHFFFAOYSA-N 335.447 5.356 30 20 EKED N#CCCCOc1cccc(NCc2ccc(SC(F)F)cc2)c1 237939947 MTYNNJLCLRWOJR-UHFFFAOYSA-N 348.418 5.296 30 20 EKED N#CCC[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 301789446 NFQQBHDMTDBIQN-CQSZACIVSA-N 349.312 5.071 30 20 EKED C[C@H]1C(=O)CC[C@H](C(O)=Nc2ccc3ccc(Cl)cc3n2)C1(C)C 328657330 OTRMKTFIEMCDOC-SMDDNHRTSA-N 344.842 5.118 30 20 EKED CC[C@H](N[C@@H](c1ccc(C)cc1)c1ccccn1)c1ccc(C#N)cc1 366863895 KGYCOCMFAHZPKX-GMAHTHKFSA-N 341.458 5.092 30 20 EKED C[C@H](NCCC(C)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 379158424 GBYHAOUSQUOTKJ-QMMMGPOBSA-N 349.265 5.420 30 20 EKED Cc1cc(C)cc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431925661 KYUOXAYPFMEUKO-WIYYLYMNSA-N 349.478 5.099 30 20 EKED CCC1(CC)CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 447060100 NTQQVZRWBHPALI-HNNXBMFYSA-N 345.512 5.125 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(F)cc3C#N)co2)cc1 488526324 GOAQFCMYJMJSQU-UHFFFAOYSA-N 338.407 5.094 30 20 EKED CC(C)(CCC#N)CNC(=O)N1CCC[C@H]1c1cccc2ccccc12 513129740 MQQVABLMUMXBKE-FQEVSTJZSA-N 349.478 5.016 30 20 EKED C=CCOc1cccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 520953109 RGKQUPYCAMTYNZ-HXUWFJFHSA-N 327.855 5.146 30 20 EKED C=CCCC1(C(=O)Nc2ccc(N3CCCCCC3)cc2C)CC1 561137808 PDJTYZSGOBXFJW-UHFFFAOYSA-N 326.484 5.060 30 20 EKED Cc1cc(CSCCC(C)(C)C#N)nc(-c2ccc(Cl)cc2)n1 573476802 BGDNAMCTHSGHBL-UHFFFAOYSA-N 345.899 5.279 30 20 EKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 603658257 WGIOAMHKDPGODZ-UHFFFAOYSA-N 349.478 5.240 30 20 EKED Cc1ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c(C)c1 609986143 YJLCCOKXHSCPCC-UHFFFAOYSA-N 341.414 5.171 30 20 EKED C=CCC[C@H](N[C@@H]1CCCn2nccc21)c1ccc(C(F)(F)F)cc1 657929892 GULVKJKOENLYDM-DLBZAZTESA-N 349.400 5.034 30 20 EKED C=CC[C@@H](OC(=O)CC(F)(F)F)c1ccc(Cl)c(Cl)c1 797553089 RDUPHHBDLSLJKH-LLVKDONJSA-N 327.129 5.106 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1O 810221191 MILAHCDPOFSTLE-PXAZEXFGSA-N 348.368 5.085 30 20 EKED Cc1ccc(C)c(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c1 814210965 XOMBZZVIPRPYHH-SFHVURJKSA-N 337.492 5.025 30 20 EKED N#CCCC[C@H](NC(=O)OCc1ccc(Cl)cc1)c1ccccc1 859168733 OLBPHZCQLAZPBB-SFHVURJKSA-N 342.826 5.001 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(OCC(C)C)c1 1776783832 OYXPBHSJYGJHHU-LJQANCHMSA-N 349.515 5.015 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2ccsc2)c1 67319361 JKEWTOIZCDNTCX-GOSISDBHSA-N 342.464 5.072 30 20 EKED C=C(C)COc1cccc(NC(=O)c2c(Cl)cccc2Cl)c1 81654985 GROFFHJYJCEJPX-UHFFFAOYSA-N 336.218 5.201 30 20 EKED N#CCCCOc1cccc(CNc2cccc(-c3nccs3)c2)c1 120785640 VFGWTUYDFJBLIH-UHFFFAOYSA-N 349.459 5.105 30 20 EKED O/C(=N/Cc1ncoc1-c1ccccc1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329161053 FMYGTHLLEXAQRG-RYQLBKOJSA-N 338.451 5.405 30 20 EKED O/C(CCc1nc2ccccc2o1)=N/[C@@H]1CCCCC12CCCC2 329695051 BEPVPSXHCILEJZ-QGZVFWFLSA-N 326.440 5.220 30 20 EKED Cc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)oc2c(C)cccc12 352225895 OYYGXMUUHIIROV-LJQANCHMSA-N 346.430 5.215 30 20 EKED N#CC[C@@H](CC(=O)N[C@H](CC1CCC1)c1ccccc1)c1ccccc1 356650078 HPWJIMDUYBXYCL-FCHUYYIVSA-N 346.474 5.122 30 20 EKED COc1cc(Cl)ccc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 421839431 XMQJAQUYRBWUFQ-RDTXWAMCSA-N 328.843 5.044 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1cccc(OCc2ccccc2)c1 434797087 WPYYWDCXSLTFDE-MRXNPFEDSA-N 348.471 5.050 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccco1 455388943 VQGBTDOWRPQMHK-IBGZPJMESA-N 336.435 5.157 30 20 EKED Cc1ccc(C)c(N(C(=O)C[C@@H](CC#N)c2ccccc2)C(C)C)c1 483460476 ICLCCMCKIKVBOC-HXUWFJFHSA-N 334.463 5.132 30 20 EKED N#CCC[C@@H](NC(=O)Nc1ccc(C2CCC2)cc1)c1ccccc1 489785446 YNXZMUMXJOKUQG-HXUWFJFHSA-N 333.435 5.121 30 20 EKED CC[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 517448234 HDZJPOLFOJEAMG-OAQYLSRUSA-N 347.393 5.448 30 20 EKED CC(C)Sc1c(Cl)cccc1NC(=O)c1ccc(CC#N)cc1 533936597 LBLOWSDTKUHXRG-UHFFFAOYSA-N 344.867 5.159 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2ccccc2C)o1)c1ccccc1 537158421 AHLUJDNMOAMBGU-HXUWFJFHSA-N 332.447 5.447 30 20 EKED C=CCC[C@@H](N[C@H](C)c1nc2c(s1)CCCC2)c1ccccc1 540147083 OVBZMCOARVDDJR-NVXWUHKLSA-N 326.509 5.380 30 20 EKED CSc1cccc(CNc2ccccc2S[C@@H](C)CC#N)c1 594706323 VZWOETICXPIIOX-AWEZNQCLSA-N 328.506 5.415 30 20 EKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)C[C@H](CC#N)c1ccccc1 597885465 JTCWGLBTEYKMAZ-SFTDATJTSA-N 346.474 5.055 30 20 EKED N#Cc1c(F)cccc1CNc1ccc(SC2CCCC2)cc1 600850365 ITUKPVPAEFHFFZ-UHFFFAOYSA-N 326.440 5.344 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 605953060 WQDIRRVRPAPKIU-NRFANRHFSA-N 348.446 5.130 30 20 EKED CCCCCC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 731400888 XGADOQSKTRZIFY-HOTGVXAUSA-N 347.528 5.561 30 20 EKED CCc1nc2ccccc2n1N=Cc1ccc(-c2cccc(F)c2C)o1 734299029 OZEJHYVXXVSOTB-UHFFFAOYSA-N 347.393 5.188 30 20 EKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 735400693 YJMQXEWLQSINMI-RDJZCZTQSA-N 340.492 5.593 30 20 EKED O=C(/C=C/c1cccc2ccccc12)c1c(Cl)nc2ccccn12 737445892 HTVWHEZXOIGMAP-VAWYXSNFSA-N 332.790 5.037 30 20 EKED C=C(Cl)COc1ccc(C(=O)/C=C\c2nccc3ccccc23)cc1 740765233 SRSCUFOLLUVHRV-KHPPLWFESA-N 349.817 5.262 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1nc2ccccc2n1C 744010275 FTLAGOSNTNAQAU-HRAATJIYSA-N 339.483 5.136 30 20 EKED O=C1/C(=C/c2ccc(Cl)nc2)CCC/C1=C\c1ccc(Cl)nc1 748993867 DJKJWMYJRCCLQT-VOMDNODZSA-N 345.229 5.003 30 20 EKED CN(C(=S)Nc1ccccc1-c1ccccc1)c1cccc(C#N)c1 751001955 AZUVWJMLEABSED-UHFFFAOYSA-N 343.455 5.058 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(N2CCCCCC2)cc1)c1ccncc1 766022878 YKHBHATWWWAYSO-AUSIDOKSSA-N 349.522 5.430 30 20 EKED O=C(/C=C\c1ccsc1Cl)c1sccc1Br 790215487 PMAQPTKCLSOZRQ-UPHRSURJSA-N 333.659 5.122 30 20 EKED CCN(CC)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 814305069 WOYPNKRIKXRESV-QFIPXVFZSA-N 335.495 5.058 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1O 815635706 IAKHZWPYCZTEQQ-HTAPYJJXSA-N 344.458 5.631 30 20 EKED CC[C@](C)(NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 838354872 CNBHBXFRNNNXIU-UNMCSNQZSA-N 349.478 5.046 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(CC(C)C)cc1 1776033226 QBTGEKMINUJSCR-UHFFFAOYSA-N 344.842 5.073 30 20 EKED O=C(O)c1ccc(NN=C2CCC[C@@H](C3CCCCC3)C2)cc1F 1776076880 KQURPPUNLOUKGJ-CQSZACIVSA-N 332.419 5.062 30 20 EKED Cc1c(NN=Cc2sc3ccccc3c2Cl)cccc1C(=O)O 1776086499 XWMIPLVHSJVVES-UHFFFAOYSA-N 344.823 5.007 30 20 EKED N#Cc1ccccc1Oc1ncnc2scc(-c3ccc(F)cc3)c12 8177776 ASTZNUTXFMCDKX-UHFFFAOYSA-N 347.374 5.161 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cccc(Cl)c1 63275339 FAKWDKOVQULEFX-SNAWJCMRSA-N 331.849 5.421 30 20 EKED Cc1c(C(=O)Nc2ccccc2C#N)oc2c1ccc1ccccc12 125608515 VKONLGXSJYZPRC-UHFFFAOYSA-N 326.355 5.018 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 131155306 VKAGENUEJISLLF-CUXKMMBLSA-N 344.867 5.200 30 20 EKED Cc1ccc(-c2nc(CNc3ccccc3O[C@H](C)C#N)cs2)cc1 182548802 ABQYCUMKRIZGAH-OAHLLOKOSA-N 349.459 5.022 30 20 EKED C#CCCCC(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 192245576 CYKJDMUBOZWEOS-LBPRGKRZSA-N 343.414 5.338 30 20 EKED CCN(Cc1ccc(C#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 195732886 ASCJGNUFCSGVKS-CQSZACIVSA-N 332.369 5.160 30 20 EKED N#CCCCOc1cccc(CN[C@@H](c2ccccc2)C2CCCC2)c1 237825877 VUSZPYGKFOBJIW-QHCPKHFHSA-N 348.490 5.390 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1cc(C(F)F)ccc1Cl 269118963 JDWKIDSEAMRKGF-UHFFFAOYSA-N 343.805 5.071 30 20 EKED N#CCC[C@H](N[C@@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 343732107 WEIZWGCACKMRPN-PZJWPPBQSA-N 329.447 5.180 30 20 EKED N#CCCC[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 353911695 CDQMTSZRSMWQMN-IBGZPJMESA-N 339.508 5.325 30 20 EKED Cc1ccc(Cl)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 433242868 BUAFLNUQDFTOEF-KRWDZBQOSA-N 341.842 5.205 30 20 EKED COc1ccccc1Oc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1 442771858 UOZHVWJYAIHTCH-INIZCTEOSA-N 344.414 5.532 30 20 EKED C[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1 443146440 OWKMPHZKKCCODI-STQMWFEESA-N 344.867 5.033 30 20 EKED C[C@H](SCCCSCC#N)c1ccc(OC(F)(F)F)cc1 466648244 MOBNUESVSYHFPQ-NSHDSACASA-N 335.416 5.026 30 20 EKED Cc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)cc1Cl 474780167 MUYUWXQOAAKXEL-UHFFFAOYSA-N 326.827 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1scc(C)c1Cl 480533017 UFBSFQFULAWZIW-UHFFFAOYSA-N 333.884 5.814 30 20 EKED C=C(C)COc1cc(CN[C@@H](C)c2cc(C)cc(C)c2)ccc1OC 500560389 DHGFGGSHXFBDES-SFHVURJKSA-N 339.479 5.118 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCCc4c3sc3ccccc43)CC2)c1 570309463 BKHABKJFGUGNSK-IBGZPJMESA-N 344.483 5.429 30 20 EKED CCCOc1ccc([C@H](C)Nc2cccc(Cl)c2C#N)cc1OC 603862429 SNZVLEYYTUYXCQ-ZDUSSCGKSA-N 344.842 5.182 30 20 EKED C[C@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 609209577 COABSSWBGVGDSN-INIZCTEOSA-N 349.434 5.004 30 20 EKED FC(F)(F)C(F)(c1ccc(NCc2ccco2)cc1)C(F)(F)F 647229716 SBGOITNFZOGANN-UHFFFAOYSA-N 341.226 5.181 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccnc3C)s2)cc1 728787965 YILYDCOIXYMESD-KHPPLWFESA-N 334.444 5.026 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2csc3ccccc23)cc1 730018914 BUHVUNZQRYEPLZ-LSDHHAIUSA-N 336.460 5.043 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C/c1csc(-c2ccsc2)n1 731321533 JEVXYOCIXAUQRA-HWKANZROSA-N 329.421 5.215 30 20 EKED N#C[C@H](NC(=O)C1CCCCCCC1)c1cccc(Cl)c1Cl 741687561 QMYSXXZACFHTNB-HNNXBMFYSA-N 339.266 5.035 30 20 EKED CC1(C)CCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 750588539 PLHXLFUVDRUTMA-UXHICEINSA-N 347.462 5.042 30 20 EKED C[C@@H](CCC#N)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 787487968 MOQZCEKYICWXOB-VIFPVBQESA-N 341.914 5.101 30 20 EKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Cl)cc1 792093050 HAAIKFIZDHDZJO-GOSISDBHSA-N 348.833 5.042 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC 886648708 BRMPLCHGEFUDTE-LJQANCHMSA-N 347.499 5.118 30 20 EKED C[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 915350538 XTCRLDAMGQEQSD-TYCQWZJGSA-N 347.462 5.042 30 20 EKED CCCCCCCOc1cccc(/C=C/c2ncc(C(=O)O)s2)c1 1776789021 KQJLTVDFUFNWDX-ZHACJKMWSA-N 345.464 5.361 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccc(C#N)cc1 79647986 PRNQSJKSYUHFTC-OAHLLOKOSA-N 338.476 5.109 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 90665316 RMNNZEQQVHNHPW-WMLDXEAASA-N 327.497 5.271 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)o1 96930435 XRRBSMLIBXYOCO-FPLPWBNLSA-N 329.808 5.261 30 20 EKED COc1cc(C(=O)/C=C\c2cccc(C)c2)ccc1SC(F)F 214922653 RPCLSZACHNPFBE-VURMDHGXSA-N 334.387 5.214 30 20 EKED CN(CC1CCCC1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303384742 WWFLEMUJPKUITI-UHFFFAOYSA-N 349.434 5.004 30 20 EKED N#CCCC[C@H](NCc1cscc1Br)c1ccccc1 353913256 ICACXJURIGHJBG-INIZCTEOSA-N 349.297 5.035 30 20 EKED CC[C@@H](N[C@@H](c1ccc(C)cc1)c1ccccn1)c1ccc(C#N)cc1 366863894 KGYCOCMFAHZPKX-GGAORHGYSA-N 341.458 5.092 30 20 EKED Cc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1C(F)(F)F 391892228 AQVMILFPEPZGLP-CYBMUJFWSA-N 334.341 5.089 30 20 EKED C=CCCc1ccccc1NC(=O)c1ncsc1-c1ccccc1 410346157 UJBZGNPGJNUPPQ-UHFFFAOYSA-N 334.444 5.181 30 20 EKED C[C@@H](N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 435664578 MXJZMXDEFYYYRR-OMWUSAIZSA-N 344.380 5.174 30 20 EKED N#Cc1ccc(CSCc2csc(-c3ccoc3)n2)c(Cl)c1 438866686 PVFOBVKOXDFXRJ-UHFFFAOYSA-N 346.864 5.362 30 20 EKED Cc1ccccc1[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(C#N)cc1 447565289 KBMWUGPXFDETHF-KBXCAEBGSA-N 332.369 5.211 30 20 EKED C=CCC[C@@H](NC(=O)N[C@@H](C)CCCC(F)(F)F)c1ccccc1 494793014 IBFHNIKSUTWIIS-GOEBONIOSA-N 342.405 5.114 30 20 EKED CC(C)c1ccc([C@H](NCc2ccc(C#N)cc2)c2cccs2)cc1 512837676 DBTQDRBUFDTKLD-QFIPXVFZSA-N 346.499 5.622 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 539048641 RCXPHSFBJOQSTF-KDOFPFPSSA-N 334.385 5.459 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1cc2cc(Cl)ccc2o1 742432175 UGUMXZJROABULR-BQYQJAHWSA-N 348.789 5.372 30 20 EKED COCc1cccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)c1 742435381 WTEAIGIRORMKAZ-GHXNOFRVSA-N 326.461 5.230 30 20 EKED CSc1ccc(C(=O)/C=C/c2cncc3ccccc23)c(Cl)c1 765613515 MULHFPCXCZSZOU-RMKNXTFCSA-N 339.847 5.506 30 20 EKED CC#CCCCC(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 767664123 AIEZZDFJTMUZIZ-AWEZNQCLSA-N 345.826 5.101 30 20 EKED C#CC[C@@H](NCc1nc2ccccc2c(C)c1Cl)c1ccccc1 775400110 WTBBZDHAIKHBQB-GOSISDBHSA-N 334.850 5.051 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccccc1SC(C)(C)C 815594955 DDFNICWJFOENFE-CQSZACIVSA-N 342.483 5.439 30 20 EKED Cc1c(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)oc2ccccc12 98054986 IQOIGRXMCZAZJA-QXMHVHEDSA-N 340.382 5.094 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(S[C@@H](C#N)C2CCCCC2)o1 115187841 XRPWJABWZOJRIA-IRXDYDNUSA-N 341.480 5.176 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccoc1C 191417770 IUDOHCSDDDLSQT-UHFFFAOYSA-N 326.440 5.104 30 20 EKED C[C@H](c1ccccc1)N(C)C(=O)c1ccccc1-c1ccccc1C#N 216820013 SCGZOUHENCNRIY-QGZVFWFLSA-N 340.426 5.058 30 20 EKED N#Cc1csc(CN[C@@H](CCc2ccccc2)c2ccccc2)c1 237850088 JMJYUSWTQNOZGB-NRFANRHFSA-N 332.472 5.083 30 20 EKED CC(C)(C)C(O)=Nc1ccc(F)c(/C(O)=N/[C@@H]2CC23CCCCC3)c1 329112949 KZMBBAWXMQMGCG-MRXNPFEDSA-N 346.446 5.487 30 20 EKED C=CCC[C@H](NC(=O)N1CCC[C@H]1c1cccs1)c1ccccc1 435110295 ILYICAZCLAAONY-ROUUACIJSA-N 340.492 5.302 30 20 EKED Cc1c(C)c(C)c(C[S@](=O)CCCCC(C)(C)C#N)c(C)c1C 436112907 SKLVKDSWFCOVTP-HSZRJFAPSA-N 333.541 5.197 30 20 EKED N#C[C@@H]1CC[C@@H](N[C@@H](c2ccccc2)c2ccc3ccccc3c2)C1 442763689 BIESFPUKPHZSET-ZQMYSKGWSA-N 326.443 5.211 30 20 EKED N#C[C@H]1CC[C@@H](Nc2cc(Cl)ccc2SCC(F)(F)F)C1 442856632 OLSZTQQJPSNNCX-GXSJLCMTSA-N 334.794 5.099 30 20 EKED CC(C)[C@H]1CC[C@H](C(=O)Nc2ccccc2SCCC#N)CC1 510551113 IUKTWJBAAIBOQU-WKILWMFISA-N 330.497 5.093 30 20 EKED C=CCOc1cccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)c1 520953107 RGKQUPYCAMTYNZ-FQEVSTJZSA-N 327.855 5.146 30 20 EKED C[C@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 540607652 WHYUKSNNLBIJSF-APPDUMDISA-N 331.246 5.203 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 543508887 ZHEDVSVJPUZJNI-GFCCVEGCSA-N 335.781 5.576 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCCC(C)(C)C#N 544486453 HMMHLFRQUQUOFX-LBPRGKRZSA-N 347.915 5.362 30 20 EKED CO[C@H](CSCc1ccccc1C(C)(C)C#N)c1ccccc1 550006525 HSGOTPSKFSBRQN-LJQANCHMSA-N 325.477 5.109 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)c1ccccc1)CC2 569396965 VXHWGHVVQCFFCF-DNQXCXABSA-N 338.454 5.119 30 20 EKED N#CCCCCCc1nc(-c2ccc(OC3CCCCC3)cc2)no1 589119923 BUIMSLHTVNALHN-UHFFFAOYSA-N 339.439 5.075 30 20 EKED CCC[C@@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208826 HQMYAILAELVBBS-OAHLLOKOSA-N 337.423 5.003 30 20 EKED CC(C)(C)CCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728814301 ZEMXLSOKXKKONO-FQEVSTJZSA-N 334.463 5.497 30 20 EKED CC(C)(C)c1ncc(/C=C2/CCOc3ccc(Cl)cc3C2=O)s1 736433426 FKPAYAPAIILFBI-FLIBITNWSA-N 347.867 5.143 30 20 EKED CC(/C=C\C(=O)c1ccc(-c2ccncc2)cc1)=C\c1ccccc1 745990263 PSXCROZZIQNTEF-UMMCPOKDSA-N 325.411 5.591 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1ccc2ccccc2n1 756518883 JOALYZYVAALUFX-ABDJAZHISA-N 346.817 5.168 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3ccccc3)n2)cc1 773982928 NEUWHQRNXFYFFR-MAUKXSAKSA-N 346.455 5.099 30 20 EKED CCCCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 776155209 DCBCJHGJSUMKAK-GCJKJVERSA-N 336.479 5.561 30 20 EKED CCCc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 814507091 HJDWQOFCECBYRZ-FQEVSTJZSA-N 335.451 5.196 30 20 EKED N#CC1(c2ccccc2)CCC(=NNc2cccc3ncccc23)CC1 915963520 BTZKVXPGXMVOJX-UHFFFAOYSA-N 340.430 5.038 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c1 917516975 FZKJVUPGWSMWME-KHPPLWFESA-N 347.439 5.270 30 20 EKED O=C(O)c1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)s1 917518624 HPNLTUXDBFEEHJ-SREVYHEPSA-N 340.425 5.071 30 20 EKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1cccs1 33936498 ZIEGDSIOWFYNHA-CLFYSBASSA-N 337.425 5.514 30 20 EKED C=CCN(C(=O)c1cscc1C)c1nc(-c2ccccc2)cs1 175279010 CFFCOGHPYVJCQP-UHFFFAOYSA-N 340.473 5.013 30 20 EKED C[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1ccc(OCC#N)cc1 179882516 MSVMBCVZHFAMND-CQSZACIVSA-N 349.434 5.201 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc2ccccc2s1 181724751 POAOAHHWRNVSSB-CABCVRRESA-N 336.460 5.215 30 20 EKED Cc1nc([C@@H](C)ON=Cc2cccs2)oc1-c1ccc(Cl)cc1 255521147 UWTNEAVPTXDULZ-GFCCVEGCSA-N 346.839 5.477 30 20 EKED C[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(OCC#N)cc1 293905987 ZUPSOFWAZWJMRH-MLGOLLRUSA-N 346.883 5.032 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/C[C@@H]2C[C@@H](C(C)C)c3ccccc32)CC(O)=N1 329881091 OBBAIBMUEXBFBY-GGXPGOJBSA-N 342.483 5.015 30 20 EKED Cc1ccc(CN(C(=O)Nc2ccc(C#N)cc2Cl)C(C)C)s1 426155593 YWBQEWCKZLGOTF-UHFFFAOYSA-N 347.871 5.024 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc([C@H](C)OC)c1 471293375 SZFMGVGEFZGFIP-KRWDZBQOSA-N 338.451 5.004 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C2(C#N)CCC2)cc1 531226570 HQVARUFDMHFEAD-OAHLLOKOSA-N 336.460 5.172 30 20 EKED C=CCC[C@@H](NCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 538258820 KGYKJCSIFSYZPS-HXUWFJFHSA-N 336.410 5.278 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccccc1C#N 588574411 GCXZWKBQMKBYMC-YPKPFQOOSA-N 330.431 5.062 30 20 EKED CC(C)[C@H](c1ccc(Cl)cc1)c1noc(CCCCCC#N)n1 589153479 WNHVTFNUHUVHQL-QGZVFWFLSA-N 331.847 5.137 30 20 EKED CCCCN(C(=O)Nc1cccc(CC#N)c1)[C@H](C)c1ccc(C)o1 590855331 CPWAUEWMYPYLDR-MRXNPFEDSA-N 339.439 5.049 30 20 EKED CCC(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603759064 SQCHGLOUYZEIPQ-GOSISDBHSA-N 340.854 5.370 30 20 EKED C=CCCCN(C)C(=O)Nc1ccccc1Oc1cccc(F)c1 605914221 WTGQWVZTIXHDDS-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Cl)cc(Cl)c1 618801381 ASLKPFRAFKAOBJ-BBATYDOGSA-N 331.246 5.203 30 20 EKED C=CCC[C@H](N[C@@H]1CCCn2ccnc21)c1ccc(C(F)(F)F)cc1 655734469 JAUHJQWYDHDOAU-DLBZAZTESA-N 349.400 5.034 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccc(C#N)c3)s2)cc1 727655467 XAWWPUZUEDAOQJ-FLIBITNWSA-N 344.439 5.195 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2F)o1)c1ccc2c(c1)COC2 742435709 XFOBFFRIZFTKOG-VQHVLOKHSA-N 334.346 5.012 30 20 EKED CCOc1cccc(/C=N/[C@@H](C)c2ccc(-c3ccncc3)cc2)c1O 746393193 HRGMWFMFTNDTOO-WTJYETQFSA-N 346.430 5.033 30 20 EKED CC(C)[C@@H]1CCc2ccccc2[C@@H]1N[C@@H](C)c1ccc(OCC#N)cc1 765809325 MDFCRGVBXKHCNU-JWNTYJGQSA-N 348.490 5.199 30 20 EKED C=CC[C@H](C(=O)OCc1ncc(-c2ccccc2C)o1)c1ccccc1 778419589 ZPSCKORJJOUKKF-IBGZPJMESA-N 347.414 5.053 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccccc1SC(C)(C)C 788668060 WRWOHPOFGXOZBZ-CQSZACIVSA-N 342.483 5.439 30 20 EKED CCCCCCCC[S@](=O)Cc1coc(-c2cccc(F)c2)n1 790138026 CQJYDOBJVSUMEH-QHCPKHFHSA-N 337.460 5.090 30 20 EKED C[C@H]1CCC[C@@H](OCCCCCC(=O)OC[C@H]2CC[C@@H](C#N)CC2)C1 809090451 MGPKUYSFEGVWFM-VNTMZGSJSA-N 349.515 5.015 30 20 EKED Cc1cc(Cl)cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c1O 815635616 GLKBWXTVWHXJSS-HNAYVOBHSA-N 342.870 5.440 30 20 EKED CC(C)(CCC#N)CNc1cccc(CSc2ccccn2)c1 125069944 NPRWRFQFHSVRPJ-UHFFFAOYSA-N 325.481 5.116 30 20 EKED CCc1cccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 217184585 JBSKDRGDYQXHTE-CQSZACIVSA-N 339.464 5.145 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc1C 264513803 ZGHZAVJTUSSJGH-LBPRGKRZSA-N 330.478 5.012 30 20 EKED Cc1cc2cc(C(=O)N[C@H](CCCC#N)c3ccccc3)oc2cc1C 352179748 BMSRJLZOVHZPHG-LJQANCHMSA-N 346.430 5.215 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426137401 NYSTZCSPSAZYME-GOSISDBHSA-N 341.842 5.073 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccccc2)cc1F 438646055 FJQKSTHDOKJYPD-UHFFFAOYSA-N 347.349 5.134 30 20 EKED N#CC1CCC(CNCc2ccc(-c3ccccc3Cl)o2)CC1 441353988 WHHQADMACHPMCH-UHFFFAOYSA-N 328.843 5.020 30 20 EKED CCC(CC)[C@@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1ccccc1 503348271 SRILSBCIFIRABN-IIBYNOLFSA-N 349.478 5.096 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2cccc(OC)c21 506046510 YLSMVOLZMVHNEF-IBGZPJMESA-N 349.474 5.216 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccc(C#N)cc1 509656255 UWKLYURBPLKKEB-HUUCEWRRSA-N 338.476 5.191 30 20 EKED CC[C@@H](C)Oc1cccc(N[C@@H](CCC#N)c2ccc(OC)cc2)c1 550855698 CQFKOSJSPSOEFD-IERDGZPVSA-N 338.451 5.329 30 20 EKED Cc1cc(C)c(CSCCCCC#N)c(OCc2ccccc2)n1 561742422 GEFKJCNZKKZFDN-UHFFFAOYSA-N 340.492 5.205 30 20 EKED CC[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 609046360 CQUWPSFCKHNXFN-KRWDZBQOSA-N 349.434 5.065 30 20 EKED CCCOc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1OCCC 743466108 KDYGGQFMGYJLAZ-INIZCTEOSA-N 338.451 5.309 30 20 EKED C=CCC[C@@H](NCc1cc(=O)oc2c(C)c(C)ccc12)c1ccccc1 775463198 JGQIGBRZEPIUQS-OAQYLSRUSA-N 347.458 5.207 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(SC(F)F)cc1 787026656 NFOVLBYFOFRPFE-XIKOKIGWSA-N 344.430 5.211 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(C)cccc2C1 789448920 ACICJPQJQDGQPB-UHFFFAOYSA-N 348.490 5.437 30 20 EKED Cc1oc(C#N)cc1-c1nc(-c2ccc(SC(C)(C)C)cc2)no1 809439533 AUKIMDJGMGHCRJ-UHFFFAOYSA-N 339.420 5.067 30 20 EKED N#CC1(CNC(CCC(F)(F)F)CCC(F)(F)F)CCCCC1 926713483 XGMCEZPPMQCPQK-UHFFFAOYSA-N 344.343 5.104 30 20 EKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(CCC#N)cc2)c1C 932576350 RMBYGIBNQDILPX-NRFANRHFSA-N 347.462 5.129 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)cc(Cl)c1 1776783048 SXLZBGJSQWJRPH-INIZCTEOSA-N 346.298 5.287 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccc2)cc1 8381283 MNHBSEGBGXKXMM-CCEZHUSRSA-N 339.394 5.033 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 55043021 NDOVAFJDJLUGJF-QHCPKHFHSA-N 338.410 5.184 30 20 EKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 71951665 MXACSBWJBAKDRL-CQSZACIVSA-N 340.835 5.057 30 20 EKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCCCC(C)(C)C#N 125989236 UXOBXFXGKAXLQD-UHFFFAOYSA-N 331.460 5.084 30 20 EKED CCCCCCCC[S@](=O)Cc1sc(C)nc1C(F)(F)F 190849125 ZUPRQZMPPFOPDK-NRFANRHFSA-N 341.464 5.080 30 20 EKED CCN(Cc1ccc(C#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 195732885 ASCJGNUFCSGVKS-AWEZNQCLSA-N 332.369 5.160 30 20 EKED Cc1c(COc2ccccc2)cccc1NCc1cc(C#N)cs1 237610776 QCHOQNIXXJGDBN-UHFFFAOYSA-N 334.444 5.119 30 20 EKED N#Cc1c(Cl)nsc1N[C@H](c1ccccc1)c1cccc(F)c1 301596646 GJTSVCSNVVHNAR-OAHLLOKOSA-N 343.814 5.009 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 449445703 LDMLGYLFSKJSEC-RUGDWHBFSA-N 336.401 5.013 30 20 EKED C=CCC(CC=C)C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 469198812 BLEPFRWLCQYPHG-HNNXBMFYSA-N 345.792 5.170 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)c1ccccc1 475557256 XBAMYTLGSYVWKY-KRWDZBQOSA-N 336.479 5.464 30 20 EKED C=CCSc1ccccc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 486839392 KEYORPRMTYSTJC-AWEZNQCLSA-N 342.489 5.035 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 507722074 ILRMCORTRLGRRE-UHFFFAOYSA-N 349.261 5.379 30 20 EKED COc1cc(-c2ccccc2)ccc1CN[C@@H](C)c1ccc(C#N)cc1 512401060 JFQUCEPEVKXHHB-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC)c1ccc(Cl)s1 513102748 NEXFJTAYWBIESH-HNNXBMFYSA-N 348.899 5.250 30 20 EKED CC(C)CCc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 526991932 BWXXIDBFKIFQIR-UHFFFAOYSA-N 334.463 5.329 30 20 EKED CCC(CC)N(C(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 530945631 HWNYYZVEXCZZJJ-CQSZACIVSA-N 345.512 5.123 30 20 EKED C=C[C@@H](CC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 535397994 UWJSZVHKFWYAGI-LPHOPBHVSA-N 339.866 5.016 30 20 EKED CC(C)(CCC#N)CNc1cc(Cl)ccc1OCC(F)(F)F 539924027 QNKDOXCKRPIRBT-UHFFFAOYSA-N 334.769 5.023 30 20 EKED CC(C)CC[C@@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588299713 BLLWQYQSVOMGDO-GOSISDBHSA-N 334.891 5.408 30 20 EKED C[C@@H](Nc1ccccc1N(C)Cc1ccccc1)c1cccc(C#N)c1 600848879 YCULKZBZRSORJH-GOSISDBHSA-N 341.458 5.368 30 20 EKED Cc1cc(F)ccc1-c1ccc(C(=O)Nc2ccccc2C#N)cc1F 609753654 GXZQGMVMTIGILF-UHFFFAOYSA-N 348.352 5.064 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cnn(-c2ccccc2)c1)c1ccccc1 773076826 PDKVMXZNPCBNQZ-AVRDEDQJSA-N 331.463 5.230 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C/c2cncc3ccccc23)cc1Cl 773163681 YUHXFSUPYAKJSU-AATRIKPKSA-N 343.213 5.020 30 20 EKED N#CCCCCCC(=O)OCc1cc(Cl)c(Cl)c(Cl)c1 805928975 VVDXUZDNAYTHLR-UHFFFAOYSA-N 334.630 5.164 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)n1 860581418 LKGHCGGNXXWMAU-ZACQAIPSSA-N 338.476 5.027 30 20 EKED CCCCOc1cc(/C=C/C(=O)c2ccc(F)cc2F)ccc1OC 916128309 XDZFYYKFRVKPAE-WEVVVXLNSA-N 346.373 5.048 30 20 EKED O=C(O)c1cc(NN=C2CC(c3cccc(Cl)c3)C2)ccc1Cl 1776033687 RLLIPDZQGMCMCU-UHFFFAOYSA-N 349.217 5.037 30 20 EKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)s1 76606814 LSLUNDOIEJLMJX-LBPRGKRZSA-N 346.864 5.118 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1cccc(Cl)c1 175211166 DXKRUGUVUXLBJK-BLMSOEDDSA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(Cl)c1F 189873434 ROLKTFGYEUGAKJ-UHFFFAOYSA-N 349.808 5.722 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2ccccc2Cl)o1 277840832 ZJQAZNPJRONRGC-UHFFFAOYSA-N 335.860 5.202 30 20 EKED CC(O)=Nc1ccc(N/C(O)=N/[C@H]2CCCCC23CCCC3)cc1 329602721 FZMQWUPKIVPQOI-KRWDZBQOSA-N 329.444 5.123 30 20 EKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1C(C)(C)C 340449683 VSNVNKUWSKSAQW-OXQOHEQNSA-N 338.499 5.032 30 20 EKED C=CCCc1ccccc1NC(=O)CCc1ncc(-c2ccccc2)o1 410360879 BYZICAPRYLAQCU-UHFFFAOYSA-N 346.430 5.032 30 20 EKED CC(C)c1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 437554605 GTQGTUFNLQODRE-RTWAWAEBSA-N 347.462 5.114 30 20 EKED C=C(C)CN(CC)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442303683 XZZYEVGHNLJPJN-UHFFFAOYSA-N 337.250 5.027 30 20 EKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NCCCCC(C)(C)C#N 444677163 VWDFTLPUVHABST-HUUCEWRRSA-N 340.433 5.507 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 447561361 HZPDSSZQWCCGIJ-GAJHUEQPSA-N 341.458 5.422 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 451016941 JFMVYIPXKVFQKU-QGZVFWFLSA-N 344.890 5.073 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F 505016926 NYIRSLIWZUQPBP-CQSZACIVSA-N 344.405 5.308 30 20 EKED CC(C)Sc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2C#N)cc1 505595185 BSWQMXBGNCNASL-CYBMUJFWSA-N 341.436 5.140 30 20 EKED CC(C)c1ccc(-c2csc(NC(=O)[C@@H](C)C#N)n2)c(C(C)C)c1 530816110 YOYHLEYPSVMJLP-ZDUSSCGKSA-N 341.480 5.155 30 20 EKED CCN(C(=O)c1cc(F)c2ccccc2c1)[C@H](C)c1ccc(C#N)cc1 555431068 HDDLXTOZZSXIRL-OAHLLOKOSA-N 346.405 5.074 30 20 EKED C=CCC[C@@H](Nc1ccc(NC(=O)CC(C)C)cc1)c1ccco1 560544885 KHCWFYXYWJMRTD-GOSISDBHSA-N 326.440 5.384 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)CC1(C#N)CC1 590196492 HHBDDFCYKFFCKY-UHFFFAOYSA-N 328.481 5.052 30 20 EKED N#CCCCCC(=O)Nc1cccc(CSCc2ccccc2)c1 593978848 DVJUWYJCBPWUHH-UHFFFAOYSA-N 338.476 5.142 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCSc2c(Cl)cccc21 618807029 SPHUXIYBIGSLDP-ZWKOTPCHSA-N 340.879 5.026 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CCF)C1 666866080 HHUZUQLKSQFWQH-MRXNPFEDSA-N 332.463 5.142 30 20 EKED CC(=NNc1ncccc1Cl)c1csc(-c2csc(C)n2)c1 729142595 VXUKNSYSOPTXPC-UHFFFAOYSA-N 348.884 5.065 30 20 EKED N#CCOc1ccc(CSC(c2ccccc2)c2ccccc2)cc1 731156662 XZTLYSVEPAVYCA-UHFFFAOYSA-N 345.467 5.612 30 20 EKED O=C(/C=C/c1nccs1)c1ccc(-c2ccccc2Cl)s1 735228484 BUCLIVNBORQAEZ-VMPITWQZSA-N 331.849 5.421 30 20 EKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1Cl 741474282 WVRFRAXKIDKKRH-FNORWQNLSA-N 349.817 5.307 30 20 EKED CCCCCC[C@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 741925394 PRXVJSUGTUIJDW-CVEARBPZSA-N 332.513 5.483 30 20 EKED N#CCC1(COC(=O)c2sc3cccc(Cl)c3c2Cl)CC1 744275418 FUOOIILLEKSRLZ-UHFFFAOYSA-N 340.231 5.059 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(C#N)cc1C 747843270 ASDKPTLKEGVNOP-UHFFFAOYSA-N 338.476 5.318 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 766350663 NKORMMIAIOKRGY-HZPDHXFCSA-N 340.854 5.101 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217089 BPGXOUHAXJUEBE-HIFRSBDPSA-N 340.389 5.273 30 20 EKED C=CCCCCCCCNC(=O)c1ccc(Cl)nc1C(F)(F)F 813256238 ALZANPHKZUGOTB-UHFFFAOYSA-N 348.796 5.010 30 20 EKED Oc1ccc2ccccc2c1/C=N/C[C@@H]1CCCO[C@@H]1c1ccccc1 920387155 MGFPYEFLCHBVMB-FKFXBRQESA-N 345.442 5.132 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1F 108408292 BNNOTSPMHSNHJO-OLZOCXBDSA-N 332.419 5.390 30 20 EKED CCCCCCC[S@@](=O)Cc1csc(-c2cccs2)n1 132640988 BRKCKORURAGKPB-FQEVSTJZSA-N 327.540 5.091 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)C1(C#N)CCCCC1 173360789 KSMQRNLUYSOGFW-UHFFFAOYSA-N 330.497 5.049 30 20 EKED CC(C)c1ccc2occ(/C(O)=N/[C@H]3CCCC34CCOCC4)c2c1 329172137 AANIJRCQCRMAIC-IBGZPJMESA-N 341.451 5.210 30 20 EKED Cc1coc2ccc(N=C(O)c3cn(C)nc3C3CCCCC3)cc12 330038197 DTPOXAQZWRHMKJ-UHFFFAOYSA-N 337.423 5.159 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C)CCC#N 411526242 DCZRISJURNDLQC-RYUDHWBXSA-N 333.888 5.115 30 20 EKED C[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1F 426288407 JEKMYPYXEVCQQW-MEBBXXQBSA-N 334.847 5.140 30 20 EKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 474697264 KFEOXPKYIGCFPJ-HNNXBMFYSA-N 346.430 5.067 30 20 EKED N#C[C@@H](C(=O)c1cc(F)c2ccccc2c1)c1nc2ccccc2s1 495290724 ZYFUZUSSAJAWET-HNNXBMFYSA-N 346.386 5.079 30 20 EKED C=C(CN[C@@H](c1cccnc1)c1cc2ccccc2o1)c1ccccc1 498413858 MLAYPVMXHLXRCA-QHCPKHFHSA-N 340.426 5.220 30 20 EKED Cc1c([C@@H](C)Nc2nc(C(F)(F)F)ccc2C#N)oc2ccccc12 519566256 ZLWMKOAMDIKPLN-LLVKDONJSA-N 345.324 5.200 30 20 EKED C=CCCC1(C(=O)N(C)c2ccc(Cl)c(C(F)(F)F)c2)CC1 564000383 KLGGLFQSNZEMHK-UHFFFAOYSA-N 331.765 5.068 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC(CCC#N)CC1 566186754 JUYMHYZWUOCHCG-UHFFFAOYSA-N 341.499 5.310 30 20 EKED Cc1c([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 570590214 HWPNZJGNTYVWRS-YWZLYKJASA-N 330.431 5.341 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccc(F)cc2)C2CCC2)cc1 591698981 OVDWLUKBDSSVKL-NRFANRHFSA-N 325.427 5.022 30 20 EKED C[C@@H]1CCC[C@@H](CNC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 609438546 JZFSYVFDIIOTII-BZUAXINKSA-N 345.512 5.029 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccs2)cc1 610829994 WBLGCHSDMVOOHA-HZPDHXFCSA-N 332.472 5.699 30 20 EKED COc1ccc2cc([C@H](C)SCc3ccnc(C#N)c3)ccc2c1 610954351 IZRPGOKDSAXNDO-AWEZNQCLSA-N 334.444 5.109 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@H](c2ccc(Cl)cc2)c2cccs2)C1 613255185 XJUYIKVKMPFOSB-MZMPZRCHSA-N 330.884 5.163 30 20 EKED CCc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613402939 KVWGLHCIZXLHCW-AWEZNQCLSA-N 340.835 5.002 30 20 EKED C=CCC[C@@H](N[C@@H]1CCCn2nccc21)c1ccc(C(F)(F)F)cc1 657929903 GULVKJKOENLYDM-IAGOWNOFSA-N 349.400 5.034 30 20 EKED C=CCC1(NC(=O)Nc2c(CCC)cccc2C(C)C)CCOCC1 666855692 FWQYOQZDPBXCNP-UHFFFAOYSA-N 344.499 5.009 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccc(C(F)(F)F)cc3)c2c1 734307821 SUHNCCIOGHCPBT-WTKPLQERSA-N 345.320 5.091 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(-c2ccncc2)cc1 745989904 GIJIDYAOGJIAQG-ONNFQVAWSA-N 336.394 5.193 30 20 EKED O=C(/C=C/c1cccc(-c2cccnc2)c1)c1ccc(O)c(Cl)c1 768754222 DOVHMKXWUGZVIF-SOFGYWHQSA-N 335.790 5.004 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cc4ccccc4[nH]3)c2)s1 788519737 FCWVVTIZKWPBHI-UHFFFAOYSA-N 343.455 5.058 30 20 EKED Cc1csc([C@@H](C#N)C(=O)C2(C3CCCCC3)CCCCC2)n1 796617404 BZNDPTXFWHEKDR-INIZCTEOSA-N 330.497 5.159 30 20 EKED Cc1ccc(NC(=S)N[C@H](CCCC#N)c2ccccc2)c(C)c1 814209478 BAMICKGFKIGPBK-LJQANCHMSA-N 337.492 5.025 30 20 EKED CCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917046515 KOLBWFFOWBCTRY-AAEUAGOBSA-N 334.872 5.342 30 20 EKED O=CCCCCCCCCCCCCCCCCCCC(=O)O 59685232 GESLCFZRPFBCTC-UHFFFAOYSA-N 326.521 6.292 30 20 EKED Cc1ccc(OC(F)F)c([C@H](C)N[C@@H](CCC#N)c2ccccc2)c1 90664536 MKYBJKMHNGMKAS-YJBOKZPZSA-N 344.405 5.292 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(OC(F)F)cc1 172906223 OOJCBVVYVINNGK-CYBMUJFWSA-N 348.418 5.152 30 20 EKED CC[C@@]1(C)CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 173123091 VHDAPHPHXKHJGO-BEFAXECRSA-N 345.512 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(C(C)C)s1 189884323 FZLPKJDRFVQFAU-UHFFFAOYSA-N 328.481 5.371 30 20 EKED C[C@@H]1CCc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@@H]1C 410978374 CVYJWNCUCOROET-GHMZBOCLSA-N 340.448 5.028 30 20 EKED Cc1oc(-c2cccs2)nc1CSCCCCC(C)(C)C#N 435885500 KVZSMEQALQCSNT-UHFFFAOYSA-N 334.510 5.665 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)cc1 442911860 BKXWTLLLHSZQAR-AWEZNQCLSA-N 349.459 5.585 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H]3CCC[C@@H](C#N)C3)s2)cc1 463235729 DIUSADQGMHNYDU-LESCRADOSA-N 339.508 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCC[C@@H]1SCC 475559073 BSPYQMKWMSIUBY-MSOLQXFVSA-N 346.540 5.334 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](c2cccc(Cl)c2)C1)c1ccccc1 496740041 SWWPSIYRYHCKHK-APWZRJJASA-N 339.866 5.016 30 20 EKED C[C@@H](CC(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccccc1 515689502 HTNAQBAZQDZWQI-HNNXBMFYSA-N 346.455 5.419 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1cccc(CCC(F)(F)F)c1 537251642 YSLPENUFJGRREC-ZDUSSCGKSA-N 328.378 5.048 30 20 EKED C[C@@H](NCc1ccc(Cl)o1)c1ccc(-c2cccc(C#N)c2)cc1 544041292 GJMIRDXROWMNEG-CQSZACIVSA-N 336.822 5.322 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1C(F)(F)F 553261871 WRWQHPWJTBJYLO-ORAYPTAESA-N 344.380 5.305 30 20 EKED C=CCCC1(c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)CC1 558388575 QHEKTFZCWNOLAP-CYBMUJFWSA-N 340.320 5.145 30 20 EKED Cc1cc(C)cc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c1 582034581 HOJWYNRMTRPUMO-AWEZNQCLSA-N 332.369 5.045 30 20 EKED N#CCCCCCC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F 588673641 WYOYVMBNRZAWKO-GOSISDBHSA-N 348.368 5.033 30 20 EKED CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)s1 619755316 WZNQOQDOGQDTJU-ZDUSSCGKSA-N 325.264 5.167 30 20 EKED Cc1ccsc1-c1nnc(S[C@@H](C#N)c2ccc(Cl)cc2)o1 619864441 PQLUITCXIUCCSS-LBPRGKRZSA-N 347.852 5.117 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccc(C#N)cc1 727267104 CPAHRPXGWCTBME-WDZFZDKYSA-N 348.402 5.025 30 20 EKED CCCCCCCCC(=O)N1CCC(OC2CCC(C)CC2)CC1 730971936 FDDWRJXGBJXFII-UHFFFAOYSA-N 337.548 5.323 30 20 EKED CC[C@@](C)(C#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732658221 FQFDDTPVZVNCBL-KRWDZBQOSA-N 334.872 5.100 30 20 EKED C=CCOc1ccccc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741472084 FDDCCRCPJBSOIU-KHPPLWFESA-N 341.410 5.210 30 20 EKED C#CCCCC(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 760236945 PPOATWXAZLXNCD-OAHLLOKOSA-N 340.854 5.255 30 20 EKED C[C@@H](CCc1ccc(Cl)s1)Nc1ccccc1O[C@@H](C)C#N 780744660 LSZJHBRVMTYZJE-STQMWFEESA-N 334.872 5.126 30 20 EKED C#CC[C@H](N[C@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccccc1 808709216 VVTJCDNEMVZJSC-UNMCSNQZSA-N 328.459 5.208 30 20 EKED CCOc1c(Cl)cc(N[C@@H](C)c2cccc(C#N)c2)cc1Cl 864008927 JPZMEMHHTIODPT-NSHDSACASA-N 335.234 5.437 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Br)cs1 194121282 MUUXGZALKNNRCI-SWLSCSKDSA-N 349.297 5.206 30 20 EKED C[C@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1ccc(OCC#N)cc1 327067554 CCZHXPDMNAZKCC-SJORKVTESA-N 336.479 5.298 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1=CCC(C)(C)CC1 455518311 SYZMOFITFSOHSV-AWEZNQCLSA-N 328.481 5.013 30 20 EKED N#Cc1cc(F)ccc1NCc1ccc(COCc2ccccc2)cc1 462923695 GZYZRYQLJLIEOQ-UHFFFAOYSA-N 346.405 5.026 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 466656977 XWZVAVTVWYANFG-OLZOCXBDSA-N 346.471 5.037 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1 469156960 JMRKGHYALGSALG-UHFFFAOYSA-N 347.245 5.539 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]1Cc1ccccc1 475578043 LASBMIVJMLKPHM-FQEVSTJZSA-N 348.490 5.387 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 480670815 MFPQXTGTWOYCGT-DJJJIMSYSA-N 346.377 5.149 30 20 EKED C[C@@H](Sc1c(C#N)cccc1C#N)c1cccc(Br)c1 488744182 JTIHTRSPEGAXSN-LLVKDONJSA-N 343.249 5.046 30 20 EKED C[C@@H](NC(=O)Nc1cccc(-c2ccccc2)c1)c1ccc(C#N)cc1 495494732 GVWSTYUKKCQWPF-MRXNPFEDSA-N 341.414 5.108 30 20 EKED C=CCCc1ccccc1NC(=O)CCCCC(=O)c1ccc(C)cc1 504291028 XEHUDAUYUZDDBH-UHFFFAOYSA-N 349.474 5.495 30 20 EKED C=CCC[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1ccco1 552226011 SXIJMTCRIMDELY-MRXNPFEDSA-N 339.357 5.018 30 20 EKED C=C[C@H](CC(=O)N1CC(C)(C)[C@@H]1c1cccs1)c1ccccc1 564003780 NSDJLDQRFWKUOO-BEFAXECRSA-N 325.477 5.018 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@@H](C#N)c1ccc(Cl)cc1 595414566 FFOXWHNZESIHPJ-KDOFPFPSSA-N 328.843 5.043 30 20 EKED C[C@H](Nc1ccccc1NC(=O)C[C@H]1C=CCC1)c1cccc(C#N)c1 601920385 GAZQIZPIOZQESD-IRXDYDNUSA-N 345.446 5.026 30 20 EKED C=CCCCCCN(C)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 606814065 GCGXBMAEAPIPAN-SJORKVTESA-N 339.401 5.014 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2cccc(C(F)F)c2Cl)C1 666700385 AVYDGVURCWYLFT-NSHDSACASA-N 328.790 5.098 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C\Sc1ccccc1 728005423 KGOPOOPNIHSTAP-BENRWUELSA-N 349.908 5.222 30 20 EKED FC(F)(F)c1nc(NN=C2CCC[C@@H](C3CC3)C2)c2ccccc2n1 737427240 KERZBHFEYLHMFY-GFCCVEGCSA-N 348.372 5.017 30 20 EKED C[C@@H](ON=C(c1ccccc1)C(F)(F)F)c1ncc(C(C)(C)C)o1 751965212 JVPNXAIRKAUFCX-LLVKDONJSA-N 340.345 5.016 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(OCC(=C)Cl)cc1)c1ccncc1 766022532 WTQVTBSHQLVYRV-OXQOHEQNSA-N 342.870 5.181 30 20 EKED Cc1ccc(C)c2c1CC/C(=C\c1cnc(-c3ccccn3)s1)C2=O 769746821 QGUXGHKDRZCOBI-RVDMUPIBSA-N 346.455 5.034 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nccc2ccccc12 802812903 HKAJVTDRMVMALL-UUXHPUJUSA-N 332.447 5.018 30 20 EKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1cccc(Cl)c1Cl 804464296 SQXQOIMAACAAMR-ZCFIWIBFSA-N 332.643 5.148 30 20 EKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3)cc2)cc1 213640926 GAZOPDAFFSUMRJ-NVNXTCNLSA-N 339.394 5.152 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc1C 264513802 ZGHZAVJTUSSJGH-GFCCVEGCSA-N 330.478 5.012 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C)o1 282948225 AVDBMPJBAIBMLX-UHFFFAOYSA-N 326.440 5.104 30 20 EKED N#CCCC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccc1 340445182 LSTZDBAOFJJRJW-PKTZIBPZSA-N 343.474 5.351 30 20 EKED N#CCCC[C@H](Nc1ncnc2cc(Cl)ccc12)c1ccccc1 431142976 HWPXSLBHWNEUJT-KRWDZBQOSA-N 336.826 5.130 30 20 EKED C=CCC[C@@H](NC(=O)c1oc2ccccc2c1COC)c1ccccc1 435279556 PJNPXHZQLXLTPL-LJQANCHMSA-N 349.430 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H](C)[C@H]1C 475572868 ZZNZKGYQCXQNDM-IXDOHACOSA-N 328.500 5.437 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ccc(C)cc1 476168187 WONMVLMWZMEXHS-UHFFFAOYSA-N 335.491 5.808 30 20 EKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 477543443 PIRVSVPXJGFJRX-KRWDZBQOSA-N 349.478 5.330 30 20 EKED N#Cc1cccnc1N[C@@H](c1ccccc1)c1ccc2ccccc2c1 518318554 JIXWZLKXPQYIDJ-QFIPXVFZSA-N 335.410 5.308 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1sccc1Br 537948839 HGCHLDLDOBASHL-SWLSCSKDSA-N 349.297 5.206 30 20 EKED CC(C)(C#N)c1ccccc1CNC(C)(C)c1cccc(Cl)c1 540414603 NVAHHQLSVBVMHI-UHFFFAOYSA-N 326.871 5.166 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cccc(-c3ccncc3)c2)cc1 552317819 IJAYDZSLMMWNBF-SFHVURJKSA-N 344.458 5.164 30 20 EKED C=C(C)[C@@H](NCc1cscc1C(F)(F)F)c1ccc(F)c(F)c1 558575655 SXDUBLFHKUJBEN-OAHLLOKOSA-N 347.352 5.452 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NC(=O)CCCCCC#N)c1 588755860 OENLBRIGDABKHD-UHFFFAOYSA-N 344.402 5.062 30 20 EKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)c2ccccc2F)c1 589739478 POGINEMMLVSGHF-HNNXBMFYSA-N 342.414 5.006 30 20 EKED N#CCCCCC(=O)N[C@H](c1ccccc1)[C@H]1CCCc2ccccc21 593998908 RSFAEEUVIWSSRI-JTHBVZDNSA-N 346.474 5.048 30 20 EKED N#Cc1c(Cl)cccc1N1CCC(c2c[nH]c3ccccc23)CC1 603847109 OPYYMXLPTLYOPB-UHFFFAOYSA-N 335.838 5.077 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCC1CCCCC1 609427568 KUPCXVTWAPPWFN-OAHLLOKOSA-N 330.497 5.380 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(-c2ccncc2)c1 610830275 JFQQAUCMVKXVKH-SJORKVTESA-N 327.431 5.032 30 20 EKED CC(C)c1cccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1 611092681 IIKFQTLJLRJFKH-UHFFFAOYSA-N 333.218 5.241 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2ccccc2F)s1 618741677 KIAPRHNANDCCMY-FQEVSTJZSA-N 348.446 5.203 30 20 EKED Cc1ccc(NC(=S)Nc2ccccc2SC[C@H](C)C#N)cc1 730954953 PQPMQEVDBWVNEI-CQSZACIVSA-N 341.505 5.056 30 20 EKED CCCCCCCCC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 734783333 PAYATUOHSZDXHC-IBGZPJMESA-N 344.543 5.079 30 20 EKED C=CC[C@H](NCc1ccc(-c2ccccc2OC)cc1)c1ccncc1 742371210 KEVHMOOAQZHSQI-QFIPXVFZSA-N 344.458 5.164 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1ccc(-c2ccncc2)cc1 745990775 XUSZTONJEXULFC-LREOWRDNSA-N 335.790 5.004 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)cs1 758306242 CWAJQUZHVBSFMR-SNVBAGLBSA-N 336.869 5.048 30 20 EKED C=CCC[C@H](NC1CC(C(F)F)C1)c1ccc(C(F)(F)F)cc1 769534316 ZCHOBGZNOLMTDL-ZALBZXLWSA-N 333.344 5.346 30 20 EKED C/C(=C/C(C)(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772161364 IOCURHYALBSPCR-FZWACIFYSA-N 332.447 5.273 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccncc1 774185488 CAMZWADOFDXACA-BZNIZROVSA-N 337.250 5.062 30 20 EKED C#CCOc1ccc([C@H](C)N[C@H](C)c2csc3ccccc23)cc1 776723686 SCDDSONKDLUUMZ-JKSUJKDBSA-N 335.472 5.325 30 20 EKED O=C1/C(=C/c2nc(Cl)cs2)CCc2[nH]c3ccc(Cl)cc3c21 790609931 QPSLJJAGOPPFOW-VMPITWQZSA-N 349.242 5.144 30 20 EKED Cc1cccnc1[C@H]1CCCC(=NNc2nccc3sccc23)C1 799108760 IVZLJVBADKREQK-AWEZNQCLSA-N 336.464 5.125 30 20 EKED N#CCCCCC(=O)O[C@H](c1ccccc1)c1cccc(Cl)c1 847716504 ROEGEAKWBWTPGQ-LJQANCHMSA-N 327.811 5.057 30 20 EKED O=C(/C=C\c1ccc(C(=O)O)c(F)c1)c1ccc(-c2ccccc2)cc1 1776131001 DBKRVWJUSOPXQR-QPEQYQDCSA-N 346.357 5.087 30 20 EKED CSc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1F 90665304 OABHGJFEJXOOMW-RDTXWAMCSA-N 328.456 5.243 30 20 EKED CSc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 108981205 DCAREOBSRLPISH-CYBMUJFWSA-N 342.489 5.055 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 192755469 ZDEIEXXGHSFAKS-ZHRRBRCNSA-N 330.406 5.138 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 410348424 JQCUGMMMRRAKPW-CABCVRRESA-N 325.374 5.112 30 20 EKED Cc1c(C#N)cccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 432282739 CHYPKBUGWDAOEK-FQEVSTJZSA-N 333.435 5.016 30 20 EKED CCC(CC)N(CC(C)C)C(=O)Nc1ccc(CC#N)cc1Cl 455710772 XZBUYFUIMXMSLF-UHFFFAOYSA-N 335.879 5.085 30 20 EKED N#Cc1ccc(NC(=O)c2cscc2-c2ccccc2)cc1Cl 463094514 TVSXKUHJQZYTTJ-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CC[C@@H](CC)NC(=O)c1ccccc1SCc1cccs1 466523863 BDSHSDRYKYRWPM-CQSZACIVSA-N 331.506 5.125 30 20 EKED C[C@@H](CCCC(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 480163087 VZMYPXDKAIVBNG-JOYOIKCWSA-N 331.275 5.140 30 20 EKED C=C(C)[C@H](NCc1ccc2nc(C)sc2c1)c1ccc(F)c(F)c1 494845795 JEUKLMBBTBCVFR-IBGZPJMESA-N 344.430 5.290 30 20 EKED CC(C)CCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 520837317 QRIMRRLDATWZKR-UHFFFAOYSA-N 344.402 5.086 30 20 EKED CCCN(C(=O)CCc1ccc(C#N)cc1)c1cccc2ccccc12 520917389 DSYLOLWYPOURTF-UHFFFAOYSA-N 342.442 5.087 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 534474141 YHAQUAKMFOIVQJ-BRWVUGGUSA-N 342.508 5.237 30 20 EKED COc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1 537012513 USMIHPCWDWIKRK-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 537289415 AAQFEYFLNAFLGA-OPAMFIHVSA-N 346.861 5.652 30 20 EKED C=CCC[C@H](N[C@H](C)c1cc(OC)ccc1OC)c1ccccc1 539045951 DAPJEVFPLULSDR-UZLBHIALSA-N 325.452 5.062 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCSc4ccc(Cl)cc43)CC2)c1 551806376 MUMSKYVKMJHSBY-QGZVFWFLSA-N 340.879 5.027 30 20 EKED Cc1coc2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc12 614119721 JBQKDWPNDGRXRO-UHFFFAOYSA-N 345.185 5.172 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3c(Cl)cccc32)cc1Cl 619755384 GYIATHMQWSEZRS-GOSISDBHSA-N 331.246 5.032 30 20 EKED N#Cc1ccc(NC(=S)Nc2cccc3ccccc23)cc1Cl 726433382 FJWQKRBZCOPXNE-UHFFFAOYSA-N 337.835 5.174 30 20 EKED COc1cccc(-c2nc(/C=C\C(=O)c3sccc3C)cs2)c1 733748599 DNYBPYYSNJFPKC-SREVYHEPSA-N 341.457 5.085 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCCC[C@@H]1c1noc(C)n1 737617307 YRSGJUFVFGHLGY-VHUCWBOISA-N 347.503 5.129 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(CC(F)(F)F)cc1 741466411 QEXIPSQSDMEBSU-UHFFFAOYSA-N 329.321 5.401 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)COC2 742435592 VSMGBEFWPKHGOT-JYRVWZFOSA-N 326.395 5.280 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)C1(C#N)CCCCC1 751251110 BYRBNWCGTXXKQQ-UHFFFAOYSA-N 330.497 5.298 30 20 EKED O=C(/C=C\c1ccc(F)nc1)c1ccc(Oc2ccccc2)c(F)c1 777468649 UYZIDXSZTPHTRV-TWGQIWQCSA-N 337.325 5.048 30 20 EKED CCCCCCC[C@@H](C)NC1CC(N2CCC(C(F)(F)F)CC2)C1 793233325 RMNUANGXLCECHR-FAEJEUNOSA-N 348.497 5.130 30 20 EKED C=CC(C)(C)CCCNc1ccc([S@@](=N)(=O)C(F)(F)F)cc1 882715108 LKJPQPNNIIIXGU-JOCHJYFZSA-N 334.407 5.016 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 914773522 LYKCYEOKLRMALZ-BQYQJAHWSA-N 327.380 5.055 30 20 EKED N#C[C@@H](C(=O)CC1CCCCC1)c1nc2cc(Cl)ccc2s1 917043003 FPHHYEAGEYPGMQ-ZDUSSCGKSA-N 332.856 5.096 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccc2)cc1 35339702 MNHBSEGBGXKXMM-PFONDFGASA-N 339.394 5.033 30 20 EKED CCCCCCCCCN(C)C(=O)Nc1cc(NC(C)=O)ccc1C 128399320 FRKKMVYKYVKMBM-UHFFFAOYSA-N 347.503 5.168 30 20 EKED N#CCCCOc1cccc(NCc2cc(Cl)cc(Cl)c2)c1 237701487 OPSCOVVSLGJGAD-UHFFFAOYSA-N 335.234 5.288 30 20 EKED Oc1ccccc1C=Nc1ccc(O)c(-c2nc3ccccc3s2)c1 254401061 UZEHMVRGLARGHX-UHFFFAOYSA-N 346.411 5.125 30 20 EKED C[C@H](Nc1ccccc1OCc1ccccc1)c1cccc(C#N)c1 310848229 ABWGRZSBYYIKSQ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED N#CCCC[C@H](NC(=O)c1cccc(-c2ccoc2)c1)c1ccccc1 352207352 WQKIUSWWUPOSLF-NRFANRHFSA-N 344.414 5.112 30 20 EKED CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438049745 LPWMQLNZQMURMA-RRFJBIMHSA-N 333.501 5.027 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1cc(Cl)c(Cl)cc1Cl 439852874 IMYSAMBDJQBEIX-UHFFFAOYSA-N 339.609 5.079 30 20 EKED CC[C@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 447561362 HZPDSSZQWCCGIJ-HXOBKFHXSA-N 341.458 5.422 30 20 EKED CC[C@@H](N[C@@H]1CCCOc2cc(Cl)ccc21)c1ccc(C#N)cc1 447578681 GKGXAFNWJMQYCW-RTBURBONSA-N 340.854 5.166 30 20 EKED CCC1(CC)CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1 458832740 IGTYMRDRIKYOQN-LJQANCHMSA-N 341.499 5.033 30 20 EKED CC(C)(NCc1ccc(F)c(C#N)c1)c1ccc(Cl)c(Cl)c1 468272740 XFPUIGLNTGTRCP-UHFFFAOYSA-N 337.225 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCCC[C@H]1C 476087663 BRSBNYYOYULHRS-APWZRJJASA-N 329.484 5.072 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(CC2CC2)nc1C 476141418 JSDFDSAPVJAYFQ-UHFFFAOYSA-N 338.451 5.040 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(SCC)c1 506855795 HCJRELMEIDGROC-UHFFFAOYSA-N 340.492 5.061 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@H](c2cccs2)C2CC2)CC1 507655129 ZSSFUOXPLIGLNL-CKHPTIKVSA-N 336.504 5.193 30 20 EKED CCCc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518241118 XDYWWVBTTDETCV-HNNXBMFYSA-N 338.476 5.286 30 20 EKED CC(C)[C@@H](NCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 532669700 RNNCNWWYXYIFRK-GOSISDBHSA-N 332.369 5.064 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1CSC 545433330 AGUKUNQXAOLTFY-UHFFFAOYSA-N 332.513 5.150 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 559863755 MDHQNQMRHRQIIM-HZPDHXFCSA-N 332.900 5.877 30 20 EKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1csc2ccccc12 730019107 GBXGKCATOOBBSL-INIZCTEOSA-N 349.503 5.102 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 739142185 HAEPNYXWCJKWFL-WMLDXEAASA-N 348.471 5.229 30 20 EKED Cc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1F 740013321 DDFDEIQUKUYGNI-UHFFFAOYSA-N 336.435 5.024 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2nccc3ccccc23)c1 757474898 MVYMNAAPEXIOPK-BQYQJAHWSA-N 339.341 5.041 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2cccc(-c3ccccn3)c2)c(Cl)c1 788360176 HPOAOSIIKSFXFJ-CSKARUKUSA-N 344.801 5.170 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100187 KRHVSZJSIIITSC-IFMUVIIVSA-N 346.817 5.168 30 20 EKED O=C(/C=C\c1ccc(OCC(F)F)cc1)c1c(F)cccc1Cl 809159604 SKIKVDOQGVHFFW-TWGQIWQCSA-N 340.728 5.019 30 20 EKED C[C@H](Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)o1)c1ccccc1 118172853 DORSHPJBJAYQCS-HUUCEWRRSA-N 349.459 5.141 30 20 EKED C[C@@H](SCc1nnc(-c2ccccc2)s1)c1ccc(C#N)cc1 127564677 MLSNFUNJGLLBJB-CYBMUJFWSA-N 337.473 5.071 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccn1)C1CC1 191484635 AGPITYDDLGTJCQ-UHFFFAOYSA-N 349.478 5.130 30 20 EKED COc1ccc2oc([C@H](C)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 358344243 VXVUOFIKVCEBBJ-OXJNMPFZSA-N 348.446 5.446 30 20 EKED Cc1nc([C@H](C)SCC2(C#N)CCC2)oc1-c1ccc(Cl)cc1 419586092 QWBPIWNOCUUHBP-ZDUSSCGKSA-N 346.883 5.792 30 20 EKED CCC(CC)CN(CCC#N)C(=O)Nc1cc(Cl)ccc1Cl 426643949 AMCBUTOFKAIJKW-UHFFFAOYSA-N 342.270 5.177 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H]3CCC[C@@H](C#N)C3)s2)cc1 463235731 DIUSADQGMHNYDU-YXJHDRRASA-N 339.508 5.160 30 20 EKED C=CCC[C@H](NC(=O)c1cc(C)oc1C(F)(F)F)c1ccccc1 472397921 PNGFETPNQPOEBW-HNNXBMFYSA-N 337.341 5.044 30 20 EKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1nccc2ccccc12 483229319 KMFGKPDFBAAQJH-INIZCTEOSA-N 346.386 5.079 30 20 EKED CC(C)(C#N)c1ccccc1CNC1(c2ccc(F)cc2)CCCC1 487416492 XOGVYTJGBNNYOD-UHFFFAOYSA-N 336.454 5.186 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(-c2cnco2)cc1)c1ccccc1 488680659 BOSHCSNEYBOSDQ-IBGZPJMESA-N 332.403 5.030 30 20 EKED CC(C)(C#N)CCCCN1CCC([C@@H](F)c2ccccc2F)CC1 511104387 FHFOWLCAAKZZRO-LJQANCHMSA-N 334.454 5.268 30 20 EKED C[C@@H](SCC(=O)Nc1ccc(C#N)cc1)c1cccc2ccccc12 518014230 USWJAVQRKOQVNN-OAHLLOKOSA-N 346.455 5.144 30 20 EKED N#CC1(c2ccc(C(=O)Nc3cccc(-c4cccs4)c3)cc2)CC1 540732025 AOYPSPKJCTYOQU-UHFFFAOYSA-N 344.439 5.223 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 550826198 BMASHXZRWDNELB-WZONZLPQSA-N 328.459 5.926 30 20 EKED CC(C)n1ccnc1SCc1ccc(-c2ccccc2C#N)cc1 591605863 GAZNECWTTLZHTJ-UHFFFAOYSA-N 333.460 5.295 30 20 EKED CCC(CC)[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccs1 604083788 ZGTDTNITQICGCG-SFHVURJKSA-N 341.480 5.113 30 20 EKED CC(C)(C)c1ccc(CCCC(=O)Nc2ccc(CC#N)cc2)cc1 608932977 HCTGTSVVOUDTTK-UHFFFAOYSA-N 334.463 5.012 30 20 EKED Cc1nc(-c2ccc(N[C@H]3CCCc4cc(C#N)ccc43)cc2)oc1C 611482456 KYSQAPMLAYVOAL-NRFANRHFSA-N 343.430 5.320 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2)s1 612571061 OYLVYQGVBKDTLX-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC(C)(C)CCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 729069936 JHUILXFBPKYTBN-GFCCVEGCSA-N 334.872 5.342 30 20 EKED Cc1nc(C)c2c(C)c(C=NNc3cccc4ccccc34)sc2n1 747060106 HNWUWECMKBWEJD-UHFFFAOYSA-N 346.459 5.216 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CC[C@@H](C)C3)n2)cc1 759538942 NYVDPVZKSBJKRD-BFYDXBDKSA-N 338.476 5.121 30 20 EKED CC(C)C[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 765590223 JXNOOZOEJHDXIE-IUODEOHRSA-N 346.883 5.322 30 20 EKED CC(=NNc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1Cl 767336677 SUFFUKPLEWWEBB-UHFFFAOYSA-N 338.625 5.355 30 20 EKED CC(C)(C#N)CCCOC(=O)CCCc1cc(Cl)sc1Cl 784084789 SBYWHPSEWKBCKM-UHFFFAOYSA-N 348.295 5.251 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1cccc(Cl)c1 916137506 ANUWZTBYRCDJLL-KTKRTIGZSA-N 325.820 5.360 30 20 EKED C=CC1(CC(=O)Nc2ccc3sc(C(=O)O)cc3c2)CCCCC1 1776150631 RLOKHZOTHRMKIB-UHFFFAOYSA-N 343.448 5.065 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N(CCC#N)CC2CC2)c(C)c1 78534670 PJTBKRLNYSQPBF-HNNXBMFYSA-N 345.512 5.043 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/c2ccc3ccc(Cl)cc3n2)cc1 110972598 GYWAWGFWXQFBCQ-JPFFYJABSA-N 334.806 5.349 30 20 EKED C=CCCCN(C)[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 129653999 MRFAJNBDNHLJPH-LLVKDONJSA-N 340.254 5.002 30 20 EKED C=CC[C@H](C)[C@H](C)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 179904646 YPWGKTBETKYBHW-XFAGBWLFSA-N 341.520 5.148 30 20 EKED CC[C@@H]1C[C@@H](/C(O)=N/[C@@H]2CCCc3ccc(C(C)C)cc32)CC(O)=N1 329724427 DDFBGLYDCKHIJR-ZHALLVOQSA-N 342.483 5.289 30 20 EKED Cc1nnc(SCCCCC(C)(C)C#N)n1[C@@H]1CCC[C@H](C)C1 436194618 PKDYXTLROKANFV-GOEBONIOSA-N 334.533 5.150 30 20 EKED C[C@@H](N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1(C)CC1 438688331 VMIQZBXWVFNCNM-OAHLLOKOSA-N 349.434 5.003 30 20 EKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 461922639 NOXQIKSWIIEKBX-HZPDHXFCSA-N 346.430 5.018 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2C(=O)[C@H](C)c2cccc(C#N)c2)cc1 462270533 IWRQBCSVGWETKO-VGSWGCGISA-N 346.474 5.149 30 20 EKED C=CCOCCCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 463301195 OOZVVOSVUSRROT-UHFFFAOYSA-N 345.826 5.054 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccccc2C)C(C)C)cc1OC 482139960 JIHFCWHBTFKBRU-JOCHJYFZSA-N 339.479 5.055 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 489084757 XQFXSRLPFCOYOV-OAHLLOKOSA-N 340.389 5.099 30 20 EKED C=CCC[C@H](NC(=O)N(C)Cc1cccc2[nH]ccc12)c1ccccc1 494814388 USCNWPAMTYZZIL-FQEVSTJZSA-N 347.462 5.017 30 20 EKED Cc1ccc([C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)cc1 504984191 ZTDHZNAICRSNPF-HXUWFJFHSA-N 347.462 5.069 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccccc1C#N 525599385 ONBFPDHGBNAWMM-HUUCEWRRSA-N 338.476 5.191 30 20 EKED N#CCCCCCC(=O)N(Cc1ccc(Cl)cc1)c1ccccc1 588891200 ZAJRHSLBDOOCGQ-UHFFFAOYSA-N 340.854 5.347 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc2ccccc12 615373345 LBTGRBCZMRTHJX-UHFFFAOYSA-N 334.394 5.199 30 20 EKED COCCCC[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1 619465941 LRLOOBIXWWBYEO-GOTSBHOMSA-N 348.490 5.083 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(C(F)F)nc1)c1ccc(F)c(F)c1 657980319 AZNVVYGXKQDLPT-APPDUMDISA-N 338.348 5.265 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@@H]1C 669727764 WCVWEHKWIHKRIS-HNNXBMFYSA-N 338.426 5.096 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CCC(F)(F)F 682777363 OLZHFNOMIBRUJR-UHFFFAOYSA-N 342.405 5.345 30 20 EKED Cc1nc(/C=C/c2cccs2)sc1C(=O)/C=C\c1cccs1 726847479 BARTVXASIDYNPL-MKKAVFGOSA-N 343.498 5.641 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@@H](CC(C)(C)C)c2ccccc2)cc1 728712091 ZMQXQIOFVCGIKS-UTKZUKDTSA-N 336.479 5.245 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1cc2cc(Cl)ccc2o1 742432178 UGUMXZJROABULR-FPLPWBNLSA-N 348.789 5.372 30 20 EKED CC(C)(C#N)c1ccccc1CON=Cc1ccccc1C(F)(F)F 767825143 NSWBAPZKXKSVHD-UHFFFAOYSA-N 346.352 5.057 30 20 EKED CCC(CC)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccs1 776161692 ZIDGYUHUHBVAGK-MGPUTAFESA-N 342.508 5.479 30 20 EKED CC(C)(C)[C@H](NCc1ccc(OCC#N)cc1)c1cc2ccccc2o1 779409282 JYTQJQOLZRADPE-OAQYLSRUSA-N 348.446 5.212 30 20 EKED COc1cccc2cc(C(=O)/C=C\c3ccnc(Cl)c3Cl)oc12 791436092 ZDDZDAJWXIBNAN-WAYWQWQTSA-N 348.185 5.039 30 20 EKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1nccnc1C(C)C 799485718 NILDOIFMUODZDR-UHFFFAOYSA-N 349.482 5.237 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(F)c3ccccc23)cc1 808437906 YGILSBOXLSXKGT-HOTGVXAUSA-N 348.421 5.121 30 20 EKED CCCCCC[C@H](CC)CN(C)C(=S)Nc1ccccc1C#N 853045193 COVLIHGEYJVCAU-INIZCTEOSA-N 331.529 5.183 30 20 EKED Cc1cc(C(=O)/C=C\c2ccc(Br)s2)c(C)s1 916155831 FHGFDXBUCREVRH-HYXAFXHYSA-N 327.268 5.085 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 90665296 YNOBGEXSQKRWGT-VQIMIIECSA-N 347.487 5.506 30 20 EKED CC[C@H](C#N)Sc1nnc(-c2ccccc2Cl)n1C1CCCC1 126953102 JCVJPXOSVUUSQI-CYBMUJFWSA-N 346.887 5.108 30 20 EKED C=CCC1(C(=O)Nc2ccc(SCc3cccnc3)cc2)CCC1 191590637 VOQPWACOVAKLIY-UHFFFAOYSA-N 338.476 5.059 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CC1CCCCC1 303525633 FZOSQDSYLBXWHM-HOTGVXAUSA-N 344.524 5.483 30 20 EKED C[C@@]12CC3CC(/C(O)=N/Cc4nc5ccccc5o4)(C1)C[C@](C)(C3)C2 329076387 AVDOUHOETOFLRM-DELCKGKKSA-N 338.451 5.281 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1 352179852 CTWLCQDMGCZSAU-NQIIRXRSSA-N 334.463 5.040 30 20 EKED N#CCCC[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccccc1 352192332 LSOZNLPKRQEOIA-UNMCSNQZSA-N 346.474 5.048 30 20 EKED N#CCOc1cccc(NCc2ccc(F)c(-c3cccs3)c2)c1 391922756 UZOHMYIAEVWLMR-UHFFFAOYSA-N 338.407 5.069 30 20 EKED C=CCCc1ccccc1NC(=O)c1nc(-c2ccco2)sc1C 410362324 BVMKBIHEHDYZCT-UHFFFAOYSA-N 338.432 5.082 30 20 EKED C=CCCCC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1 479832726 VBTDGJDWTIZRLN-QGZVFWFLSA-N 337.463 5.238 30 20 EKED C=CCCc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 505028890 JVMHMSNFDRUPCG-UHFFFAOYSA-N 349.434 5.132 30 20 EKED CCC(CC)N(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 530706588 BFHSUBJGCBUODS-AWEZNQCLSA-N 345.512 5.266 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1ccc(C#N)cc1 531580934 BWZSORAEGSJTOZ-INIZCTEOSA-N 347.487 5.183 30 20 EKED Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N 538072983 CGFSMLVFZJNJMR-RYUDHWBXSA-N 344.505 5.029 30 20 EKED Cc1sc([C@H](C)NCCC(C)(C)C#N)nc1-c1ccc(Cl)cc1 542574630 PVAMLSPZORFMBI-LBPRGKRZSA-N 347.915 5.362 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCSc4c(Cl)cccc43)CC2)c1 551805318 QCSJIHSJQRDCMY-QGZVFWFLSA-N 340.879 5.027 30 20 EKED C=CCC[C@H](N[C@H](C)c1cncnc1C)c1ccc(C(F)(F)F)cc1 570739739 SRIBXBBLAVXLQE-KDOFPFPSSA-N 349.400 5.162 30 20 EKED C=CCCC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 588216679 RMEPEZUFMRPNTC-AWEZNQCLSA-N 328.843 5.418 30 20 EKED C[C@@H](Nc1cccc(-c2ccc3c(c2)CCO3)c1)c1cccc(C#N)c1 600853230 ZIZGAHKXPLIQKM-MRXNPFEDSA-N 340.426 5.333 30 20 EKED C[C@@H](Sc1ccc(Cl)cc1C#N)c1nc(-c2cccs2)no1 610655194 UFIUXSNEJNKMJF-SECBINFHSA-N 347.852 5.176 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1nc(-c2ccccc2)cs1 618807178 VEABSVSSIXQZIM-LIRRHRJNSA-N 345.471 5.020 30 20 EKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 647377367 GQDOFNFANWCGNM-OAHLLOKOSA-N 342.489 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccn(CC)c1 683040679 QBOXFRXGPBXRIH-UHFFFAOYSA-N 339.483 5.024 30 20 EKED Cc1cc(/C=C2\Cc3ccccc3C2=O)ccc1Oc1cccnc1 732714379 YNBMHTKVJXOJMU-LDADJPATSA-N 327.383 5.005 30 20 EKED C=CCCCSc1nn(-c2ccc(Cl)cc2)c(=S)s1 735412606 GABVTEJFHATVBW-UHFFFAOYSA-N 328.915 5.375 30 20 EKED COc1ccc2oc(C(=O)/C=C/c3nccc4ccccc34)c(C)c2c1 740765853 XURPKEFCXBKKTK-CMDGGOBGSA-N 343.382 5.194 30 20 EKED COc1cc(/C=C/C(=O)c2cc3ccc(C)cc3o2)cc(Cl)c1O 754825933 SQHBASDUUWQTTK-GQCTYLIASA-N 342.778 5.005 30 20 EKED C#CCCCCCC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 779924775 FXYDMGVWWSXJSN-UHFFFAOYSA-N 342.826 5.050 30 20 EKED O=C(/C=C/c1cc(-n2ccnc2)cs1)c1cc2ccccc2s1 780187358 DLBMQTMWUFLIHY-AATRIKPKSA-N 336.441 5.045 30 20 EKED C/C(=C/c1ccc(C)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567833 MRTLNRBRQBVWFK-DNXIFWLFSA-N 338.476 5.029 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1 856373581 PPNTWAKHBVSXIO-UHFFFAOYSA-N 344.455 5.049 30 20 EKED N#Cc1cc(F)ccc1N1CCC[C@@H]1c1ccccc1C(F)(F)F 864006889 OOUMDQUVMJNJFS-QGZVFWFLSA-N 334.316 5.058 30 20 EKED Cc1cccc(-c2nnc(SCCCCC3(C#N)CCC3)o2)c1 901366600 WCRQRFBJPPKEIR-UHFFFAOYSA-N 327.453 5.001 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1ccc(N2CCCCC2)cc1 916286949 ZYOBEXDQKXOJRT-UHFFFAOYSA-N 344.462 5.061 30 20 EKED N#Cc1cccc(CSc2ncc(-c3ccc(Cl)cc3)o2)c1 11300416 JIBYUPVYZOOMGE-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CCN(Cc1ccc(Cl)c2cccnc12)[C@@H](C)c1ccc(C#N)cc1 60469654 RBGQNKQXTAMLST-HNNXBMFYSA-N 349.865 5.343 30 20 EKED C=CCCCN(C)[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 119291364 UMNPGJCYVHYZBF-NSHDSACASA-N 340.254 5.002 30 20 EKED C[C@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(C#N)cc1 181901555 IRYNMGVMYGDXCL-YCRPNKLZSA-N 347.849 5.047 30 20 EKED COc1cccc2cc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)oc12 182052946 HJRNUBPXUOIRBF-QAPCUYQASA-N 334.419 5.137 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(OCC#N)cc1 193013838 RUVSBALTDVWLKH-YWZLYKJASA-N 340.442 5.166 30 20 EKED CC(C)c1nc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cs1 340447092 OZKHUOOLQBORHN-DOTOQJQBSA-N 327.497 5.352 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCC(C)(C)CCC#N)cc2)cs1 343252198 IWVCOOCGUWUUFL-AWEZNQCLSA-N 327.497 5.099 30 20 EKED Cc1nc(SCCCCC(C)(C)C#N)[nH]c1Cc1ccccc1 436141600 XAQLDZNATRNOLD-UHFFFAOYSA-N 327.497 5.121 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1SC 471129517 CFKKZFDPMAGVBL-UHFFFAOYSA-N 326.465 5.019 30 20 EKED C=CCC[C@@H](NC(=O)c1cc(C)oc1C(F)(F)F)c1ccccc1 472397922 PNGFETPNQPOEBW-OAHLLOKOSA-N 337.341 5.044 30 20 EKED CC(C)C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cccs1 475113037 FOXLTTTYPGPLOK-QZTJIDSGSA-N 340.492 5.039 30 20 EKED C[C@@H](SCc1ccccc1C(C)(C)C#N)c1nc2ccccc2o1 481922704 NNZDDHNVLLILNT-CQSZACIVSA-N 336.460 5.623 30 20 EKED CC(C)[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 497798867 IWCOSKGVKGTYOP-KBXCAEBGSA-N 340.854 5.226 30 20 EKED CCc1c(C)sc(NC(=O)C[C@@H](CC)c2ccccc2)c1C#N 504905141 DBNJBODAGSCCCZ-CQSZACIVSA-N 326.465 5.013 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccncc1 505034195 BGHNAHQPABFGDC-OAQYLSRUSA-N 349.478 5.349 30 20 EKED N#CCCCOc1cccc(NC(=O)CCCC2CCCCC2)c1 516007998 GFSSWJWGCDUHCF-UHFFFAOYSA-N 328.456 5.058 30 20 EKED C=C[C@H](CC(=O)Nc1cc(C)ccc1Br)c1ccccc1 534161435 VGDIZLPWBQUFPW-CQSZACIVSA-N 344.252 5.056 30 20 EKED C=CCC[C@H](NCc1ncc(-c2ccccc2C)o1)c1ccccc1 537158420 AHLUJDNMOAMBGU-FQEVSTJZSA-N 332.447 5.447 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 539048640 RCXPHSFBJOQSTF-KBXCAEBGSA-N 334.385 5.459 30 20 EKED C[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 539506496 JGLFFEVKPVQALG-DIFFPNOSSA-N 331.246 5.203 30 20 EKED C=CCC[C@@H](N[C@@H]1CCCc2nc(CC)sc21)c1ccccc1 540146138 AKJMYNVQXNNEIA-IAGOWNOFSA-N 326.509 5.380 30 20 EKED CC(C)Oc1ccc2ccccc2c1CN[C@H](C)c1cccc(C#N)c1 545236218 ZYTMNJUSJNNBMX-QGZVFWFLSA-N 344.458 5.349 30 20 EKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cc2c1 562172614 XMNCURAMXSWRCZ-CYBMUJFWSA-N 340.473 5.280 30 20 EKED N#CCC[C@H](N[C@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593606415 FHLNWGHLRPQCOA-IRXDYDNUSA-N 328.818 5.101 30 20 EKED C[C@H](CC#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 597132724 VBFHHFSWGLZWNK-ZIAGYGMSSA-N 341.842 5.001 30 20 EKED C=CCN(Cc1ccccc1)C(=O)[C@H](C)c1ccccc1C(F)(F)F 607787701 BDPHAFWMBPFFLC-OAHLLOKOSA-N 347.380 5.024 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@H]2CCc3cc(C#N)ccc32)o1 618743164 YTIPGJANKSKQEG-NRFANRHFSA-N 346.405 5.043 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-c2ccco2)cc1F 619202850 YUQWYWSJSOFWJS-NRFANRHFSA-N 346.405 5.125 30 20 EKED C=CCc1ccccc1OCC(=O)Nc1ccccc1-c1ccccc1 668532261 ZPGXXSCUOAPXKP-UHFFFAOYSA-N 343.426 5.100 30 20 EKED CCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 749057006 TUZHPXMZAROHTG-RYUDHWBXSA-N 348.418 5.091 30 20 EKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc(C2CC2)s1 761803603 CVWFUWOLFSFHSQ-UHFFFAOYSA-N 347.487 5.057 30 20 EKED C#CCCCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 779745272 IMHOGZXCWOSVGX-UHFFFAOYSA-N 348.471 5.545 30 20 EKED N#CCSc1ccccc1C(=O)Nc1cccc(-c2ccccc2)c1 805257999 HPWAPBFIBMUQNA-UHFFFAOYSA-N 344.439 5.222 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1 915982659 UWDFQWUEGXFOEI-QXMHVHEDSA-N 348.471 5.399 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cc2cc(Cl)ccc2o1 916130368 QYDALHJVCONVCL-QPJJXVBHSA-N 333.774 5.531 30 20 EKED C=CCCCCCCCCCNc1c(C(=O)O)cccc1[N+](=O)[O-] 1776172145 ZKOISCVPPLEVHR-UHFFFAOYSA-N 334.416 5.012 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccccc2Cl)o1 63961218 XNQNVSVQRSIYFP-UHFFFAOYSA-N 336.778 5.032 30 20 EKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc(Cl)cc1 206944173 CRLLDIHRQMISFG-XFXZXTDPSA-N 349.817 5.210 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(OC(F)(F)F)cc1 208804788 DVTNOPXBNAXYCL-WMZJFQQLSA-N 343.304 5.030 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 255112737 GZZDQJYAECZMAX-LDCOFTPGSA-N 344.867 5.200 30 20 EKED OC(CC/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)=Nc1ccccc1 329169466 JPMXMPYVZQCCTD-CGTJXYLNSA-N 328.456 5.228 30 20 EKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1)C1CC1 329959864 NOXOWHVLQYMSKH-YCFRAFIESA-N 346.515 5.227 30 20 EKED C[C@@H]1Cc2c(sc(NC(=O)c3ccoc3C3CC3)c2C#N)[C@H](C)C1 410965375 BOSPKFQWHJYKGZ-WDEREUQCSA-N 340.448 5.028 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1sccc1C1CC1 432934259 ZLXZPZJACPXXQY-GFCCVEGCSA-N 342.489 5.272 30 20 EKED N#CCCC[C@@H](NCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 433016685 SYKRJQJSMMUTAA-HXUWFJFHSA-N 349.409 5.005 30 20 EKED C=C(C)C[C@@H](C)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 464573054 XBVPDQXGUAQBHX-XLIONFOSSA-N 346.474 5.018 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC(c2c[nH]c3c(CC)cccc23)CC1 466820183 YFKGBRRIQHRTFO-INIZCTEOSA-N 338.495 5.039 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(-c2cccnc2)cc1 512614418 VQPBEEZQMLACPC-JKSUJKDBSA-N 345.421 5.171 30 20 EKED N#CC1(c2ccc(C(=O)Nc3ccccc3-c3cccs3)cc2)CC1 539601734 PVMSDTORAZVISL-UHFFFAOYSA-N 344.439 5.223 30 20 EKED C=CCC[C@@H](N[C@@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 560545430 VLQUSINXSXGNDY-IAGOWNOFSA-N 329.415 5.318 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1cc2ccccc2o1 564536791 KENZCSGFYCNCPF-GFCCVEGCSA-N 344.336 5.174 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)c2ccccc12 588976341 PZDYYMXSKBKHCM-MRXNPFEDSA-N 346.449 5.631 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1Cc1ccccc1 606934841 PPLYQBZUCUGCMM-UHFFFAOYSA-N 336.479 5.488 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc2oc(C(C)C)nc2c1 606946036 CKIMDCQHDBWYFB-UHFFFAOYSA-N 329.444 5.161 30 20 EKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)cc2c1 685782630 ZIJWJQKQGSQEKG-INIZCTEOSA-N 342.423 5.248 30 20 EKED O=C1/C(=C\c2csc(-c3cccs3)n2)Cc2c(Cl)cccc21 728440870 XABPMWMUANAGRN-YFHOEESVSA-N 343.860 5.347 30 20 EKED COc1ccc2oc(C(=O)/C=C\c3ccc(O)c(Cl)c3)c(C)c2c1 729150741 MAFMLTVOCKMHMQ-DAXSKMNVSA-N 342.778 5.005 30 20 EKED CSc1ccc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1F 741848349 YEMYOHIPLFNFSE-VOTSOKGWSA-N 335.469 5.198 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1cc2ccccc2o1 796992043 LAWZHGNGXMKTNG-MDZDMXLPSA-N 349.386 5.592 30 20 EKED C[C@H](OC(=O)CCCCCC#N)c1ncc(-c2ccc(Cl)cc2)o1 805698174 VMODTWPMQDEVQM-ZDUSSCGKSA-N 346.814 5.073 30 20 EKED CC(C)c1ccccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 857585524 BAAHYWMMJWRWBA-HNNXBMFYSA-N 338.476 5.314 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCCCCC2)cc1 915352566 MJBKBETWFLKHRL-NRFANRHFSA-N 347.462 5.140 30 20 EKED C(=NNCc1cccc2cccnc12)c1ccc(-c2ccccc2)cc1 915961673 BFLBRKWOVMNWBU-UHFFFAOYSA-N 337.426 5.026 30 20 EKED CCCCCCCCC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 920232913 XWRLCERKMGFEEL-CTNGQTDRSA-N 331.500 5.021 30 20 EKED Oc1ccc2ccccc2c1/C=N\C[C@@H]1CCCO[C@@H]1c1ccccc1 920387156 MGFPYEFLCHBVMB-XBISJKRFSA-N 345.442 5.132 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776119816 MKGKELNWKYEVGP-FLIBITNWSA-N 342.822 5.232 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776370529 XIXUFBFFADREIP-KTKRTIGZSA-N 328.795 5.058 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(Cl)ccc1SC 64563271 AUISOJBXBFWAKV-UHFFFAOYSA-N 346.883 5.282 30 20 EKED C=CCN(C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 71846388 WCVHTHNLMOOZGH-ZWKOTPCHSA-N 345.364 5.028 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1 154327293 QIQSXNSPXUNHJX-IRXDYDNUSA-N 327.431 5.032 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)cc1 303229266 UXRISHNEGXABOC-IUYQLWOBSA-N 333.431 5.216 30 20 EKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1C 328979271 CTYHNHLKOMUBBI-IXDOHACOSA-N 328.456 5.797 30 20 EKED CC(C)(C)[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 440209664 ASKBWKKIMWRRCS-VQTJNVASSA-N 349.478 5.118 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1cc(F)ccc1C#N 468928246 KHXCEKDBXNJEOY-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CCCOc1ccc(C(C)(C)NCc2ccc(C#N)cc2Cl)cc1 483271998 UAPIKGIHAROMLE-UHFFFAOYSA-N 342.870 5.025 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 489599454 REPNRLHKQQMHHQ-UTKZUKDTSA-N 349.478 5.014 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2cc(C)ccc2n1 506046217 SEYFKTHLWFMUJS-UHFFFAOYSA-N 344.458 5.647 30 20 EKED C[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 510073528 OSBUFAXSGOBWHZ-CVEARBPZSA-N 349.434 5.003 30 20 EKED COc1ccccc1[C@H](CC(C)C)N[C@H](C)c1ccc(C#N)cc1F 512666275 JOQUPJAZEKQMOK-QRWLVFNGSA-N 340.442 5.144 30 20 EKED CCCC[C@H](CC)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 522682595 UDQGDJMJDROVFR-HOTGVXAUSA-N 332.513 5.626 30 20 EKED C[C@@H](SCCCC1(C#N)CCOCC1)c1cccc2ccccc12 541881395 TUNCZHQVEDGYOX-QGZVFWFLSA-N 339.504 5.735 30 20 EKED Cc1c(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)oc2ccccc12 557644877 SETRRCODWLQXGF-GOSISDBHSA-N 346.430 5.033 30 20 EKED CC(C)CCC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609930284 YJYBYXDRIDCXSR-HOTGVXAUSA-N 347.528 5.417 30 20 EKED N#CCC[C@H](NCc1c(Cl)ccc2cccnc12)c1ccccc1 611406954 IMLYQGAYXREVID-IBGZPJMESA-N 335.838 5.023 30 20 EKED COc1ccc(CN[C@H](C)c2ccc(-c3cccs3)cc2)cc1C#N 742369241 QBKKTANSDKCFDI-OAHLLOKOSA-N 348.471 5.146 30 20 EKED CC(=NOCc1ncc(-c2cccs2)o1)c1cc2ccccc2o1 760417919 YQVMBOMRUZOROA-UHFFFAOYSA-N 338.388 5.090 30 20 EKED CCCCCCCCC(=O)N1CCC(OCc2ccc(F)cc2)CC1 768903645 RDVFYFOZCSYSLX-UHFFFAOYSA-N 349.490 5.084 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccncc1 774185494 CAMZWADOFDXACA-ZBEGNZNMSA-N 337.250 5.062 30 20 EKED C[C@H](C#N)Oc1ccccc1NCCCOc1ccc2ccccc2c1 779743785 UXLWOZWRIPHQQX-QGZVFWFLSA-N 346.430 5.012 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1ccccc1C(F)(F)F 864372367 PBKDBLIHSCZJKQ-UHFFFAOYSA-N 329.325 5.090 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)s1 902884381 GYEIWXFIHHUKGP-GXTWGEPZSA-N 338.398 5.463 30 20 EKED C(=NNc1ccccc1)c1cn(-c2ccccc2)nc1-c1cccs1 916245930 MMWGWZURYYKZIG-UHFFFAOYSA-N 344.443 5.047 30 20 EKED CCCCCCCCCCNc1cc(C)c([N+](=O)[O-])cc1C(=O)O 1776787759 PIVYHZKXZHSWNB-UHFFFAOYSA-N 336.432 5.154 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 62369899 ZNFVSXCPBMTHQJ-UHFFFAOYSA-N 349.261 5.256 30 20 EKED Cc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1C 63275354 CJCVKWXJRUURSB-AATRIKPKSA-N 325.458 5.385 30 20 EKED C=C(C)[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)c(F)c1 187778016 ZTVASZIVBHHOOM-HXUWFJFHSA-N 340.417 5.173 30 20 EKED CC(O)=Nc1ccc(CC/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1 329055416 HYJXNAPPBPWQSM-YSIASYRMSA-N 342.483 5.400 30 20 EKED C=CCCC[C@H](C)NC(=O)C(C)(C)c1csc(-c2cccs2)n1 410013166 SGYYTQRMHLRRID-ZDUSSCGKSA-N 348.537 5.010 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)C(c1ccccc1)c1ccccc1 442874643 UMSLIZJAPHOZFH-HDYDNRTBSA-N 332.491 5.127 30 20 EKED CCc1ccc([C@@H](C)CC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487176307 LHPXIDTXNDRNPM-PGRDOPGGSA-N 348.490 5.294 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(-c2nc(C)co2)c1)c1ccccc1 489707635 AJWMDJABCVKBIA-HXUWFJFHSA-N 346.430 5.339 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@]1(CCC)C(F)(F)F)c1ccccc1 499521597 SBGKBGOVVZFFCD-CRAIPNDOSA-N 339.401 5.070 30 20 EKED C[C@H]1CC(C(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@H](C)C1 503139607 MOWNPJOCGLHOHT-RBSFLKMASA-N 330.497 5.092 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C 505009994 AEKRSHYROSVCQR-XLIONFOSSA-N 334.463 5.215 30 20 EKED Cc1cccnc1[C@H](NC1CCC(C#N)(c2ccccc2)CC1)C(C)C 507633815 DPWLLYMZPDLUGJ-WQMHRJNTSA-N 347.506 5.081 30 20 EKED N#Cc1ccc(CN[C@H](c2cccc3ccccc23)C(F)(F)F)cc1 510396254 KNZARIAAKZHQPK-LJQANCHMSA-N 340.348 5.105 30 20 EKED CCc1c(C)sc(NC(=O)c2cc(C)c(C)cc2Cl)c1C#N 511039535 FBVSAAPIBWMAMA-UHFFFAOYSA-N 332.856 5.013 30 20 EKED C=CCCOCCCCC(=O)Nc1cc(C(F)(F)F)ccc1Cl 538415907 NSTXSACHCHUTHF-UHFFFAOYSA-N 349.780 5.060 30 20 EKED CCC[C@H](NC(=O)CCCCC#N)c1ccc(Cl)c(Cl)c1 593969926 OYEFLNBNZMGJBA-HNNXBMFYSA-N 327.255 5.035 30 20 EKED C[C@@H](NC(=O)Nc1ccccc1-c1ccccc1)c1cccc(C#N)c1 610317529 SELWAJFOWBSAPV-MRXNPFEDSA-N 341.414 5.108 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(NC(=O)[C@@H](C)CC(=C)C)c(C)c1 619323254 ABRHUBFUAKHFDZ-IRXDYDNUSA-N 342.483 5.077 30 20 EKED C#Cc1cccc(NC(=S)N(CC)Cc2ccc3ccccc3c2)c1 726476853 NCZPOWHORIJYMU-UHFFFAOYSA-N 344.483 5.040 30 20 EKED CC(=NNc1cccc([N+](=O)[O-])c1C)c1cc(Cl)sc1Cl 727973508 OSZXKGACWZTMLH-UHFFFAOYSA-N 344.223 5.108 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)C=C(C3CC3)C3CC3)cc2)c1 731331618 LPIHREPTEORIAX-UHFFFAOYSA-N 344.414 5.035 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccsc1 737501383 AWRBELHFLJGPHX-QRWLVFNGSA-N 346.455 5.146 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(C(C)C)cc2)c1 772985267 VQTOHUGBBYPFGI-DYESRHJHSA-N 336.479 5.342 30 20 EKED CC(CCCCCCC(=O)O)=NNc1cc(Cl)cc(Cl)c1 1776058477 JLDHZCDJDBAJHG-UHFFFAOYSA-N 331.243 5.206 30 20 EKED CCCCCCCC[C@H](C)C(=O)N[C@@H](CC(=O)O)c1ccc(C)cc1 1776786164 STLJDEXSKKJQAE-HKUYNNGSSA-N 347.499 5.014 30 20 EKED CCCCc1oc2ccccc2c1/C=C/C(=O)c1cccc(C(=O)O)c1 1776807940 DNLDSJBRXVAUOI-OUKQBFOZSA-N 348.398 5.370 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1nc2ccccc2o1 182069967 RYVVHINLUHSXTR-ZIAGYGMSSA-N 337.448 5.253 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2ccc(F)c(C#N)c2)cc1 182098741 PSZJFGPPJJWVRU-AWEZNQCLSA-N 328.456 5.049 30 20 EKED N#CC1(c2ccc(C(=O)Nc3ccccc3-c3ccccc3)cc2)CC1 182286388 PZJZCVXZBGIRSU-UHFFFAOYSA-N 338.410 5.161 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(C(F)F)cc1 185620838 SBAGRMSIFLMKMP-CYBMUJFWSA-N 332.419 5.488 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOc1ccccc1 189874468 WWFNRCNGPAIQQT-UHFFFAOYSA-N 337.463 5.336 30 20 EKED COc1cccc(/C=C\C(=O)c2ccc(Cl)s2)c1OC(C)C 212557224 MHRXBZZNJYUDKW-FPLPWBNLSA-N 336.840 5.093 30 20 EKED N#CCCCOc1cccc(/C=C(/Cl)c2nc3ccccc3o2)c1 255499473 QVQMESBOWJBHIP-DTQAZKPQSA-N 338.794 5.247 30 20 EKED O/C(=N/[C@@H]1CCOC2(CCCCC2)C1)Nc1cccc2ccsc12 328689260 BIERUQZAPDTUEH-OAHLLOKOSA-N 344.480 5.109 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc1Cl 329032971 XSJYXVLRMHPHPM-VNQPRFMTSA-N 348.874 6.142 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H](CC)c3ccc(C#N)cc3)oc12 447518558 NWAVLVXHWWVHMJ-KXBFYZLASA-N 348.446 5.505 30 20 EKED Cc1cc(C)cc(-c2ccc(CNCc3cccc(C#N)c3)cc2)c1 462687867 RXZORHRRDPPMAF-UHFFFAOYSA-N 326.443 5.132 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(O)c2ccccc2c1 473222953 AVGOTOHWKMVZOL-UHFFFAOYSA-N 345.442 5.650 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CCCCC2)C1 475553157 DTBDZQJRDVHLBO-UHFFFAOYSA-N 340.511 5.727 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C1CCCC1 475582356 MUUFRYMUBOJRHS-FQEVSTJZSA-N 340.511 5.725 30 20 EKED CCC[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 500891267 LTWGPPMCJRZFDN-SFHVURJKSA-N 333.262 5.496 30 20 EKED N#Cc1ccc(Oc2cccc(-c3nc(C4CCCC4)no3)c2)cc1 521899709 MBTIJYTVSLGSJY-UHFFFAOYSA-N 331.375 5.058 30 20 EKED N#Cc1ccccc1SCc1ncc(-c2ccc(Cl)cc2)o1 525086196 ZIFOWELEYUQPBS-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CCC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 583665909 SRQBHPMEEKSXEX-SFHVURJKSA-N 332.369 5.208 30 20 EKED CC(C)(C)c1cc(NC(=O)c2sccc2C2CC2)c(C#N)s1 584388147 VCHHXYOZVYRWFG-UHFFFAOYSA-N 330.478 5.108 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)NCCCCCc2ccccc2)cc1 609046484 DKOYTDPGFNLOIP-UHFFFAOYSA-N 349.478 5.022 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619746877 PUORYSIJGZTGKS-LLVKDONJSA-N 338.760 5.081 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1cc2ccc(C(C)C)cc2[nH]1 729433902 VOYQPJUPRXCZAJ-UHFFFAOYSA-N 339.483 5.083 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(F)c(F)c3)s2)cc1 734307087 VDOSNVKATZGOAV-VQHVLOKHSA-N 341.382 5.293 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)COC3)o1 742436969 PEBSEMXJWXJLPN-YVMONPNESA-N 348.373 5.320 30 20 EKED N#C[C@@H](C(=O)C1CCCCCCC1)c1nc2cc(Cl)ccc2s1 744036412 YKUGMOSYGKVKPS-AWEZNQCLSA-N 346.883 5.486 30 20 EKED C=CC[C@@H](C(=O)Oc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 759906813 WWZUCGSKSCDIIZ-HXUWFJFHSA-N 347.414 5.224 30 20 EKED Cc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cnc1Cl 760265993 RAFANOQRZYMSQJ-WAYWQWQTSA-N 334.806 5.002 30 20 EKED CC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1O 775532700 XFNNFLPMOGGDIT-JOCHJYFZSA-N 342.442 5.172 30 20 EKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1Cl 795984460 YHCQUEICGBSNPU-GOEBONIOSA-N 327.811 5.032 30 20 EKED CCC[C@@](C)(CC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 796651009 NXMYBKHNIIMJNH-YVEFUNNKSA-N 334.872 5.342 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2cscc2C(F)(F)F)c(Cl)c1 811691580 QNLOHRWVCNMFPI-DUXPYHPUSA-N 341.741 5.188 30 20 EKED CC(=NNc1cccc(C(=O)O)c1C)c1cccc(-c2ccccc2)c1 1776086645 GMYJMLPGPYMKSP-UHFFFAOYSA-N 344.414 5.196 30 20 EKED O=C(/C=C\c1ccc(C(=O)O)s1)c1ccc(-c2cccs2)cc1 1777569736 GZRHLUBWCZQMEF-CLFYSBASSA-N 340.425 5.071 30 20 EKED O=C(O)c1cccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c1 1777684929 PEAZYVPYNRNFDG-KTKRTIGZSA-N 334.396 5.009 30 20 EKED CC(C)(C#N)CCCN1CCc2sccc2[C@@H]1c1cccs1 174812102 BHGMGXJLLCBPJB-QGZVFWFLSA-N 330.522 5.087 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc2cccnc12 178391523 OMDPMKGHTULVJW-HNNXBMFYSA-N 333.460 5.241 30 20 EKED CCc1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 217184609 MCONYJUPUGDLFZ-CQSZACIVSA-N 339.464 5.287 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2cc3ccccc3s2)cc1 237605871 QNTWIGMTHYACLT-HUUCEWRRSA-N 336.460 5.043 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 392288724 MAQBYKQMTROODY-MBSDFSHPSA-N 326.443 5.193 30 20 EKED CCC[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(F)cc1F 439434151 DCQWMIHBZULKCV-GOSISDBHSA-N 334.797 5.121 30 20 EKED C=CCC1(C(=O)Nc2cccc(NC(=O)CCC)c2C)CCCCC1 448792366 CIHDGFHUNUBUFW-UHFFFAOYSA-N 342.483 5.199 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(C)c1 476148335 MMAKPYNXRKKMOZ-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C=CCN(C(=O)c1ccc(C(C)C)s1)c1nc2c(s1)CCCC2 546859129 AAHBFXXDKJPYRM-UHFFFAOYSA-N 346.521 5.040 30 20 EKED N#CCc1ccccc1NC(=O)c1cc2sc3ccccc3c2s1 550080263 JXMQBQNKHFWFCT-UHFFFAOYSA-N 348.452 5.434 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(SCC(F)(F)F)cc1 558236657 BNNACAPRDWYKSS-CYBMUJFWSA-N 344.446 5.322 30 20 EKED C=CCC[C@@H](NCc1nc(C)oc1C)c1ccc(C(F)(F)F)cc1 660203630 GESBZLLAUQGVRR-MRXNPFEDSA-N 338.373 5.107 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1ccccc1Cl 727263953 KVKFGWFZRNGSMX-KHPPLWFESA-N 325.820 5.360 30 20 EKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccc(F)cc1 732919569 MFDVHZJGZNJGHW-INIZCTEOSA-N 346.405 5.449 30 20 EKED C#Cc1cccc(N(Cc2ncc(C(C)C)o2)Cc2cccs2)c1 733309571 URGNREPZRKPAIS-UHFFFAOYSA-N 336.460 5.048 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(F)cc3F)s2)cc1 734306723 RAUCWRHWNLNOEA-VQHVLOKHSA-N 341.382 5.293 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1nccc2ccccc12 740764832 HRWAGGIMFGDAIN-MDZDMXLPSA-N 336.460 5.193 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc(Cl)nc1 748999783 YXXFAPFXSVEPMH-CLFYSBASSA-N 340.835 5.063 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CC[C@H](C)C3)n2)cc1 759538946 NYVDPVZKSBJKRD-YQQAZPJKSA-N 338.476 5.121 30 20 EKED C=CC[C@H](N[C@H](C)c1cccc(-c2ccccc2)c1)c1ccncc1 766023380 UMPIOOVQWXDJRM-JPYJTQIMSA-N 328.459 5.717 30 20 EKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1ccc(F)c2ccccc12 808121040 VXZRSYUIPWIJLO-SECBINFHSA-N 331.803 5.134 30 20 EKED CCOc1ccc(/C=C/C(=O)c2ccc(Cl)s2)cc1OCC 60108383 GKYJIOOVEYGSNV-FNORWQNLSA-N 336.840 5.095 30 20 EKED CC1CCC(N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 66955167 VFWGAUIQKWAVGB-HWOWSKLDSA-N 345.512 5.123 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)cc3)s2)cc1 107718400 GPDARWQCXHLUOQ-OAHLLOKOSA-N 347.487 5.149 30 20 EKED C[C@@H](Sc1nnc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 118177304 DWUFZQHXZBBFKC-LLVKDONJSA-N 341.823 5.115 30 20 EKED N#Cc1ccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 254819043 OWBBXXVGWXLSDP-UHFFFAOYSA-N 326.359 5.226 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 421112377 DBMQLFWFIATIKU-CQSZACIVSA-N 340.389 5.002 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cc(Cl)ccc1Cl 426725138 YBEJNKZCFIPKAZ-CYBMUJFWSA-N 347.289 5.645 30 20 EKED N#CCCC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 431514192 XOGJNBVPKDLYFA-OAHLLOKOSA-N 329.787 5.095 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1Cl 447324799 NTBULDVRRGPCJD-ZDUSSCGKSA-N 347.289 5.645 30 20 EKED N#C[C@H](NC(=O)CCCC1CCCC1)c1ccc(Cl)c(Cl)c1 463743622 HTLZEBAGSXHTQD-INIZCTEOSA-N 339.266 5.035 30 20 EKED C=C[C@@](C)(CC)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 467848358 CGFQCPGSBIIYNY-XXBNENTESA-N 346.474 5.018 30 20 EKED Cc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(F)c1 482299089 ZRLUVQHZZTZTMF-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 505029654 OYSQPGBDDTUWBR-HXUWFJFHSA-N 338.426 5.313 30 20 EKED C[C@@H](SCCC(=O)Nc1ccc(Cl)cc1)c1ccc(C#N)cc1 522841212 MSODTFCGXDPZLN-CYBMUJFWSA-N 344.867 5.035 30 20 EKED C=CC[C@@H](C)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 523959737 IVMDYDKSVMURBG-SSDOTTSWSA-N 348.682 5.556 30 20 EKED COc1ccc(-c2ccc(CN[C@H](C)c3cccc(C#N)c3)cc2)cc1 537305791 LFCHLKUCJZPJIT-QGZVFWFLSA-N 342.442 5.085 30 20 EKED C[C@H]1CCCCN1Cc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1 538500314 WTYJXIOPNJSMIC-ZWKOTPCHSA-N 333.479 5.106 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1ccc(C#N)cc1 603435797 FPQPZJIRLAFACI-UHFFFAOYSA-N 326.446 5.017 30 20 EKED CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 610140512 HWFRGFYNCFKKEI-IBGZPJMESA-N 341.499 5.310 30 20 EKED CCCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@@H](C)c1ccccc1 610356033 HWXTWBAZWHAUDL-MSOLQXFVSA-N 349.478 5.192 30 20 EKED CC(C)c1ccc([C@H](NCc2ccccc2C#N)c2cccs2)cc1 611614647 HQJKJBIENZCHPW-QFIPXVFZSA-N 346.499 5.622 30 20 EKED C=CCN(CC(F)(F)F)C(=O)c1sc2cccc(C)c2c1Cl 620593432 MJYFVRZGAWLFSL-UHFFFAOYSA-N 347.789 5.054 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(SC(F)F)c1 727597558 HOPOTMVDPKYPOZ-UHFFFAOYSA-N 348.418 5.221 30 20 EKED O=C(/C=C/c1nc(Cl)cs1)c1ccc(N2CCCCCC2)cc1 759075211 JYIMBJVVLFKCJQ-MDZDMXLPSA-N 346.883 5.073 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2cccc3cnccc23)c1 782887625 OGJOUFXUWPTYAV-SREVYHEPSA-N 339.341 5.041 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)n1 797096236 FZHVSQIKYJMYLK-QKPAOTATSA-N 330.497 5.049 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCC[C@H]1CC1(Cl)Cl 819066987 FRFJPUIREABBDK-RYUDHWBXSA-N 329.296 5.077 30 20 EKED C=CCN(C(=S)Nc1c(C(C)C)cccc1C(C)C)[C@@H](C)COC 849276901 LKVLCHJZUQYZCR-INIZCTEOSA-N 348.556 5.153 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(SC(F)(F)F)c1 861649251 HENZOAOFTUCAKY-BETUJISGSA-N 342.386 5.013 30 20 EKED CC(C)c1ccccc1NC(=O)[C@@H](C)SCC1CCC(C#N)CC1 902566943 IKNIQSHYRKTTOE-KLAILNCOSA-N 344.524 5.200 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)[C@H](C)c1ccc(CC(C)C)cc1 1776037495 LEQIYVYAJIRCPQ-HNNXBMFYSA-N 338.451 5.175 30 20 EKED C=CCCCCCCCCNc1nc(C(F)(F)F)ccc1C(=O)O 1776207889 COEZEOGZOIXRFD-UHFFFAOYSA-N 344.377 5.127 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 90664939 HUUTWZVLPTVYKW-KSSFIOAISA-N 332.369 5.401 30 20 EKED N#CCCCOc1cccc(CNc2cccc(CC(F)(F)F)c2)c1 151804309 IBXFXKSNAHRXTH-UHFFFAOYSA-N 348.368 5.086 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 185902292 MXNWJJJOPPXFJG-CYBMUJFWSA-N 344.505 5.376 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 207593854 HTIQWFHSMZRYAZ-JYRVWZFOSA-N 349.430 5.052 30 20 EKED N#CCC[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccc1 358323732 BLLPRZQSDRGTNX-KOENEWCDSA-N 343.474 5.025 30 20 EKED CCc1nc(N[C@@H](CCCC#N)c2ccccc2)c2ccsc2n1 431492307 CBSGWWDMQDPNHP-INIZCTEOSA-N 336.464 5.101 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc2c1CCO2 432581980 ZLEBCNJNUBHWOR-UHFFFAOYSA-N 336.435 5.117 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1ncc(-c2ccccc2)o1 443142519 PPVHQDISROMLLX-CABCVRRESA-N 334.444 5.769 30 20 EKED C=C(C)[C@H](N[C@@H]1CCCc2nc(CC)sc21)c1ccc(F)c(F)c1 480661956 SXHPLDZQGHCJKW-AEFFLSMTSA-N 348.462 5.268 30 20 EKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nccc2ccccc12 483202152 ORRUGVQHFTZNKV-INIZCTEOSA-N 346.773 5.124 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3sccc3s2)n1 531330833 ACUDPSKVUGUWAS-SECBINFHSA-N 332.475 5.033 30 20 EKED C=C[C@@H](CC(=O)N1CCCC[C@@H]1c1ccc(F)cc1)c1ccccc1 533927620 GXDNGGVQOSMORR-LAUBAEHRSA-N 337.438 5.239 30 20 EKED C=CCCC[C@@H](C)Sc1nnc(C2CC2)n1Cc1ccccc1 537071708 FDRVRIMIUXPRBB-OAHLLOKOSA-N 327.497 5.041 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)c(F)c1 540709264 JVCUMSNDSHMPBH-ORAYPTAESA-N 328.406 5.274 30 20 EKED CC1(C)CC(C)(C)c2cc(NCCCC3(C#N)CCOCC3)ccc21 540809958 BJTZOSCOVPUSEG-UHFFFAOYSA-N 340.511 5.158 30 20 EKED C[C@@H](CCc1ccc(F)cc1F)N[C@@H](CCCC#N)c1ccccc1 551211861 YKLQENXZIFPINS-KKSFZXQISA-N 342.433 5.311 30 20 EKED Cc1ccc(C(F)(F)F)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 598869319 FJSAQTCDKJKWRA-UHFFFAOYSA-N 346.352 5.067 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCC(C)(F)F 604358634 HSLCDAKLKGRYHL-UHFFFAOYSA-N 344.361 5.033 30 20 EKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2cccs2)C2CC2)cc1 611367404 FDNFZBLVRUVGKP-JOCHJYFZSA-N 344.483 5.528 30 20 EKED C=CCCC(C)(C)NC(=O)Nc1ccccc1CCC(F)(F)F 666315995 RTBXYZNHAXDTKU-UHFFFAOYSA-N 328.378 5.048 30 20 EKED CC1=CC(=NNc2nc(C(F)(F)F)nc3ccccc23)CC(C)(C)C1 725830834 LZLICUIWTFIFGN-UHFFFAOYSA-N 348.372 5.183 30 20 EKED C[C@H](ON=Cc1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 727484907 XUMGWSWDPCCBRQ-JTQLQIEISA-N 339.178 5.013 30 20 EKED CC(=NNc1cc(F)c(F)cc1F)c1sc(C(C)(C)C)nc1C 734302361 BLMLRPXDRYXJMR-UHFFFAOYSA-N 341.402 5.002 30 20 EKED Cc1ccsc1C(=O)/C=C\c1c(-c2ccccc2)nn(C)c1Cl 734753360 SYRXMHSMQAXZRF-HJWRWDBZSA-N 342.851 5.007 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 756227071 NVCNMJCOXKIKKL-CZUORRHYSA-N 334.444 5.300 30 20 EKED C[C@@H](N[C@H](CC1CCCC1)c1ccccc1)c1ccc(OCC#N)cc1 776170319 OVEBFPSMJAEJNH-WZONZLPQSA-N 348.490 5.561 30 20 EKED C#Cc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3OC)cc2)cc1 809624802 QANSCNMIJMHCDY-SFHVURJKSA-N 341.454 5.194 30 20 EKED CCN(C)c1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 815636321 SNWWJMJMUXSYQL-GCJKJVERSA-N 335.495 5.228 30 20 EKED CCCCCCCCCCCN(C)[C@H](C)c1cc(C)c(C(=O)O)o1 1776784635 ZPIBKOGPHMKTAW-QGZVFWFLSA-N 337.504 5.810 30 20 EKED C=CCN(C(=O)c1oc2ccc(Cl)cc2c1C)c1ccccc1 71846340 HPKMKBUSUUOHHT-UHFFFAOYSA-N 325.795 5.227 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1 110968506 NMTUTOMKAJHALP-RZXPCSSPSA-N 332.428 5.271 30 20 EKED N#Cc1c(Cl)nsc1N[C@@H](c1ccccc1)c1ccc(F)cc1 301077110 GKWOBUWPCVCOKE-HNNXBMFYSA-N 343.814 5.009 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 466656979 XWZVAVTVWYANFG-QWHCGFSZSA-N 346.471 5.037 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1c(C)cc(C)cc1C)c1ccc(F)c(F)c1 479786519 USMZVKSQKIVVQE-GOSISDBHSA-N 344.405 5.329 30 20 EKED C=CCCCC(=O)N(C1CC1)[C@H](C)c1cccc(C(F)(F)F)c1 481155571 LJJJFENNDIFAAU-CYBMUJFWSA-N 325.374 5.114 30 20 EKED N#Cc1c(Cl)cccc1SCc1nc2ccccc2n1C(F)F 537840350 DKPPKMKFRNYBEW-UHFFFAOYSA-N 349.793 5.249 30 20 EKED CC[C@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1ccc(C#N)c(F)c1 539609727 JLCHDPXLRCIONM-HOTGVXAUSA-N 340.442 5.034 30 20 EKED N#CCc1ccc(CN(Cc2cccs2)Cc2cccs2)cc1 542208821 FDMPJXPWJSDRON-UHFFFAOYSA-N 338.501 5.078 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@H]1CCCC[C@H]1C 609428307 LTJUDBMYJINLRT-BZUAXINKSA-N 330.497 5.236 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC)c1ccc(Cl)cc1 612299674 QNOGVQDYOIKOBK-LJQANCHMSA-N 342.870 5.189 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@@H](c2ccc(Cl)cc2)c2cccs2)C1 613255187 XJUYIKVKMPFOSB-QBIMZIAESA-N 330.884 5.163 30 20 EKED CC(C)(C)c1ncc(/C=C2/CCOc3c(Cl)cccc3C2=O)s1 736433521 FXXIQWNDCGOYIH-LUAWRHEFSA-N 347.867 5.143 30 20 EKED CCCCC[C@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 742654353 UYIQLCXWORMCEV-HOTGVXAUSA-N 332.513 5.626 30 20 EKED CCC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 745948055 UPIKWIJVWLSDGY-CQSZACIVSA-N 346.883 5.466 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3coc4ccccc34)co2)cc1 747705417 NVJNQFBPAKUWOL-KHPPLWFESA-N 329.355 5.292 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)C3CCCC3)n2)cc1 750687801 OSPVDZMGFTUVIL-YOEHRIQHSA-N 338.476 5.121 30 20 EKED CC(C)=C(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 751120981 XEIIYBFREJPKEF-GOSISDBHSA-N 338.838 5.290 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccccc2C#N)cc1 755600763 KNYAHUHJBNSHBR-CCEZHUSRSA-N 339.394 5.130 30 20 EKED CC(CCCC(F)(F)F)=NNc1ccnc2cc(Cl)ccc12 774310963 SMNXYOVPBLYINT-UHFFFAOYSA-N 329.753 5.409 30 20 EKED C#CC[C@H](NCc1nc2ccccc2c(C)c1Cl)c1ccccc1 775400114 WTBBZDHAIKHBQB-SFHVURJKSA-N 334.850 5.051 30 20 EKED C#CCCCCCC(=O)N(Cc1cccs1)c1ccc(F)cc1 779855344 ALZGFWIRALMUOY-UHFFFAOYSA-N 329.440 5.004 30 20 EKED CC(C)(C)OCCCCSCc1cc(Cl)ccc1OCC#N 788812000 YPDGCKRBBCUZFD-UHFFFAOYSA-N 341.904 5.071 30 20 EKED C[C@H](Nc1ccc(Cl)cc1Br)c1cccc(C#N)c1 131452796 SMVFYUDEQXWJRR-JTQLQIEISA-N 335.632 5.147 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 179824250 IDTYQUORXZOFTC-CQSZACIVSA-N 343.496 5.431 30 20 EKED CCCCCCCCC(=O)N[C@H](c1ccccc1)c1nccs1 303210009 OFRGEAAUCGJLDL-GOSISDBHSA-N 330.497 5.099 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC(C)(C)C1 332339757 PLEYIWZXQZVELA-HNNXBMFYSA-N 345.512 5.125 30 20 EKED CC1(C#N)CCN(c2ccnc3ccc(Oc4ccccc4)cc23)CC1 433753893 OVJBCTOQNVUKRE-UHFFFAOYSA-N 343.430 5.157 30 20 EKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CCC(C)(C)CC1 458799723 JYNLXODBJJROOV-LJQANCHMSA-N 341.499 5.032 30 20 EKED CC[C@@H](CN(CC)C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 476830099 NWJZFNXKMMQCQM-SFHVURJKSA-N 348.490 5.144 30 20 EKED C=C(C)[C@H](NCc1cc(C)nc2ccccc12)c1ccc(F)c(F)c1 481592950 OPWXAFFURCEVQH-NRFANRHFSA-N 338.401 5.228 30 20 EKED N#CCc1ccc(CNc2cccc(COc3ccc(F)cc3)c2)cc1 506283441 RACHPRVAMPUKPO-UHFFFAOYSA-N 346.405 5.083 30 20 EKED CC(C)c1ccc(CSCc2nnc(-c3ccc(C#N)cc3)o2)cc1 525117408 PVIZVORGAABYEP-UHFFFAOYSA-N 349.459 5.165 30 20 EKED Cc1ccc(-c2ccc(CN[C@@H](CCC#N)c3ccccc3)o2)cc1 533497350 KVJDCFNLKWIZET-NRFANRHFSA-N 330.431 5.390 30 20 EKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540127094 BXWZMTVDDVPLON-QAPCUYQASA-N 349.434 5.145 30 20 EKED C[C@H](N[C@@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541133936 MGJBLDCUACVEDB-HOTGVXAUSA-N 332.472 5.699 30 20 EKED C[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1ccc(C#N)c(F)c1 553914784 XVYRZTFNMZTIHC-NSHDSACASA-N 349.236 5.344 30 20 EKED N#Cc1ccc(CNc2cccc(Cl)c2SCC(F)F)cc1 558367374 BIMOFOSUMPJJHN-UHFFFAOYSA-N 338.810 5.181 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](CCC)c1cccc(C(F)(F)F)c1 588726484 KJXHWNDRCRKCFT-INIZCTEOSA-N 342.405 5.154 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(CO[C@H]2CCC[C@H](C)C2)c1 591504542 MXDYGPARSSUPSL-PXNSSMCTSA-N 344.499 5.212 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1[C@H]2c3ccccc3C[C@H]21 626633607 DMQVBIGSLYEJIK-QHAWAJNXSA-N 331.459 5.063 30 20 EKED C=CCC[C@H](NCc1cc(-c2ccc(OC)cc2)no1)c1ccccc1 678785590 LQTGNJJCKYWOMJ-NRFANRHFSA-N 348.446 5.147 30 20 EKED CCc1ccc(C=NOCc2ncc(-c3ccc(Cl)cc3)o2)cc1 727465972 WMPJQEAPEKQFRU-UHFFFAOYSA-N 340.810 5.108 30 20 EKED C=CC[C@@H](NC(=O)N1CCCCC[C@H]1c1ccccc1)c1ccncc1 734681809 ZMQWUVVBQIPMQK-RTWAWAEBSA-N 349.478 5.026 30 20 EKED CC(=NNc1cccc(Cl)c1)c1sc(-c2cccnc2)nc1C 747601594 CFAFNCDAJIRVOU-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CC(C)(C)c1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 762996171 UAFATXYYZACHCM-INIZCTEOSA-N 348.471 5.013 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1cccc(-c2ccncc2)c1 772809662 YTQIHCNWLXYRRO-HJWRWDBZSA-N 336.394 5.193 30 20 EKED C#CC[C@@H](N[C@@H](C)c1sc(C(C)(C)C)nc1C)c1ccccc1 773116224 QWDUDKNNOQXCGD-WMLDXEAASA-N 326.509 5.164 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCc2ccc(F)cc21 776192289 IRBCZQGPUGGUPD-GHXNOFRVSA-N 341.432 5.223 30 20 EKED Cc1cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)o1 782383938 YRQHAFLTLMLIQL-INIZCTEOSA-N 330.431 5.286 30 20 EKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1Cl 795984462 YHCQUEICGBSNPU-HOCLYGCPSA-N 327.811 5.032 30 20 EKED CCCCCCCCCN1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 805780042 AJRGGWOYGCDQIG-ZWKOTPCHSA-N 349.519 5.199 30 20 EKED CSc1ccc(CN[C@H]2C[C@H](C)Sc3sccc32)cc1C#N 886688671 XRXUOBZQLUMETK-NHYWBVRUSA-N 346.546 5.057 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 915085492 BUGZPTNCBQCMIK-FQEVSTJZSA-N 346.817 5.248 30 20 EKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2ccncc2)cc1 916136164 IFMPTEFLIMPNDK-RAXLEYEMSA-N 342.442 5.004 30 20 EKED C[C@@H]1CCN(C(=O)Nc2ccc(C#N)cc2C2CC2)[C@H](c2ccco2)C1 933846576 DCJSKPXLMPPCQN-KUHUBIRLSA-N 349.434 5.034 30 20 EKED CC(=NNc1ccccc1C(=O)O)c1ccccc1SC(C)(C)C 1776030631 ZECGHVHDWPUHOR-UHFFFAOYSA-N 342.464 5.112 30 20 EKED CC1(C)CCC/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C1=O 1776550838 KPUKYOJMBUIYDV-DEDYPNTBSA-N 348.442 5.143 30 20 EKED Cc1ccc2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)[nH]c2c1 66856339 IBLBVOBBCKEIOB-AWEZNQCLSA-N 349.459 5.123 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 90665394 BCUZKIOAKXTOIQ-MOPGFXCFSA-N 344.405 5.374 30 20 EKED Cc1csc(-c2ccc(NCc3ccc(O[C@H](C)C#N)cc3)cc2)n1 125045491 HLXAIRUNVVDMQD-OAHLLOKOSA-N 349.459 5.022 30 20 EKED Cc1c(Cl)cccc1N=C(O)CC/N=C(/O)[C@@H]1CC12CCCC2 329953466 JIVKIEJJWLBIIZ-ZDUSSCGKSA-N 334.847 5.163 30 20 EKED O/C(=N\C1CCC(/C(O)=N\CCC2=CCCCCC2)CC1)C1CC1 330018186 SIUVFIKNVUYUHS-UHFFFAOYSA-N 332.488 5.149 30 20 EKED CC[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 426303441 YBBDLNIILIWQSM-JKSUJKDBSA-N 330.884 5.391 30 20 EKED C=CC[C@H]1N(C(=O)Nc2c(C)cccc2SC)CCCC1(C)C 445167926 VWUZPPRDSAQEBT-MRXNPFEDSA-N 332.513 5.316 30 20 EKED CC1(C#N)CCC(Nc2ccccc2COCc2ccccc2)CC1 449042972 VPDZQIDNXTUZKW-UHFFFAOYSA-N 334.463 5.288 30 20 EKED Cc1nc(C(C)C)ccc1CNc1ccccc1S[C@@H](C)CC#N 453098071 ZBLMDZVYLZYNME-HNNXBMFYSA-N 339.508 5.520 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(C)(C)C)cc1 463013083 SHZPZEMZFJQTNH-DYESRHJHSA-N 336.479 5.560 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(COC2CCCCC2)c1 488365813 KIUWWMFXKPAGCI-IBGZPJMESA-N 342.483 5.108 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2sccc2[C@@H]1C 505061012 IKDPUANKTNCFBW-AWEZNQCLSA-N 326.465 5.018 30 20 EKED C[C@@H](NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccc(C#N)cc1 538392879 FGVXLRDRUKXELD-OAHLLOKOSA-N 348.396 5.277 30 20 EKED CCN(CCC1CC1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 546218609 PUJMZQWTHRWCRO-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 559857187 CJMWNTPFACYYAE-YJBOKZPZSA-N 344.405 5.374 30 20 EKED CCC[C@@H](NC(=O)CCCCCC#N)c1ccc(Cl)c(Cl)c1 588154757 MXTREOHFMOBLCN-MRXNPFEDSA-N 341.282 5.425 30 20 EKED Cc1c(CNCc2ccc(C#N)cc2F)sc2c(Cl)cccc12 590185752 XUIVHXAAPGTYSF-UHFFFAOYSA-N 344.842 5.164 30 20 EKED CC(C)[C@H]1CCCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609757071 ICTYAWSOPPXTSY-OAQYLSRUSA-N 348.446 5.001 30 20 EKED N#Cc1cccc(Cl)c1NCc1ccnc(Oc2ccccc2)c1 610274751 QDOITOKSLUWFLD-UHFFFAOYSA-N 335.794 5.011 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCSc2c(Cl)cccc21 618807019 SPHUXIYBIGSLDP-QZTJIDSGSA-N 340.879 5.026 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2ccc(Cl)cc2)c1 743476022 BDSLKYFNDNDGQS-ICSRJNTNSA-N 342.870 5.262 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccccc1SCc1ccccc1 778251106 NTVSQSXQFLVJPP-UHFFFAOYSA-N 326.465 5.019 30 20 EKED C[C@H](Nc1cccc(Cl)c1SC(F)F)c1cccc(C#N)c1 864010281 UIHHFYIMHPJEJA-JTQLQIEISA-N 338.810 5.699 30 20 EKED Cc1ccc(N[C@@H](C)CC2(C#N)CCOCC2)cc1-c1ccsc1 877839322 HJORHAJDZXBRAD-INIZCTEOSA-N 340.492 5.234 30 20 EKED CCOc1cc(/C=C\C(=O)c2ccc(Cl)s2)cc(Cl)c1O 916135778 RZKGOYYQGBCGEI-ARJAWSKDSA-N 343.231 5.055 30 20 EKED CCc1c(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)oc2ccccc12 1776956342 ZUMUQMFDPXHKBW-KTKRTIGZSA-N 348.398 5.206 30 20 EKED N#CCCn1cc(-c2csc(-c3ccccc3)n2)c2ccccc21 7843754 PXDNIHNWZZBERS-UHFFFAOYSA-N 329.428 5.345 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(C(C)(C)C)cc2)cc1 110656594 BMTGTWAKTIYNPT-SNQWNFELSA-N 333.431 5.171 30 20 EKED CC(C)(C#N)CCC[S@@](=O)[C@@H]1CCc2c(Cl)cc(Cl)cc21 153768680 NBEMHKCNYUTKHV-VFNWGFHPSA-N 344.307 5.059 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(F)cc1Cl 189878950 GKGSKNGFAJVHEC-UHFFFAOYSA-N 345.845 5.512 30 20 EKED N#CCCC[C@H](Nc1ncnc2sc3c(c12)CCC3)c1ccccc1 431491545 WGBKMLVXHXIPCL-INIZCTEOSA-N 348.475 5.027 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 481568014 KDGOPGDKWAIRCI-UHFFFAOYSA-N 337.448 5.003 30 20 EKED CCCOCc1ccccc1CN[C@H]1CCCCc2cc(C#N)ccc21 481913474 FZLVIFMPVVLEJD-QHCPKHFHSA-N 348.490 5.042 30 20 EKED C[C@@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1F 512664954 CHJXOLWIDQLDKS-SJKOYZFVSA-N 336.332 5.042 30 20 EKED N#CCc1ccc(NC(=O)CCCc2ccc(Cl)c(Cl)c2)cc1 514057148 SKBBCBZUIGOYOB-UHFFFAOYSA-N 347.245 5.021 30 20 EKED C=C(C)COc1cc(CNCc2ccc(C(C)C)cc2)ccc1OC 518780102 GHYPMLXUMXIHSV-UHFFFAOYSA-N 339.479 5.063 30 20 EKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2cc(C#N)ccc2C)cc1 531320551 VKPPPGHUUDVXFC-LAUBAEHRSA-N 347.462 5.180 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cnn(Cc2ccccc2)c1)c1ccccc1 537950398 VTNYFKIAYANONB-AUSIDOKSSA-N 345.490 5.290 30 20 EKED CCC[C@H](NCc1ccccc1C#N)c1cccc(C(F)(F)F)c1 538158027 KVOMTESZZUCHGJ-SFHVURJKSA-N 332.369 5.208 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccc(F)cc4)s3)CC2)c1 551577465 ZSVCALCJDUBNOC-UHFFFAOYSA-N 348.446 5.205 30 20 EKED CC(C)Oc1ccc([C@@H]2CCC[C@@H]2NCC(C)(C)CCC#N)cc1 558247527 PVILYVJXARELEF-PMACEKPBSA-N 328.500 5.029 30 20 EKED CCCCOc1ccc([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 585765164 VSLSREGUSKSECR-KSFYIVLOSA-N 334.463 5.075 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H]1CCc2cc(C#N)ccc21 588958822 VLUDHFXCZSXBDH-RBBKRZOGSA-N 341.458 5.003 30 20 EKED N#CCC[C@@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccccc1 611337061 LMJQLPOKNWWQBM-MSOLQXFVSA-N 345.273 5.615 30 20 EKED CC(C)Oc1cccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)c1 611390962 XPKGQHSVTXIRNO-KSFYIVLOSA-N 334.463 5.074 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1Cl 619754914 OLJAQGRJDJGORH-GOSISDBHSA-N 331.246 5.106 30 20 EKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1csc2ccccc12 730018906 BUHVUNZQRYEPLZ-CABCVRRESA-N 336.460 5.043 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 734708314 CTASMCVELLJOAV-IRXDYDNUSA-N 338.451 5.247 30 20 EKED Cc1cc(CON=Cc2cccc(Cl)c2Cl)c2ccccc2n1 742351469 YEOVNFCWTGROPI-UHFFFAOYSA-N 345.229 5.401 30 20 EKED CCOc1cccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1 743539229 YRDABNDTMGQPCY-SREVYHEPSA-N 341.457 5.166 30 20 EKED CCCc1ccc([C@H](C)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772983578 LANVKWMILDQQFS-LAUBAEHRSA-N 336.479 5.171 30 20 EKED C#CCCCCCC(=O)Nc1ccccc1-c1nc2ccccc2s1 779744269 YNHHXSMXZMCMCC-UHFFFAOYSA-N 348.471 5.486 30 20 EKED CCC[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797570783 KKIVYXSMSVQREY-JKSUJKDBSA-N 340.492 5.201 30 20 EKED C[C@@H](Cc1cccc(C(F)(F)F)c1)Nc1ccccc1O[C@H](C)C#N 798931579 GFEIIASMUMLSAL-UONOGXRCSA-N 348.368 5.039 30 20 EKED CCCC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 800387067 PWPVGLJLLXQWDV-ZBFHGGJFSA-N 326.465 5.121 30 20 EKED Cc1cc(Cl)ccc1CNc1ccccc1SC[C@@H](C)C#N 864006417 URQKYARHEMRXDW-ZDUSSCGKSA-N 330.884 5.512 30 20 EKED C=CCN(C(=S)Nc1ccccc1Oc1ccccc1)C(C)C 917589307 QACAVYRNEOOTCB-UHFFFAOYSA-N 326.465 5.072 30 20 EKED CCCCCCCOc1cccc(CNCCCCCCC(=O)O)c1 1776788747 XOTFNULGMVTLJX-UHFFFAOYSA-N 349.515 5.161 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)NCCCCC#N 171400584 PRBZOQHIUUZAMW-UHFFFAOYSA-N 341.842 5.131 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1c(F)cccc1Cl 181736560 NZPGKLVSALZLLJ-ZDUSSCGKSA-N 330.834 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](OCC)c1ccccc1 298600990 NDHJEERPGRJVOB-NRFANRHFSA-N 337.463 5.255 30 20 EKED Cc1nc2ccc(CN[C@H](CCCC#N)c3ccccc3)cc2s1 353918062 XEWCXSIYXAEXKS-GOSISDBHSA-N 335.476 5.130 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H](C)SCc1ccccc1 410369118 AAFCICMDQCCUQC-INIZCTEOSA-N 325.477 5.066 30 20 EKED Cc1ccc2sc(C(=O)Nc3sc(C)c(C)c3C#N)cc2c1 463071877 SMXCKNFZBBOMNF-UHFFFAOYSA-N 326.446 5.012 30 20 EKED C=C(C)CN(C)C(=O)Nc1cccc(CSCc2ccccc2)c1 477587816 MOMOJPUZADIYCW-UHFFFAOYSA-N 340.492 5.160 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2cccc(C#N)c2)o1 477900519 HPIGBXGQUKZYJO-UHFFFAOYSA-N 336.778 5.032 30 20 EKED CC(C)C(=O)Nc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1 481989575 JFFGFTMTYSBCFV-OAQYLSRUSA-N 347.462 5.032 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)Cc1ccc(CC#N)cc1 488865086 SPLAHPJTPMPVIF-FYSMJZIKSA-N 339.504 5.060 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C2CCC2)cc1 489809935 JCBGNFSEDZQWKU-UHFFFAOYSA-N 326.465 5.236 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1F 512632018 VWLZQMFIMJHDLT-ZUOKHONESA-N 326.390 5.028 30 20 EKED Cc1nn(C(C)C)cc1CNc1ccc(Oc2ccccc2)c(C#N)c1 543075910 ULRLWUKIFQVCSM-UHFFFAOYSA-N 346.434 5.049 30 20 EKED Clc1ccccc1-c1csc(CON=Cc2cccs2)n1 588510202 JLOJADNDDBRBHA-UHFFFAOYSA-N 334.853 5.076 30 20 EKED C[C@@H](c1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1)C(F)(F)F 590712592 PTENCIHFHMYTBZ-UONOGXRCSA-N 332.369 5.075 30 20 EKED N#CC1(CC(=O)Nc2cc(Cl)ccc2C(F)(F)F)CCCCC1 598836337 GTRBHIUWZMWDPM-UHFFFAOYSA-N 344.764 5.161 30 20 EKED C=CCCCCCN(C)C(=O)c1c(-c2ccccc2Cl)noc1C 606816651 IGNMLAVCNUHMIG-UHFFFAOYSA-N 346.858 5.122 30 20 EKED Cc1cc(C#N)ccc1CN[C@@H](Cc1ccccc1)c1cccs1 614405710 FJUXZONWPJAVES-FQEVSTJZSA-N 332.472 5.002 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc2c(s1)CCCC2 619755622 NOKMIAIJIFUFHA-LBPRGKRZSA-N 330.884 5.003 30 20 EKED CC(C)(CCC#N)COC(=O)c1ccccc1SCc1ccco1 798877746 CSYXKYDPIMFLOO-UHFFFAOYSA-N 343.448 5.059 30 20 EKED C=CC[C@H](C(=O)O[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803061897 CTHIXLVMKLDGQI-BBRMVZONSA-N 349.352 5.065 30 20 EKED CC(C)(CCC#N)CNC(=O)c1c2ccccc2cc2ccccc12 809260413 DCAKJAJUUQRXHR-UHFFFAOYSA-N 330.431 5.053 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(Br)nc1)c1ccccc1 810228767 YRFDZFYOSNUFTN-RHSMWYFYSA-N 345.284 5.202 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211153 FFRBGVJBJHAJSJ-HIFRSBDPSA-N 340.389 5.273 30 20 EKED C[C@H]1CCN(C(=O)Nc2ccc(C#N)cc2C2CC2)[C@@H](c2ccco2)C1 933846573 DCJSKPXLMPPCQN-IFXJQAMLSA-N 349.434 5.034 30 20 EKED C[C@H]1C(=Nn2c3ccccc3c3ccccc32)CC[C@H](C(=O)O)C1(C)C 1776113015 SRZLIOSLFWFPRL-WMLDXEAASA-N 348.446 5.156 30 20 EKED C[C@@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1ccc(OCC#N)cc1 182005984 BNJAYKAVBKKEPN-IIBYNOLFSA-N 334.463 5.052 30 20 EKED Cc1ncc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 367803885 SXIRPRLWEXCKGM-CABCVRRESA-N 347.487 5.402 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)CC2CC(c3ccccc3)C2)cc1 409710950 NHTMOGBGQIJOOJ-UHFFFAOYSA-N 332.447 5.010 30 20 EKED N#CC1(CC[S@](=O)Cc2cccc(Cl)c2Cl)CCCCC1 417160678 IESSSBBKJIQBEJ-NRFANRHFSA-N 344.307 5.106 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 449445704 LDMLGYLFSKJSEC-VIBAHUMZSA-N 336.401 5.013 30 20 EKED C=C(C)CCS[C@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 507095019 XRNRFVABRYWRRJ-LLVKDONJSA-N 346.477 5.417 30 20 EKED C=CCN(Cc1cccs1)C(=O)c1ccc(SC(C)C)cc1 512461987 GEOJGIMKSJGRMY-UHFFFAOYSA-N 331.506 5.077 30 20 EKED Cc1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(C)s1 520293966 MDBLDWTVAVBADZ-UHFFFAOYSA-N 335.432 5.036 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)cc1OC)c1ccccc1 537945970 HKVHCJRFDMTEQA-JXFKEZNVSA-N 325.452 5.062 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(SC)c1C 538211379 UOBIMJYWNWLOJH-UHFFFAOYSA-N 344.455 5.076 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cncnc1C)c1ccc(C(F)(F)F)cc1 570739733 SRIBXBBLAVXLQE-KBXCAEBGSA-N 349.400 5.162 30 20 EKED N#Cc1ccc(CSc2nc(-c3ccco3)nc3ccccc23)cc1 589573652 IZAPHSXBTICFSK-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 605945839 HCZHYJCEVISDEE-LJQANCHMSA-N 342.870 5.037 30 20 EKED Cc1ccc2oc(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)cc2c1 609415309 QCOCEWSTMJMSKB-GOSISDBHSA-N 346.430 5.033 30 20 EKED COc1ccccc1-c1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1 610270666 TYIFBBPZYWJIQX-QGZVFWFLSA-N 342.442 5.085 30 20 EKED Cn1cc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)c2ccccc21 727267502 WDGCCPHQZPHALI-VAWYXSNFSA-N 344.439 5.198 30 20 EKED CCCCCCCS(=O)(=O)Cc1nc(C2CCCCC2)cs1 766877686 VYJVSFJWVHYZDH-UHFFFAOYSA-N 343.558 5.076 30 20 EKED CCOc1cccc2cc(C(=O)/C=C/c3scnc3C3CC3)oc12 782304374 BIKVRPMLJFIDRF-CMDGGOBGSA-N 339.416 5.062 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)C(C)(C)C)cc1 1776788227 SDDQDBKVDUDCFZ-IBGZPJMESA-N 349.515 5.015 30 20 EKED C[C@H](CCC(=O)Nc1ccccc1SCCC#N)c1ccccc1 120012804 VEPQSCQOPXBOLE-MRXNPFEDSA-N 338.476 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccncc1)C1CC1 191437543 SNRCWYCEBHJESL-UHFFFAOYSA-N 349.478 5.130 30 20 EKED CCC(CC)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1 236682205 CTSHKGZGGCSZRD-HTAPYJJXSA-N 336.479 5.245 30 20 EKED CC1(C)CCCC[C@@H]1CC(O)=Nc1cccc([C@H]2CN=C(O)C2)c1 328643405 FHXXVSFFMCZPAM-HZPDHXFCSA-N 328.456 5.325 30 20 EKED C[C@H](C(=O)Nc1ccccc1-c1cccs1)c1cccc(C#N)c1 463236562 LTLSDZSFXSBLIF-AWEZNQCLSA-N 332.428 5.029 30 20 EKED CC(C)CC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 465248183 BAFQEJWHQDZAKM-HNNXBMFYSA-N 345.512 5.029 30 20 EKED C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(-c2ccccc2OC)cc1 467314440 KYJGHWCSLIBOKE-QGZVFWFLSA-N 349.474 5.308 30 20 EKED CC(C)C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cccs1 475113035 FOXLTTTYPGPLOK-MSOLQXFVSA-N 340.492 5.039 30 20 EKED CCCn1ccc2ccc(NC(=O)C[C@@H](CC#N)c3ccccc3)cc21 476205896 PSVPFQHWJVRUCC-LJQANCHMSA-N 345.446 5.077 30 20 EKED Cc1ccc(C)c([C@H]2CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)c1 476317112 YUVMJPJQHUSSST-OAQYLSRUSA-N 346.474 5.082 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2C)nnc1-c1ccoc1C 481447485 CHBHTOUYBFOSCU-OAHLLOKOSA-N 339.464 5.194 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 488647926 TWYHTBVORYACPK-SFHVURJKSA-N 334.444 5.109 30 20 EKED CCc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 503227762 XJRZZZFBXCKEET-CQSZACIVSA-N 339.464 5.287 30 20 EKED N#Cc1ccc(/C=C\c2nc(-c3c(Cl)cccc3Cl)no2)cc1 517609315 DIUMBGRCMHLCEA-HJWRWDBZSA-N 342.185 5.085 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCCCc3ccccc32)cc1 523700298 URBUKQHUSOVLHB-HXUWFJFHSA-N 347.462 5.077 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1)c1ccccc1 536204802 PPDYXXWTABAVBS-ILZDJORESA-N 337.463 5.248 30 20 EKED C[C@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)c(F)c1 539607226 DIZXJSUWPLDNMR-BTDLBPIBSA-N 349.236 5.342 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)c2ccccc12 558172241 FFJRUTIKFDOQML-MRXNPFEDSA-N 346.449 5.631 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)cc(Cl)c1N)c1ccccc1 602669426 IRBPDAZEAKGECI-KRWDZBQOSA-N 348.277 5.100 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)cc(Cl)c1N)c1ccccc1 602669430 IRBPDAZEAKGECI-QGZVFWFLSA-N 348.277 5.100 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1 609825587 HBIRADOALWVQFQ-OLZOCXBDSA-N 344.867 5.033 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(C#N)c1 615982860 BAWWCOPYODIODX-INIZCTEOSA-N 349.478 5.517 30 20 EKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 737502285 GDDBNTHJUSWXMR-HNAYVOBHSA-N 346.455 5.146 30 20 EKED CC(C)c1ccc(C=NO[C@H](C)c2nnc(-c3cccs3)o2)cc1 748097166 DNICPEJJJHKXBS-CYBMUJFWSA-N 341.436 5.033 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1ccc(N2CCCCCC2)cc1 799727017 VHQYSZVBOVSMQV-HDYDNRTBSA-N 339.527 5.048 30 20 EKED CCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 915087330 SHTJEPCIMAVGIX-LJQANCHMSA-N 346.455 5.218 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(Cl)c(Cl)c1 916137184 UYCUGVLTPJMXEC-YWEYNIOJSA-N 328.198 5.438 30 20 EKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccc(Cl)cc3)c2c1 1776114959 HIQSRBJZQAOEQF-CLTKARDFSA-N 342.803 5.149 30 20 EKED CCN(Cc1ncc(-c2ccccc2C)o1)[C@H](C)c1ccc(C#N)cc1 75645772 IBEHXJVZMGJJEY-QGZVFWFLSA-N 345.446 5.105 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H](C)c3ccc(C#N)cc3)oc12 118443160 YGDYXDPFMPYRFL-CABCVRRESA-N 334.419 5.115 30 20 EKED C[C@@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1ccc(C#N)cc1 154320088 DUNFRRNRLFFCTQ-ZIAGYGMSSA-N 346.446 5.327 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccc3nc(C4CC4)sc3c2)cc1 178205084 SODFFBPPFOIQTQ-ZDUSSCGKSA-N 349.459 5.077 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)nc1C 276488836 UGWPLOOHOTWBLK-UHFFFAOYSA-N 342.870 5.077 30 20 EKED N#CCC[C@@H](N[C@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 343732105 WEIZWGCACKMRPN-CTNGQTDRSA-N 329.447 5.180 30 20 EKED N#CCCC[C@@H](Nc1ncnc2cc(Cl)ccc12)c1ccccc1 431142977 HWPXSLBHWNEUJT-QGZVFWFLSA-N 336.826 5.130 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(SCCCCC(F)(F)F)n1 443524533 VSODTVLTDAVBNB-UHFFFAOYSA-N 342.308 5.105 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC(C)(C)C1 443606424 XPJVWDODMCPUHS-HUUCEWRRSA-N 345.512 5.029 30 20 EKED C=CCCCCCS[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F 485576011 HGEQRFZVEVLKNZ-ZDUSSCGKSA-N 345.430 5.512 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1c(F)cccc1F 505022534 FDUZZECYRLUOJA-AWEZNQCLSA-N 344.405 5.308 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2ccc(Cl)cc2C1 505045344 ILPYNLFAKZIALV-UHFFFAOYSA-N 340.854 5.049 30 20 EKED N#CCc1ccc(C(=O)Nc2ccccc2SC2CCCC2)cc1 536152527 ZVRMVOKGRZHJTF-UHFFFAOYSA-N 336.460 5.040 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 586795010 TZCZHLIDXXTSBJ-RNJTYBCJSA-N 336.401 5.013 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(F)c2ccccc12 590254395 UDAHHENHLQSRQJ-RCDICMHDSA-N 330.406 5.189 30 20 EKED C[C@@H](Nc1nc(C(C)(C)C)ccc1C#N)c1ncc(-c2ccccc2)o1 613425808 LKQQJECUYACJTK-CQSZACIVSA-N 346.434 5.079 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC=C)C1 666866095 HQGJTFVNGSFLBY-QGZVFWFLSA-N 326.484 5.359 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3ccco3)s2)n1 675925234 IURGTWLOXNLLJV-LLVKDONJSA-N 342.445 5.078 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F 727973021 PSQKXELQUAWKKR-WAYWQWQTSA-N 330.227 5.019 30 20 EKED C=CCOc1ccc(CNC(C)(C)c2ccc(F)cc2)cc1Cl 728593452 RKWHYARTEJFDIY-UHFFFAOYSA-N 333.834 5.069 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2nccc3ccccc23)c1 757474899 MVYMNAAPEXIOPK-FPLPWBNLSA-N 339.341 5.041 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCC[C@H]3C)n2)cc1 769282456 ODRXZLYLZGENNP-HYVNUMGLSA-N 338.476 5.121 30 20 EKED C=C(C)[C@H](NC(=S)Nc1c(C)cccc1C)c1ccc(F)c(F)c1 774206758 OXGFBPUWKYHTKU-KRWDZBQOSA-N 346.446 5.185 30 20 EKED C=C(C)[C@@H](NC(=S)Nc1c(C)cccc1C)c1ccc(F)c(F)c1 774206761 OXGFBPUWKYHTKU-QGZVFWFLSA-N 346.446 5.185 30 20 EKED COc1cc(C=NOCc2cccc3ccccc23)ccc1OC(C)C 854087524 JGFCXTRSSDKRDG-UHFFFAOYSA-N 349.430 5.186 30 20 EKED CCCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916650288 AGBYHYZVFOSWIU-KRWDZBQOSA-N 340.492 5.655 30 20 EKED CCOc1cccc(C=Nc2ccc(Oc3cccnc3)c(C)c2)c1O 920177798 KSLLJYIJLVEBCS-UHFFFAOYSA-N 348.402 5.037 30 20 EKED CCc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)s1 1776966076 VRQSAEHVOGQKDM-ZZXKWVIFSA-N 342.441 5.120 30 20 EKED Cc1cccc2c1CC/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1777457217 GLQLYUOWWCARPA-LCYFTJDESA-N 348.423 5.120 30 20 EKED Cc1ccccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777465338 SFKMOLHCIHYKJR-OVCLIPMQSA-N 342.394 5.256 30 20 EKED N#Cc1ccc(NC(=O)c2sccc2-c2ccccc2)cc1Cl 15532668 IRYGMGSXXCJFHP-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#CCC[C@@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccccc1 90664645 AVCJMSBSBKHJCE-QZTJIDSGSA-N 342.895 5.512 30 20 EKED CC[C@H](C)N(Cc1ccccc1)C(=O)N[C@@H](CCC#N)c1ccccc1 160598675 ZRSXKEJDBJLHIN-RXVVDRJESA-N 349.478 5.042 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Sc2nc(C)cs2)cc1 303901331 SRZIUVXRZKDNFB-UHFFFAOYSA-N 347.509 5.033 30 20 EKED CC(O)=Nc1ccc(N/C(O)=N/[C@@H]2CCCCC23CCCC3)cc1 329602722 FZMQWUPKIVPQOI-QGZVFWFLSA-N 329.444 5.123 30 20 EKED COc1ccc2c(c1)[C@@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340451766 OVIYIDKYQYQJCR-YADHBBJMSA-N 334.463 5.097 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(CSCC)c1 438395293 IWUXOSLWGPDOKZ-UHFFFAOYSA-N 346.521 5.221 30 20 EKED C[C@H](NCCCC1CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1 470318291 MWOSNLFKBJBOSH-SFHVURJKSA-N 348.490 5.083 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CC)(CC)C1 475579738 AKDFLNIPIAAOOS-UHFFFAOYSA-N 328.500 5.583 30 20 EKED C=C[C@H](CC(=O)N(CCC)[C@H]1CCCc2cccnc21)c1ccccc1 475953219 HPDUMYQRQXUZLJ-NQIIRXRSSA-N 348.490 5.058 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OC)cc1F)c1ccc(F)c(F)c1 480659100 MGLFBYIBXRFEBA-HXPMCKFVSA-N 335.369 5.081 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1F 512630895 ORXHWCHAEHPHKT-QRQCRPRQSA-N 348.396 5.277 30 20 EKED C=CCC(C)(C)C(=O)N[C@H](C)c1ccc(-c2ccccc2OC)cc1 551093343 KVYYOCXKPNHSJV-MRXNPFEDSA-N 337.463 5.142 30 20 EKED C=CCC[C@H](NCc1ccc(-c2csc(C)n2)cc1)c1ccco1 552048481 UOFVLIJWUXNRNR-SFHVURJKSA-N 338.476 5.509 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CC2(CCCCC2)Oc2ccccc21 562044723 NKQZMZXTBDXKTQ-GOSISDBHSA-N 326.484 5.133 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C(C)(C)Cc1ccccc1 605079731 DTVRFJCYJVFVOK-UHFFFAOYSA-N 347.911 5.185 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](CC)c1ccccc1 609639089 ROVMEFWPZDKESK-OAQYLSRUSA-N 349.478 5.538 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1C 747193097 FCCJIHKMKTXZMW-JTGQJZMRSA-N 338.476 5.081 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C\c2coc(-c3ccccc3)n2)cc1 749886399 MLMQYIKYBZXFRL-RAXLEYEMSA-N 333.387 5.025 30 20 EKED Cc1ccoc1C(=O)/C=C\c1csc(-c2ccc(Cl)cc2)n1 769783934 JTZKSODNKCQDFT-SREVYHEPSA-N 329.808 5.261 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(Br)cc1F)c1ccccc1 783258120 APBLQESWVRPSTN-UGSOOPFHSA-N 346.243 5.003 30 20 EKED COc1ccc2cc(NCc3ccc(C(C)(C)C#N)cc3)ccc2c1 795287798 XEIQDVNVCOPRFQ-UHFFFAOYSA-N 330.431 5.262 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(SC(C)(C)C)cc1 820764666 FCOMNHZIDSRSHP-IYBDPMFKSA-N 330.497 5.292 30 20 EKED C#CCCCS[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 842178912 RNHSSMACTVTQBE-JTQLQIEISA-N 341.263 5.251 30 20 EKED C[C@H](CC(C)(C)C#N)Nc1cccc(C[S@](=O)C2CCCCC2)c1 926091816 OSHNPYHMTBHWCE-GYCJOSAFSA-N 346.540 5.008 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1 1776339817 RSUZEORUEGZQBC-ZHACJKMWSA-N 342.822 5.133 30 20 EKED CCc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776968912 MUCKJARCPCYANP-KPKJPENVSA-N 346.382 5.103 30 20 EKED OC(=Nc1ccc2nc(C3CC3)oc2c1)N1CCCC12CCCCC2 328889907 QZRVJZFOZAGMNU-UHFFFAOYSA-N 339.439 5.049 30 20 EKED OC(=Nc1ncccc1OCC1CCCCC1)[C@@H]1CCC(F)(F)C1 330039080 BQVINNWICLGZMW-CQSZACIVSA-N 338.398 5.064 30 20 EKED N#CCCC[C@H](NC(=O)CC/C=C\c1ccccc1)c1ccccc1 352207127 UESNMCWGZUTRRO-NIEFLNLKSA-N 332.447 5.031 30 20 EKED Cc1nc(-c2cc([C@H](C)NCC3CCC(C#N)CC3)cs2)cs1 442856879 OXQUAQLWLONHLJ-GRTSSRMGSA-N 345.537 5.161 30 20 EKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)CCCCC(C)(C)C#N 444594140 GYZLQFHWMGNMGG-AWEZNQCLSA-N 326.406 5.418 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CCc1ccco1 475552777 SAVXMUAQJODHOU-INIZCTEOSA-N 340.467 5.274 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 480669532 BVEZLXPUWTZLBK-BFUOFWGJSA-N 346.377 5.149 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccccc1C(F)(F)F 480886785 SJBFQIGYGWUMHG-LLVKDONJSA-N 338.760 5.081 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1c(Br)cccc1SCC 484886840 RKONQSUPIYSQCY-LLVKDONJSA-N 342.302 5.102 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(CC#N)c2)c(C)c1 498486697 SZDUAIDHDNLRCT-HNNXBMFYSA-N 338.476 5.204 30 20 EKED CC(C)(C#N)CCCN[C@H](c1c(Cl)cccc1Cl)C1CC1 518444123 PFXXSEVWZNTLED-INIZCTEOSA-N 325.283 5.364 30 20 EKED C[C@H](NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccc(C#N)cc1 538392875 FGVXLRDRUKXELD-HNNXBMFYSA-N 348.396 5.277 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(SCC(F)F)cc1 610829949 SVXUDCXSPSDLLU-ZIAGYGMSSA-N 346.446 5.327 30 20 EKED C[C@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C#N)cc1 613667629 YJXYWQCAZYLXBC-NSHDSACASA-N 340.295 5.385 30 20 EKED C=CCC1(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)CCC1 683063115 GXPSZNUXJIJVPR-UHFFFAOYSA-N 333.300 5.026 30 20 EKED N#CCCSc1ccccc1NC(=S)Nc1ccc(Cl)cc1 730953225 UPAVWXOADUWCBU-UHFFFAOYSA-N 347.896 5.155 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 740764135 LQCBQQYJFHWHAT-HJWRWDBZSA-N 327.305 5.150 30 20 EKED CCCCCCCCC(=O)NCc1coc(-c2ccc(C)cc2)n1 744742688 ZLLGEMGLFVHGNE-UHFFFAOYSA-N 328.456 5.017 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc3c(c2)CCCC3)c1 772982154 FTONXEDSLZAIPS-VGSWGCGISA-N 348.490 5.097 30 20 EKED C#CC[C@@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccccc1 773116361 RIORVXIUZWSBBQ-OXQOHEQNSA-N 333.431 5.165 30 20 EKED C=CCC[C@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 778597366 CUPNPOPKLULJMT-PMACEKPBSA-N 340.426 5.161 30 20 EKED Cc1ccc2c(C[S@@](=O)CCCC(C)(C)C#N)c(C)ccc2c1 871614642 JGESYHQWQCRQIN-QHCPKHFHSA-N 327.493 5.035 30 20 EKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1ccccc1Cl 921261411 OCEXIEOUDBVLKH-JXMROGBWSA-N 340.728 5.177 30 20 EKED C=CCn1c(S[C@H](C)c2ccc(F)cc2)nnc1-c1ccccc1 58059779 WIJBWGJAKMTGAI-CQSZACIVSA-N 339.439 5.124 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 255168570 VKAGENUEJISLLF-WASHYIJTSA-N 344.867 5.200 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)C(C)(C)C1CCCC1)C(O)=N2 328857419 KPXOOXAKEGZALW-INIZCTEOSA-N 342.483 5.497 30 20 EKED C[C@@H](SC/C(O)=N/C1CCCCCC1)c1nc2ccccc2o1 329253828 WKQXJNOBLLSCLK-CYBMUJFWSA-N 332.469 5.301 30 20 EKED Cc1cc(Cl)c2ccccc2c1N=C(O)C[C@H]1CCCC(O)=N1 329630608 HZQUTVYSKLMAHT-GFCCVEGCSA-N 330.815 5.289 30 20 EKED N#CCc1ccc(CNC2(c3c(Cl)cccc3Cl)CCC2)cc1 447379308 BKKVXXYSTYRYCK-UHFFFAOYSA-N 345.273 5.228 30 20 EKED C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 466650553 JIKHIWYTTMZBFY-GRDNDAEWSA-N 339.401 5.217 30 20 EKED C=C[C@@](C)(CC)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 467848356 CGFQCPGSBIIYNY-CVDCTZTESA-N 346.474 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2cc(C)ccc2O1 476997899 DBWXYFWDGAMRGE-OAQYLSRUSA-N 349.474 5.179 30 20 EKED CCN(Cc1csc(-c2ccccc2)n1)[C@H](C)c1ccc(C#N)cc1 497594132 QODUSRGVNQXZMJ-MRXNPFEDSA-N 347.487 5.265 30 20 EKED Cc1sc(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c(C#N)c1C 518702424 SQDVHJCBAPJLGM-ROUUACIJSA-N 346.455 5.132 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(N2CCC(C)CC2)c1 524832166 POPLATZRHHZAHG-UHFFFAOYSA-N 343.515 5.133 30 20 EKED COc1ccccc1[C@H](CC(C)C)N[C@H](C)c1ccc(C#N)c(F)c1 538508665 XHEHMIUFBBHDOB-QRWLVFNGSA-N 340.442 5.144 30 20 EKED Cc1sc(C(C)(C)NC[C@H](C)CCC#N)nc1-c1ccccc1F 602675146 RLTIFBOOJHHXHZ-CYBMUJFWSA-N 345.487 5.022 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 605945836 HCZHYJCEVISDEE-IBGZPJMESA-N 342.870 5.037 30 20 EKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 614178900 HLIIXYGJEOGCGW-LJQANCHMSA-N 328.406 5.007 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc2ccccc2c1 731835896 VFFCVYJBWPTECI-SEYXRHQNSA-N 325.367 5.391 30 20 EKED CC1(C)CCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 750588538 PLHXLFUVDRUTMA-PMACEKPBSA-N 347.462 5.042 30 20 EKED N#CC1CCC(COC(=O)c2sc3ccccc3c2Cl)CC1 755965877 KVINRACOTPPUAW-UHFFFAOYSA-N 333.840 5.041 30 20 EKED CC(C)CC1(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)CCCC1 756274729 HXJJVGWMDMYPCT-AWEZNQCLSA-N 344.455 5.218 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc(Cl)nc1Cl 761479032 JEUHMZWNOQVXAR-FSEMZKDTSA-N 342.272 5.210 30 20 EKED CC(C)[C@H]1CCc2ccccc2[C@H]1N[C@@H](C)c1ccc(OCC#N)cc1 765809326 MDFCRGVBXKHCNU-LXBDKUERSA-N 348.490 5.199 30 20 EKED CC[C@@H](Nc1cc(F)c(OC(C)C)c(F)c1)c1ccc(C#N)cc1 774355348 RLLRWCANRUNEMC-GOSISDBHSA-N 330.378 5.187 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2nccc3ccccc23)cc1C 792092494 CAGNIMHUPVBVQP-GEPASTNRSA-N 340.426 5.050 30 20 EKED C[C@@H](CCCC(F)(F)F)Nc1ccc(OCC(F)(F)F)c(F)c1 800497712 QCKWORJIUVRYEV-VIFPVBQESA-N 347.274 5.300 30 20 EKED CCCCCCCCC(=O)N1CCc2[nH]c3ccc(C)cc3c2C1 914500448 AQNYXMXSTKNZJU-UHFFFAOYSA-N 326.484 5.112 30 20 EKED O=C(/C=C/c1cccs1)c1cc2cc(Br)ccc2o1 7716107 YKSDGSDQPAZKSY-SNAWJCMRSA-N 333.206 5.153 30 20 EKED CC[C@H](c1ccccc1)c1nnc(S[C@@H](C)c2ccc(C#N)cc2)o1 118176876 CEDRRVYLKSVTHF-KBXCAEBGSA-N 349.459 5.336 30 20 EKED C=CCC(CC=C)C(=O)N1CCc2sccc2[C@H]1c1cccs1 121497826 YRKDMZGFQVYWBO-SFHVURJKSA-N 343.517 5.052 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1sccc1C#N 158163068 IAUPNJMEVYVBIX-UHFFFAOYSA-N 330.478 5.071 30 20 EKED C[C@@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(C#N)cc1 181901539 IRYNMGVMYGDXCL-VFNWGFHPSA-N 347.849 5.047 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(CC)CC)no1 189911849 PMDKLFJKVKHDPK-UHFFFAOYSA-N 340.467 5.682 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CCSCC 191430558 OIYCSBBLLKVKLT-INIZCTEOSA-N 348.556 5.534 30 20 EKED CCc1nc(C)c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)s1 340436619 RXNYKOVNQOWYRD-RHSMWYFYSA-N 327.497 5.100 30 20 EKED N#CCC[C@@H](NC(=O)c1ccc(C2=CCCC2)cc1)c1ccccc1 355344636 HTMJVKUPNILWKF-OAQYLSRUSA-N 330.431 5.029 30 20 EKED CCC(CC)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 392245973 PYAYYVBIHSRXNZ-VGSWGCGISA-N 336.479 5.417 30 20 EKED C[C@H]1C[C@@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccsc2S1 417375081 YZLJTHUGSVFIOQ-UYHISHBKSA-N 340.517 5.212 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1ccc(C#N)cc1 447591238 HIXALNKAJUFPGN-UGSOOPFHSA-N 348.368 5.259 30 20 EKED CCC1(CC)CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 458832738 IGTYMRDRIKYOQN-IBGZPJMESA-N 341.499 5.033 30 20 EKED C=CCn1c(S[C@H](C)c2cccc(C)c2)nnc1-c1ccoc1C 463038475 PTRYVYSELFRYJE-OAHLLOKOSA-N 339.464 5.194 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(COC(C)(C)CC)c1C 467335487 KUQZNFOAAMTHCH-UHFFFAOYSA-N 329.484 5.407 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CC(c2ccccc2)C1 475553649 ZKEVTDPEDYPPDX-UHFFFAOYSA-N 348.490 5.606 30 20 EKED C=CCC1(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)CCC1 480030097 OMEPGTYJWRZGRS-KRWDZBQOSA-N 334.463 5.545 30 20 EKED C=CCCCCCSCC(=O)Nc1ccccc1C(F)(F)F 485560627 LIWMIPXHYFHPGP-UHFFFAOYSA-N 331.403 5.124 30 20 EKED Cc1ccc2sc(C(=O)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 486280613 FIFXGEQKAFEGGN-GOSISDBHSA-N 348.471 5.293 30 20 EKED C[C@@H](Nc1cc(Cl)ccc1C#N)c1nc2ccccc2n1C(F)F 486451312 NPUIKZIQJDIYRP-SNVBAGLBSA-N 346.768 5.130 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1cccc(C#N)c1 520640352 SUNFYSXTMPIRBN-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 524567227 KDESFBAFBRQVKC-NHCUHLMSSA-N 347.483 5.220 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(-c2nc(C)cs2)c1 525347280 UFYFLWHDQWVVKE-UHFFFAOYSA-N 343.496 5.329 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(C2CC2)s1 530401786 JUFPDESQRGJSCI-UHFFFAOYSA-N 326.465 5.125 30 20 EKED C=CCCOCCCCC(=O)N1CCC[C@H](C)[C@H]1c1ccc(C)cc1 539404528 UMOYZYJOYSRLSN-UGKGYDQZSA-N 343.511 5.058 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2ccc[nH]2)cc1 544255782 QGNJXILJOQLQOA-UHFFFAOYSA-N 349.409 5.041 30 20 EKED CCC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550836524 RFTYXZOJXMCAJD-NHCUHLMSSA-N 340.898 6.206 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 620595241 JHUGRQHJZNWZAV-HNNXBMFYSA-N 335.403 5.020 30 20 EKED C=CC[C@@H](N[C@H](CC)c1ccc(Br)cc1)c1ccncc1 766020947 RPSJFHOZOASQDU-QZTJIDSGSA-N 345.284 5.202 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(OC2CCC2)c(F)c1 767808331 HKSSMCKMCOAFFA-UHFFFAOYSA-N 338.426 5.170 30 20 EKED C#CCCCCC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 773204344 DQMYJXUNCOPGLO-UHFFFAOYSA-N 348.471 5.019 30 20 EKED CC1(C)CC(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796796687 ILVUSQAUDJBTOQ-CQSZACIVSA-N 344.867 5.076 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NC[C@H]1CCCC1(F)F 926520898 AMRKOVXZZBJKQH-SECBINFHSA-N 341.286 5.065 30 20 EKED CCCCCCCCCCCCCCC(=O)NCc1ccccc1 2297752655 CBYQHFBHSMAGBU-UHFFFAOYSA-N 331.544 6.394 30 20 EKED C[C@@H](Sc1c(C#N)nnc2ccccc12)c1ccc(Cl)cc1 77213646 IPOLOOLTIIEABB-LLVKDONJSA-N 325.824 5.008 30 20 EKED C=CCCC(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1 171420124 PGOJWKZWFJAZDA-UHFFFAOYSA-N 342.851 5.581 30 20 EKED CCCCCCCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 303479630 KDDZTNVVFNVZHJ-UHFFFAOYSA-N 332.488 5.279 30 20 EKED N#C[C@H]1CC[C@H](Nc2ccccc2OCc2cccc(Cl)c2)C1 442857960 HDOPMOMWGHPSNC-YOEHRIQHSA-N 326.827 5.023 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCC#Cc1cccc(Cl)c1 448058952 VADLGAOJOJLGQE-HNNXBMFYSA-N 340.879 5.055 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 467736694 XTPWLPGMPLCUJW-UHFFFAOYSA-N 348.471 5.670 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C\c1ccc(C)cc1 476127507 BBSCABUORCSIES-TWGQIWQCSA-N 333.475 5.889 30 20 EKED C[C@@H](C(=O)Nc1cccc(Nc2ccccc2)c1)c1cccc(C#N)c1 486350781 NDAOPVRYMVYOLG-MRXNPFEDSA-N 341.414 5.044 30 20 EKED N#Cc1cc(NC(=O)CCCC(F)(F)F)ccc1Oc1ccccc1 494006303 HRNPSMJKPMCIBJ-UHFFFAOYSA-N 348.324 5.022 30 20 EKED N#Cc1cnc(N[C@H](Cc2ccccc2)c2ccccc2)c(Cl)c1 513635758 RCFNECYWZRUNAB-LJQANCHMSA-N 333.822 5.003 30 20 EKED CCc1ccc([C@@H](C)CC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 523110890 LHCQOCAKPKUPNS-SFHVURJKSA-N 348.490 5.051 30 20 EKED N#C[C@@H](Sc1nnc(CCC2CCCCC2)o1)C1CCCCC1 523712349 PZHRKOISLPGUDT-MRXNPFEDSA-N 333.501 5.147 30 20 EKED C[C@H]1CCC[C@@H](OCc2cccc(NCc3cc(C#N)cs3)c2)C1 532728370 OMXCLQWGUNKQOU-HNAYVOBHSA-N 340.492 5.327 30 20 EKED C=CCC[C@H](NCc1ccc2c(c1)nc(CC)n2C1CC1)c1ccco1 552257570 MDCSQYQSJVTMEB-SFHVURJKSA-N 349.478 5.324 30 20 EKED CC(C)(NCc1csc(C2CCCCC2)n1)c1cccc(C#N)c1 595634902 HZAOQBICRVHXCQ-UHFFFAOYSA-N 339.508 5.087 30 20 EKED C[C@H](Nc1cccc(OCc2cccc(F)c2)c1)c1cccc(C#N)c1 600851426 YQLZKYVDOMGGNV-INIZCTEOSA-N 346.405 5.449 30 20 EKED C=CCCSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 606756034 XHSYPRISPUJUDJ-MRXNPFEDSA-N 335.476 5.223 30 20 EKED C=CCCCCCN(C)C(=O)c1cc2c(s1)-c1ccccc1OC2 606816377 VDMAPONQIFCWCM-UHFFFAOYSA-N 341.476 5.126 30 20 EKED C[C@@H](CC1CCOCC1)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611871374 ATGLLHQIOQKOQV-ROUUACIJSA-N 348.490 5.081 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1ccc(SC(F)F)cc1 734979947 GCOSAEZEXSTZCB-XFSBKJJWSA-N 340.778 5.256 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCCC[C@@H]1c1ncc[nH]1 737821310 AHUPVSZGVBICJW-PMXLPMHFSA-N 331.504 5.160 30 20 EKED COCc1cccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c1 742434314 GZCCKBVWVJAAIB-YHYXMXQVSA-N 334.387 5.044 30 20 EKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)Cc2cc(Cl)ccc21 742437155 JADDCSYFKITXER-UVTDQMKNSA-N 337.831 5.286 30 20 EKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccc(C)o1 743444211 HPCJSWRCUKCHDY-UHFFFAOYSA-N 339.342 5.053 30 20 EKED Cc1ccc(O)c([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c1 756785307 CSYRGQSHEVSWJN-KRWDZBQOSA-N 342.442 5.090 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(N(C)C(C)C)c1 776839486 SGGFZRUOWNLDPX-UHFFFAOYSA-N 340.492 5.062 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568368 QWNVSNQOCJSJPX-HOCLYGCPSA-N 340.492 5.119 30 20 EKED C=CCCCCCCCCNC(=O)c1c(Cl)cncc1Cl 816682980 PCSAGVFIGFYSRT-UHFFFAOYSA-N 329.271 5.035 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1cccc(F)c1 917714011 QBJNCSCLVOZVFF-MDZDMXLPSA-N 348.402 5.078 30 20 EKED C=CCN(C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)C(C)C 918058283 HEKPNGSZBRBZDT-LJQANCHMSA-N 342.870 5.035 30 20 EKED CC[C@H](C)c1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776697994 BXFURCPMUQGJFV-AMGXQNHQSA-N 334.415 5.038 30 20 EKED O=C(O)c1cccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)c1 1777684930 PEAZYVPYNRNFDG-MDZDMXLPSA-N 334.396 5.009 30 20 EKED COc1cc(C(=O)/C=C/c2ccccc2F)ccc1SC(F)F 63874766 DFMLWZRYLOANNT-SOFGYWHQSA-N 338.350 5.045 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)CC1CCCCC1)C(O)=N2 328766960 PRKOVAAQSVRBJR-INIZCTEOSA-N 328.456 5.251 30 20 EKED CC(C)(C)c1cnc(CC/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)o1 328770759 CQEONAQAIKWGIX-ARFHVFGLSA-N 332.488 5.220 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1nccc2ccccc12 340429695 CYITULBYJAWFLQ-DYESRHJHSA-N 329.447 5.321 30 20 EKED Cc1cccc([C@@H]2CCCCN2C(=O)[C@H](C)c2cccc(C#N)c2)c1C 462180462 MGTURVKZQYVLDG-GCJKJVERSA-N 346.474 5.032 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 466874200 VQDAURSGBIPKDR-YOEHRIQHSA-N 339.401 5.361 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccccc1OCC(C)C 485739156 RJRHJYMCADAOSH-UHFFFAOYSA-N 341.476 5.252 30 20 EKED CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 513436831 KCLMRXQCEGOFMJ-DOTOQJQBSA-N 344.524 5.626 30 20 EKED N#Cc1cccc(NC(=O)Nc2cccc(COC3CCCCC3)c2)c1 519168357 XQZRXXQCBFBBHU-UHFFFAOYSA-N 349.434 5.052 30 20 EKED N#Cc1c(Cl)cccc1SCc1cc(-c2cccs2)on1 537846659 KYNBLPQYVDHFCK-UHFFFAOYSA-N 332.837 5.220 30 20 EKED Cc1ccsc1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542929929 HMNYHWWPSHOEOT-HNNXBMFYSA-N 346.455 5.086 30 20 EKED CC(F)(F)c1ccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)cc1 551239908 ACLWJWIXYUNLDP-HXUWFJFHSA-N 340.417 5.227 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1C(F)(F)F 553261869 WRWQHPWJTBJYLO-BFUOFWGJSA-N 344.380 5.305 30 20 EKED C=CCC[C@@H](NCc1ccc(C(=O)OC(C)(C)C)cc1)c1ccco1 578732623 YPDSIVDXUVVUNU-GOSISDBHSA-N 341.451 5.032 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2c(F)cccc2F)cc1Cl 582305534 DMVGWAQARZYVTF-GFCCVEGCSA-N 337.797 5.034 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 726742652 UGDFLDSIBXSNJX-JYRVWZFOSA-N 333.431 5.389 30 20 EKED FC(F)(F)Oc1ccccc1C=NOc1ccccc1C(F)(F)F 754712799 UFBXRNUXTZGPLK-UHFFFAOYSA-N 349.230 5.017 30 20 EKED C[C@@H](CC1(C#N)CCOCC1)Nc1ccc(SC(C)(C)C)cc1 876857445 RMCQVFXLSPVHME-HNNXBMFYSA-N 332.513 5.088 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=S)Nc1ccccc1C#N 915999414 DFDLIIZTOPHYQF-UHFFFAOYSA-N 343.455 5.343 30 20 EKED C#Cc1cccc(NC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)c1 916673333 BDFRMWPJVYJVTC-NRFANRHFSA-N 346.474 5.334 30 20 EKED CCCCCCCC(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 918608000 UQJVYRORJOUILU-SFHVURJKSA-N 326.484 5.234 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1cccc(Cl)c1 918723442 SUUZPZXSNMPNSK-UHFFFAOYSA-N 326.937 5.719 30 20 EKED O=C(O)c1ccccc1NN=Cc1c2ccccc2cc2ccccc12 1776029957 UEZVOZSFYSVSQW-UHFFFAOYSA-N 340.382 5.137 30 20 EKED CCC(=Nn1c2ccccc2c2ccccc21)c1ccc(C(=O)O)cc1 1776113082 WHEWGQMCOWUWKB-UHFFFAOYSA-N 342.398 5.155 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)oc2ccc(Cl)cc12 18119994 JLWRLOQDFQFTEE-UHFFFAOYSA-N 345.185 5.172 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCCC)cc1C 56747451 SOJQKHWMQTWBQB-UHFFFAOYSA-N 344.480 5.065 30 20 EKED CC[C@H](c1ccccc1)c1nnc(SCc2ccc(C#N)cc2C)o1 186274956 NNPICPPXHYQKTJ-GOSISDBHSA-N 349.459 5.084 30 20 EKED CC(C)(CCC#N)CNCC(C)(C)c1ccc(Cl)c(Cl)c1 236816978 CJPSBLGIVBZLMG-UHFFFAOYSA-N 327.299 5.191 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 255112738 GZZDQJYAECZMAX-PINLSGDHSA-N 344.867 5.200 30 20 EKED CC(C)(C)C(O)=Nc1ccc(F)c(/C(O)=N/[C@H]2CC23CCCCC3)c1 329112948 KZMBBAWXMQMGCG-INIZCTEOSA-N 346.446 5.487 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C(C)C)n(C(C)(C)C)n1 410346096 SWFPIJCNFPUUGC-UHFFFAOYSA-N 339.483 5.132 30 20 EKED N#C[C@@H]1CC[C@H](N[C@@H](c2ccccc2)c2ccc3ccccc3c2)C1 442763688 BIESFPUKPHZSET-VSDWSMLSSA-N 326.443 5.211 30 20 EKED C[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 443597052 YRTFTLQIIZABGI-BZUAXINKSA-N 345.512 5.171 30 20 EKED CC[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 447579359 KHAPLQFJDCTCIC-RTWAWAEBSA-N 346.499 5.644 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)c1ccc(CC#N)cc1 462229098 POEJNAXOWLZVMF-UHFFFAOYSA-N 334.806 5.120 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2ccccc2c1C 476133184 FMVYTEAANSCMMF-UHFFFAOYSA-N 344.458 5.647 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 477499548 OKBZIHMMWQWSLI-INIZCTEOSA-N 340.492 5.580 30 20 EKED C=CCCc1ccccc1NC(=O)NCc1nc(C(C)C)c(C)s1 505006819 XAUCDCRYEBVJAS-UHFFFAOYSA-N 343.496 5.015 30 20 EKED CC(C)(C#N)CCCN1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 511079362 FNMDYQXLJWKIQG-INIZCTEOSA-N 338.417 5.215 30 20 EKED C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1F 512646758 CWPJFCNUISMQCG-DJJJIMSYSA-N 328.406 5.274 30 20 EKED CC(C)(CCC#N)CNc1cccc(COc2cccc(F)c2)c1 532888539 KMRNVRMKRUCQEM-UHFFFAOYSA-N 326.415 5.147 30 20 EKED Cc1cc2cc([C@H](C)N[C@@H](CCC#N)c3ccccc3)oc2cc1C 540149566 VTPRHHTZRDXLPQ-PXNSSMCTSA-N 332.447 5.745 30 20 EKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 559865533 RNGRZZZGKWSXCU-PXNSSMCTSA-N 332.447 5.827 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 594010372 KYAAQRPBTZDLCI-KRWDZBQOSA-N 346.474 5.227 30 20 EKED C=CCOc1cccc(NC(=O)[C@@H](C)c2ccccc2C(F)(F)F)c1 607807174 GTRAEVUBIHTYET-ZDUSSCGKSA-N 349.352 5.012 30 20 EKED CCCCc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 608915263 QLBMLQVNKPUOBJ-UHFFFAOYSA-N 349.478 5.343 30 20 EKED CC(C)Sc1ccc(Cl)cc1N[C@@H](C#N)Cc1ccccc1 609221643 OCNCCYMIZVZGBA-MRXNPFEDSA-N 330.884 5.387 30 20 EKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 609824824 ABWRUPMYXDLDMV-GAJHUEQPSA-N 342.442 5.007 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(C)c1 612303431 LYRQZRQWUUVRGT-KXBFYZLASA-N 345.512 5.043 30 20 EKED C=CC[C@@H](NC(=O)CC1CCC(c2ccccc2)CC1)c1ccncc1 734458335 XQYHGQXXUIBXQQ-ZOGYUUGASA-N 348.490 5.179 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccc(Cl)cc1Cl 754712190 FPGDVLDANPJBKJ-UHFFFAOYSA-N 334.124 5.425 30 20 EKED C=C[C@H](CC(=O)Oc1ccccc1Oc1ccccn1)c1ccccc1 759295764 MSIYASUOEYIAOA-QGZVFWFLSA-N 345.398 5.139 30 20 EKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792095041 SSQCGHINQIIABZ-SFHVURJKSA-N 348.833 5.042 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)C1CCC(C(F)(F)F)CC1 839438389 XMOABDGWYAKPNN-UHFFFAOYSA-N 346.352 5.019 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(N2CCCC2)c(F)c1 917557843 XAKDXGSPGHYJBR-UHFFFAOYSA-N 334.394 5.035 30 20 EKED CC/C=C(\C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 918622128 SORCHIIEZOGKLQ-GAVDFCLNSA-N 338.838 5.290 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(O)c(Cl)c1 188061178 ZVZSZFNMADBGCL-UHFFFAOYSA-N 329.827 5.150 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2cccs2)cc1)c1cccc(C#N)c1 190696272 QJAKRMBELVPQHU-AWEZNQCLSA-N 347.443 5.045 30 20 EKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 195635630 BCWWTARXTSTAOZ-GOSISDBHSA-N 349.434 5.147 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnn(C2CCCCC2)c1C 410344156 IQGOIQVEIMSPQE-UHFFFAOYSA-N 337.467 5.068 30 20 EKED CC(C)c1ccc(NC(=O)NCC2CCC(C#N)CC2)c(C(C)C)c1 441305470 HYCNTHYYXBNQSX-UHFFFAOYSA-N 341.499 5.385 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1CC 475558523 KHHKTPHNADOFKR-SFHVURJKSA-N 328.500 5.725 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2ccccc2)CC1 475572996 QVRNNCFTFPZZRB-UHFFFAOYSA-N 334.463 5.349 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1cc(Cl)cc2cccnc12 482937597 XNHJVAWGKHPVSA-UHFFFAOYSA-N 342.870 5.097 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1)c1ccccc1 536171033 ZZUKHYOIGJWUPL-DRSNIGMVSA-N 337.438 5.095 30 20 EKED C=C[C@H](CC(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 536790419 KENFVHRUMQAOEI-CYBMUJFWSA-N 334.246 5.316 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1 536842100 WGTAMCMSPHQEJY-FXAWDEMLSA-N 337.463 5.206 30 20 EKED N#CCc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)cc1 543187956 OEFYYADJSDCFLW-XMMPIXPASA-N 340.470 5.216 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2ccccc2C1 563215973 FGAFASVDJVMHPP-FQEVSTJZSA-N 333.475 5.282 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc3sccc3s2)s1 570624983 KVCIBMSQWCZECE-SECBINFHSA-N 346.502 5.207 30 20 EKED Cc1ccccc1NC(=S)Nc1ccccc1S[C@@H](C)CC#N 731322350 XXVZTUDWXZCONQ-AWEZNQCLSA-N 341.505 5.198 30 20 EKED C#CCCCCC(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 773304582 XHQBLCOARDUKQF-UHFFFAOYSA-N 344.414 5.159 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(C(F)(F)F)s2)c(Cl)c1 788359759 DQWFVZHIBLJSKI-DJWKRKHSSA-N 341.741 5.188 30 20 EKED O=C1/C(=C\c2ccc3ncccc3c2)CSc2ccc(Cl)cc21 797242804 RGGCYLVCBCQYJR-ZROIWOOFSA-N 337.831 5.260 30 20 EKED CCCCCCCC(=O)Nc1ccccc1NC(=O)c1ccccc1 915196199 MKGOTRODPAUQPU-UHFFFAOYSA-N 338.451 5.238 30 20 EKED N#CC1(CSc2nnc(-c3ccc4ccccc4c3)o2)CCCC1 916709086 CYVWSBWYKKLIMU-UHFFFAOYSA-N 335.432 5.066 30 20 EKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)s1 1776784610 PYYLZVINNWTMKF-UHFFFAOYSA-N 325.518 5.409 30 20 EKED CCOc1cc(/C=C\C(=O)c2ccc3ccccc3c2)ccc1OC 34854370 VJIDEBSOALWJTF-WQLSENKSSA-N 332.399 5.143 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(CCCC)cc1 63388689 OQZMAQMQKARSIR-UHFFFAOYSA-N 347.462 5.121 30 20 EKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 163558281 NQNZNPMVMVDYIQ-OAHLLOKOSA-N 348.233 5.160 30 20 EKED N#Cc1cccc(CSc2nnc(-c3cccc4ccccc34)o2)c1 172697217 DZZNQOQWEBFGSE-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C[C@@H](Sc1nnc(-c2ccccc2Cl)o1)c1cccc(C#N)c1 189847048 LUCHWRSZLBCTDI-LLVKDONJSA-N 341.823 5.115 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C#N)cc1 191560466 MTJZARKQTXOUBU-UHFFFAOYSA-N 334.463 5.205 30 20 EKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Cl)cc1Cl 194445726 RXONBCYCONCGAH-OLZOCXBDSA-N 349.261 5.135 30 20 EKED CC(C)[C@@H]1CCCC[C@@H]1/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330026589 LRAUFHYOALIXNM-FOIPXRHGSA-N 334.504 5.083 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340438987 BEMQFORMJPDVHQ-WOJBJXKFSA-N 328.406 5.441 30 20 EKED CO[C@@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 433028461 ZOFZIVQZSIBNEC-PMACEKPBSA-N 342.870 5.052 30 20 EKED C[C@H](SCCCCC(C)(C)C#N)c1nc(-c2ccccc2)no1 435893839 PEOOCACNBKNXSH-AWEZNQCLSA-N 329.469 5.251 30 20 EKED CC(C)(C#N)CC(=O)N(Cc1cccc2ccccc12)C1CCCC1 469163242 YTVLCYRJUSGVMC-UHFFFAOYSA-N 334.463 5.051 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C(C)(C)C)cc2)n1 474441465 NRVRLAAYDOUERL-OAHLLOKOSA-N 326.465 5.054 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(S[C@H](C)CC)cc1C 488380209 ORPLOAXDIONXEC-HZPDHXFCSA-N 332.513 5.458 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2)nnc1-c1ccc(F)cc1 501629344 QNRSBULBFRMORO-CQSZACIVSA-N 339.439 5.124 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 511825626 PMGMIRSZZUJASU-IAGOWNOFSA-N 338.417 5.261 30 20 EKED C=CCn1c(S[C@H](CC)c2ccc(Cl)cc2)nnc1C1CC1 520558880 UOUJFIGBCWOMRL-OAHLLOKOSA-N 333.888 5.238 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NCCCC(C)(C)C#N)cc2)cs1 540354737 TYWZQMSYWWNBQJ-CQSZACIVSA-N 327.497 5.099 30 20 EKED CC(C)Oc1ccc2ccccc2c1CN[C@H](C)c1ccc(C#N)cc1 546649925 VKHIMHAWYZKJHR-QGZVFWFLSA-N 344.458 5.349 30 20 EKED CC(C)c1ccc([C@@H](NC(=O)CC(C)(C)C#N)c2cccs2)cc1 548413113 UUVMEOXKJWURIM-LJQANCHMSA-N 340.492 5.017 30 20 EKED C=CCC(C)(C)C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 556932355 WWUUNCYKLVJAQM-HNNXBMFYSA-N 339.401 5.014 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 560546344 ZTEQWRPLKJGQOT-MAUKXSAKSA-N 348.412 5.767 30 20 EKED N#CCCC[C@H](NC(=O)c1cc2sccc2s1)c1ccccc1 569254577 QQPPOQCWELSBBX-AWEZNQCLSA-N 340.473 5.128 30 20 EKED CCCOc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 582560558 MHEDHSWRLICLNC-PGRDOPGGSA-N 336.479 5.561 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cc(Cl)ccc1SC(C)C 591521909 BPNUAHIKSXRODL-UHFFFAOYSA-N 326.893 5.270 30 20 EKED N#CCCCCN1CCc2sccc2[C@H]1c1ccc(Cl)cc1 595767053 MDSNOORMPQYRAL-GOSISDBHSA-N 330.884 5.043 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)[C@@H]1C[C@H]1c1ccc(Cl)s1 618988274 HOGVWWZPWREMBP-IAOMBJDPSA-N 342.895 5.042 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(O)c(Cl)c1 632751600 OZIZAIUBLKUDCM-UHFFFAOYSA-N 343.854 5.079 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(Cl)nc1 727078975 RFIXVHFIJJQMKH-UHFFFAOYSA-N 327.925 5.114 30 20 EKED C#Cc1cccc(N(C(=O)c2cc3cc(Cl)ccc3o2)C(C)C)c1 728247438 DKYQTHUQKZXPBV-UHFFFAOYSA-N 337.806 5.123 30 20 EKED CCCCCCOc1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1 743495344 CVTFHPYLNDBXKZ-GOSISDBHSA-N 336.479 5.368 30 20 EKED Cc1cc2cc(C(=O)/C=C/c3ccc(O[C@H](C)C#N)cc3)oc2cc1C 749132655 PUIXFUFOPWAGRK-YXMGTMDOSA-N 345.398 5.237 30 20 EKED C[C@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 755612809 XIAPDAXYMQFTRT-ZBFHGGJFSA-N 340.492 5.449 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cccc(F)c3F)s2)cc1 776269001 ZAZLKODWOIBBTJ-KTKRTIGZSA-N 341.382 5.293 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)nc1)c1cc2ccccc2s1 780187722 FGDZXQMKISQOHF-ZHACJKMWSA-N 342.423 5.254 30 20 EKED CC(=NNc1nccc2sccc12)c1cc(Cl)sc1Cl 915979077 CVDZIJKVYZEIGX-UHFFFAOYSA-N 342.276 5.501 30 20 EKED Cc1nc(CN[C@H](CCCC#N)c2ccccc2)sc1C(C)(C)C 930570106 PTWDECOFDMIUME-QGZVFWFLSA-N 341.524 5.274 30 20 EKED O=C(O)c1ccc(NN=Cc2ccc(C3CCCCC3)cc2)cc1F 1776077061 STEKSQAYZRBLJJ-UHFFFAOYSA-N 340.398 5.018 30 20 EKED COc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1F 26764807 SETTWSYJBWHDQE-DUXPYHPUSA-N 331.195 5.099 30 20 EKED C[C@H](CC#N)N(C)C(=O)Nc1cccc(CSC2CCCCC2)c1 120480037 WTDPMJJNFCXJHB-OAHLLOKOSA-N 345.512 5.018 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CCCCCc2cccs2)n1 177769305 MRJNWSPOEJETQQ-OAHLLOKOSA-N 346.521 5.307 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1cccs1 189885808 NDKBFZGNFIDSNM-UHFFFAOYSA-N 341.476 5.202 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cc(Cl)cs1 189894700 LOFZPHQWQXCEQV-UHFFFAOYSA-N 347.911 5.825 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1c(F)cccc1F 189913278 ATGPNCPRTGHSMZ-AWEZNQCLSA-N 343.417 5.559 30 20 EKED N#CCCCOc1cccc(CN[C@@H](CC2CCC2)c2ccccc2)c1 350292828 ZRMGWUREVCKXLS-QHCPKHFHSA-N 348.490 5.390 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CC(C)(C)c3ccccc32)cc1 431526402 TUTYTWLTIRLWJZ-LJQANCHMSA-N 347.462 5.032 30 20 EKED CC[C@@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 447581425 UKGVBKUMQFZNMO-DNVCBOLYSA-N 347.487 5.484 30 20 EKED C[C@H](C(=O)N(Cc1ccccc1)C1CCCCC1)c1cccc(C#N)c1 463461352 NMAKLMBQCLPWTE-SFHVURJKSA-N 346.474 5.023 30 20 EKED CCCC1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCC1 467576736 GANOFIWVXYEXSS-HNNXBMFYSA-N 345.512 5.030 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 488846856 VRQKWSOXKUULRR-NRFANRHFSA-N 344.414 5.172 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NC(=O)c1cccc(C#N)c1 500741853 HLNZGBRQTZHPED-UHFFFAOYSA-N 344.439 5.270 30 20 EKED CC(C)(C)c1cc(NC(=O)c2cc3cc(F)ccc3o2)c(C#N)s1 538073618 GPRITDPYFJBLCA-UHFFFAOYSA-N 342.395 5.055 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)nc1 558238189 NZLFZYAQFSLNTI-HXUWFJFHSA-N 339.870 5.018 30 20 EKED N#Cc1cc(CN[C@@H](CCc2ccccc2)c2ccccc2)ccc1F 561111261 MYIBEKSFSFMETA-QHCPKHFHSA-N 344.433 5.161 30 20 EKED CCCN(C(=O)CCCCCC#N)[C@@H](C)c1cc2ccccc2o1 588305620 ZAVJGQOUSWHBLC-INIZCTEOSA-N 326.440 5.206 30 20 EKED N#C[C@H]1CCC[C@@H](NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 618577741 CYFGQSBOMHJEFA-WCQYABFASA-N 342.792 5.020 30 20 EKED C=CCN(Cc1cc(-c2ccccc2)on1)Cc1ccc(Cl)s1 674865106 CKKVOPCYXCGILJ-UHFFFAOYSA-N 344.867 5.245 30 20 EKED Cc1ccccc1[C@@H](OC(=O)c1cccc(CC#N)c1)c1cccs1 748505797 SQPFKXSVZSZZIC-HXUWFJFHSA-N 347.439 5.069 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1csc2ccccc12 775384236 DPVQKVCLUJXEAN-JLTOFOAXSA-N 332.472 5.501 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1cccc(OC)c1 789719534 SAJSMWFUWZXQOG-SAPNQHFASA-N 349.474 5.589 30 20 EKED CCCCCCC[C@H](C)NC1CC(N2CCC(C(F)(F)F)CC2)C1 793233326 RMNUANGXLCECHR-ZLPCBKJTSA-N 348.497 5.130 30 20 EKED CCCC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 800385834 FODZHXNSVBTGJV-SWLSCSKDSA-N 346.883 5.466 30 20 EKED CC[C@](C)(NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 838354867 CNBHBXFRNNNXIU-IRLDBZIGSA-N 349.478 5.046 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)n1 860581417 LKGHCGGNXXWMAU-BRWVUGGUSA-N 338.476 5.027 30 20 EKED O=C(O)c1ccc2scc(/C=C/C(=O)c3csc(Cl)c3)c2c1 1777683932 DBIMZNQISSBYIY-HNQUOIGGSA-N 348.832 5.211 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2nc(-c3ccccc3)cs2)cc1 26040181 MPMROWANRKCDOL-KRWDZBQOSA-N 336.485 5.346 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(F)cc1Cl 60451323 WCSVMWSWLVTPGK-UHFFFAOYSA-N 344.238 5.022 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(Cl)cc1 63274778 JWCHILNEEHMWGK-AATRIKPKSA-N 331.849 5.421 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cc(F)ccc1F 108407510 BVQHZOYRXQHCPB-OLZOCXBDSA-N 332.419 5.390 30 20 EKED Cc1cccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1Cl 118980480 SQTBBZVWUCCOIP-CYBMUJFWSA-N 344.867 5.295 30 20 EKED C=CCC[C@H](NCc1nc2ccccc2n1C(F)F)c1ccccc1 180035301 POHQSFZYSHVYQD-INIZCTEOSA-N 341.405 5.229 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1cccs1 191454019 AIOPFKNMSCCAGW-UHFFFAOYSA-N 342.508 5.654 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2)nnc1-c1ccccc1F 195568981 YXFCGFZFNCMBCL-AWEZNQCLSA-N 339.439 5.124 30 20 EKED N#Cc1csc(CN[C@H](CCc2ccccc2)c2ccccc2)c1 237850214 JMJYUSWTQNOZGB-OAQYLSRUSA-N 332.472 5.083 30 20 EKED Cc1c(Cl)cccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 329982820 ARGGNXDDUSAJQQ-UHFFFAOYSA-N 334.847 5.162 30 20 EKED C[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)c(F)c1 426305821 DRYCDNFCBDYANR-BONVTDFDSA-N 334.847 5.140 30 20 EKED CC[C@@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(C#N)cc1 447583589 CAIVYRZVBFWSMC-MOPGFXCFSA-N 338.426 5.040 30 20 EKED N#Cc1cccc(Cl)c1NCc1nc2cc(Cl)ccc2s1 462373376 OMQLHGSQHDIJRI-UHFFFAOYSA-N 334.231 5.087 30 20 EKED Cc1cccc([C@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)c1C 476167589 SRIIYECMCYHHIQ-RBBKRZOGSA-N 346.474 5.055 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2cc(C#N)cs2)o1 477904084 UGPZILBYMWEYML-UHFFFAOYSA-N 342.807 5.094 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cc(F)c(F)c(F)c1)c1ccc(F)c(F)c1 480667172 FXTZRYFKQJFATF-YPMLDQLKSA-N 341.323 5.350 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)c1cccc(C#N)c1C 509962905 HLYCDDMGGSBBCJ-UHFFFAOYSA-N 338.476 5.069 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)cn1)c1ccc(-c2cccc(C#N)c2)cc1 543961579 XWIYARNOPIOLSO-HZPDHXFCSA-N 345.421 5.171 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1coc2ccc(C(C)C)cc12 558156362 GYCWPLHOAXODJE-UHFFFAOYSA-N 326.440 5.101 30 20 EKED CCC[C@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208821 HQMYAILAELVBBS-HNNXBMFYSA-N 337.423 5.003 30 20 EKED C[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 611773868 CBEDNBLZJLLQJM-KRWDZBQOSA-N 341.414 5.167 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2ccccc2C(F)(F)F)cc1 619775736 PQDDXLOBXKGPMA-AWEZNQCLSA-N 335.369 5.121 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1cc(Cl)sc1Cl 760261376 APFTZHQTCMDDTB-PLNGDYQASA-N 344.288 5.675 30 20 EKED C#C[C@@H](C)N(C)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 770566160 XIZYNKXYUMJOQC-CVEARBPZSA-N 338.476 5.025 30 20 EKED C/C(=C\C(C)(C)C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 773984989 XUFHPXYEPPSSGO-ZJNQMXKESA-N 332.856 5.118 30 20 EKED C(=NNCc1cccc2cccnc12)c1ccccc1-c1ccccc1 917548268 LYKYUFQCXNJZSA-UHFFFAOYSA-N 337.426 5.026 30 20 EKED CCCCCC[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 78572900 OCHDTZAYKCULIT-CVEARBPZSA-N 347.528 5.419 30 20 EKED CCCC[C@@H](CC)CNC(=O)Nc1ccccc1SC[C@H](C)C#N 78573350 PBVWNJIQLSTJMX-HZPDHXFCSA-N 347.528 5.276 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cccc1Cl 132256697 QVZULMZLAXDAGE-UHFFFAOYSA-N 332.806 5.008 30 20 EKED C=C(C)[C@@H](NCc1csc(-c2ccoc2)n1)c1ccc(F)c(F)c1 187777028 FYOOCEXNCPGPCN-QGZVFWFLSA-N 346.402 5.088 30 20 EKED Cc1cc(/C=C\C(=O)c2cccs2)cc(C)c1OCc1ccccn1 207254519 TUMLPHWNDRCOPB-HJWRWDBZSA-N 349.455 5.235 30 20 EKED N=C(O)[C@@H]1CCC[C@H](C(O)=Nc2ncc(C3CCCCC3)s2)C1 329971551 XSFQDAGUYHOMLD-OLZOCXBDSA-N 335.473 5.120 30 20 EKED N#CCCC[C@@H](NCc1cscc1C(F)(F)F)c1ccccc1 353902976 UKNQHJQZTNBZHE-MRXNPFEDSA-N 338.398 5.292 30 20 EKED CC[C@H](N[C@H](CCCCOC)c1ccccc1)c1ccc(C#N)cc1 359018366 MRPUJKVLTQXBBO-FCHUYYIVSA-N 336.479 5.157 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 390967960 NUAMXZBEBNSHGL-ZDUSSCGKSA-N 349.261 5.849 30 20 EKED CC(C)(C#N)CCCC[S@](=O)c1ccc(-c2ccccc2)cc1 414283433 FMYAIYPZGIULRQ-QHCPKHFHSA-N 325.477 5.181 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CCC(C)(C)CC1 438049821 QXCXXMRSXHFPNV-AWEZNQCLSA-N 345.512 5.029 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 459595950 SCEOTPUJWYDMFI-KRWDZBQOSA-N 344.890 5.073 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2cc(Cl)cc(Cl)c2[C@H]1C 466414039 GLQJGATXPUDGLE-VXGBXAGGSA-N 326.267 5.041 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2sccc2c1 476121823 OSMYEVLKERUXBS-UHFFFAOYSA-N 335.472 6.006 30 20 EKED C[C@H](Sc1c(C#N)cccc1C#N)c1cccc(Br)c1 488744184 JTIHTRSPEGAXSN-NSHDSACASA-N 343.249 5.046 30 20 EKED Cc1c([C@H](C)Nc2nc(C(F)(F)F)ccc2C#N)oc2ccccc12 519566539 ZLWMKOAMDIKPLN-NSHDSACASA-N 345.324 5.200 30 20 EKED Cc1cccc(COc2cccc(NCc3ccc(C#N)cc3)c2)c1 520361906 MFBHVGZEGUHEFX-UHFFFAOYSA-N 328.415 5.058 30 20 EKED COc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1Cl 536837973 IFLHOIQBSNGGPV-RDTXWAMCSA-N 328.843 5.044 30 20 EKED CC(C)[C@@H]1C[C@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542948398 UPTMCCHHLHCICS-IMRHEYAYSA-N 348.490 5.079 30 20 EKED CCc1ccc(-c2nc(CN[C@H](C)c3ccc(C#N)cc3)cs2)cc1 548930569 FHPZPEUHZOWGON-OAHLLOKOSA-N 347.487 5.095 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Cl)sc1Cl 618807387 UHVOCYPIEHRRFQ-LKFCYVNXSA-N 337.275 5.265 30 20 EKED CC(=NNCc1cccc2cccnc12)c1cccc(Cl)c1Cl 734981058 XYQXJNPRZKZMRB-UHFFFAOYSA-N 344.245 5.055 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2cccc(Cl)c2Cl)s1 736434489 UIFRKDPKLLEIJG-BQYQJAHWSA-N 340.275 5.644 30 20 EKED C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 743059768 QKHFNMOIYVVKKD-MRXNPFEDSA-N 341.414 5.108 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1coc2ccccc12 747706330 UPQPZKKJYQVYJA-WAYWQWQTSA-N 337.425 5.514 30 20 EKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2ccc(F)c(F)c2)ccc1OC 749453119 RDHVJVRGTLIFOL-OMDQHUAHSA-N 346.373 5.047 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccccc1 773104638 FMJBLVHRJMKPBX-MBSDFSHPSA-N 326.443 5.164 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc2cccc(OCC)c2o1)c1ccccc1 776170279 IZFVBUXJULXWAU-VQIMIIECSA-N 333.431 5.247 30 20 EKED CC1=C(C)C[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)CC1 842688362 FONAGVXQXLMEKS-DLBZAZTESA-N 336.460 5.123 30 20 EKED CC(C)c1ccccc1NC(=O)[C@H](C)SCC1CCC(C#N)CC1 902566938 IKNIQSHYRKTTOE-GTPINHCMSA-N 344.524 5.200 30 20 EKED CCC[C@@H](N[C@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902786755 SJQSACAFLHWKLQ-CXAGYDPISA-N 347.384 5.164 30 20 EKED CCCOc1cc(/C=C\C(=O)c2cc3ccccc3o2)ccc1OC 916138504 SONPAIQBWVTKHA-NTMALXAHSA-N 336.387 5.126 30 20 EKED Cc1ccc(SCC(=O)c2cn(CCC#N)c3ccccc23)cc1C 5972351 GJSHNUYJUFHDBD-UHFFFAOYSA-N 348.471 5.147 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 410345889 SWTZAOREOHGXJI-UHFFFAOYSA-N 347.380 5.552 30 20 EKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(C)cc1Cl 430614407 ZADJVFNKJWPGCC-CYBMUJFWSA-N 346.883 5.201 30 20 EKED Cc1cc(C)cc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431925657 KYUOXAYPFMEUKO-NQIIRXRSSA-N 349.478 5.099 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)N(C)[C@H](C)CC#N)c1 435180278 DKPRHGLDHNZJEH-CQSZACIVSA-N 341.842 5.081 30 20 EKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCCCC1 438047778 DVUIBUFXUVADMS-CABCVRRESA-N 345.512 5.171 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2ccoc2c1 443384973 LNWXKOWZQVSABS-UHFFFAOYSA-N 346.839 5.368 30 20 EKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cc2ccccc2s1 475758274 XLKMZHCXXHUMNX-DOTOQJQBSA-N 348.471 5.166 30 20 EKED C[C@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)c1cccc(C#N)c1 487994645 QBYXEEMWPFYNIY-SJORKVTESA-N 343.430 5.157 30 20 EKED Cc1ccccc1NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 503224679 JSJDIOIASBAALM-UHFFFAOYSA-N 343.386 5.303 30 20 EKED CC(C)c1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)c(C(C)C)c1 513915836 XWULOZRXAGIKPT-HNNXBMFYSA-N 327.472 5.089 30 20 EKED Cc1c(F)cccc1NC(=O)c1ccccc1Oc1ccccc1C#N 539761649 PNZCFSIRJFMBEY-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1 540150301 HOHWKHFUYVRCMG-XMSQKQJNSA-N 331.463 5.230 30 20 EKED Cc1nnc(S[C@@H](C)c2ccc(Cl)c(Cl)c2)c(C#N)c1C 553403109 ZBFDEGYOMLECOU-JTQLQIEISA-N 338.263 5.125 30 20 EKED N#CCCC[C@@H](NCc1ccc(Cl)cc1Cl)c1ccccc1 560565632 WPINHRIAUUNTIO-GOSISDBHSA-N 333.262 5.518 30 20 EKED Cc1cccc2sc(C(=O)N[C@@]3(C#N)CCC[C@@H](C)C3)c(Cl)c12 609736983 VMCBAMDENYGRFP-ZMZPIMSZSA-N 346.883 5.065 30 20 EKED CCc1oc2ccccc2c1C=NOCc1coc(-c2ccccc2)n1 727490455 LNYZBOOAKPLLJT-UHFFFAOYSA-N 346.386 5.201 30 20 EKED COc1ccc2oc(C(=O)/C=C\c3ccc4ncccc4c3)c(C)c2c1 729151951 ZBJXVXNYEKTWQL-TWGQIWQCSA-N 343.382 5.194 30 20 EKED CCCCCCCCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730421958 ROYJLWRNVZNGDV-AWEZNQCLSA-N 332.444 5.362 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1cccc(-c2ccncc2)c1 741472305 HDSOQAWKFNZUNM-GQCTYLIASA-N 335.790 5.004 30 20 EKED CCCCCC[C@@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 741925406 PRXVJSUGTUIJDW-HZPDHXFCSA-N 332.513 5.483 30 20 EKED C[C@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772960042 QEVLLJBXWGFOFR-UONOGXRCSA-N 348.368 5.020 30 20 EKED CC(C)(C)c1ccc(NN=Cc2c(C3CC3)nc3sccn23)cc1 779824917 JNVAJHQCVLONSL-UHFFFAOYSA-N 338.480 5.017 30 20 EKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2c(Cl)cccc21 788352739 BTSQXIYICVGOOO-SOFGYWHQSA-N 343.757 5.028 30 20 EKED CC(C)(CCC#N)COC(=O)CC(c1ccccc1)c1ccccc1 798878680 MYFFJJQUWUBPKH-UHFFFAOYSA-N 335.447 5.082 30 20 EKED C=C(C)[C@@H](NCc1ccc(Cl)nc1Cl)c1ccc(F)c(F)c1 801544811 VEILUOHCJXWIOB-OAHLLOKOSA-N 343.204 5.074 30 20 EKED Cc1ccc(-c2ccc(/C=C\C(=O)c3ccc(OCC#N)cc3)o2)cc1 915985171 QQXXGAOCGQYCKO-BENRWUELSA-N 343.382 5.054 30 20 EKED O=C(/C=C/c1cccc2c1OCCCO2)c1ccc(Cl)cc1Cl 917143098 BETXLLZPQLAIED-VMPITWQZSA-N 349.213 5.051 30 20 EKED CCC[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 59281314 ULHNSKXFKVWCHV-KBXCAEBGSA-N 340.854 5.370 30 20 EKED Cc1cc(C)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 432483406 ANBIKMFPTIUXHG-LJQANCHMSA-N 335.451 5.169 30 20 EKED Cc1oc(-c2ccccc2)nc1CN[C@H](CCCC#N)c1ccccc1 433023843 UDFXOJPQGPRJSE-HXUWFJFHSA-N 345.446 5.175 30 20 EKED C[C@H](SCCCCC(C)(C)C#N)c1nc(-c2cccs2)no1 435886109 SEOPPGIFEAIYLA-LBPRGKRZSA-N 335.498 5.312 30 20 EKED C[C@@H](Sc1nnc(-c2cccc(Cl)c2)o1)c1cccc(C#N)c1 442915134 VVXDIAMWIYHQHI-LLVKDONJSA-N 341.823 5.115 30 20 EKED C[C@H](Sc1cccc(C#N)c1)c1nc(-c2ccc(Cl)cc2)no1 468653128 MKUGTLBGNGHRPU-NSHDSACASA-N 341.823 5.115 30 20 EKED Cc1ccc([C@@H]2CCCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1 476120973 MXOWWLZEJWAZJA-VXKWHMMOSA-N 346.474 5.136 30 20 EKED C=CC[C@H](C)[C@@H](C)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 543113705 ZSOBNNGOGIYYMT-JKSUJKDBSA-N 340.442 5.020 30 20 EKED Cc1ccc([C@H](NCc2ccc(CC#N)cc2)c2ccccc2)c(C)c1 570004309 XWVBEFBKYBOCDQ-XMMPIXPASA-N 340.470 5.249 30 20 EKED C[C@@H]1CCN(C(=O)CCCCCC#N)c2cc(Cl)ccc2S1 588887626 MBVDTOYFAAFDPU-CYBMUJFWSA-N 336.888 5.031 30 20 EKED CC[C@H](NCc1ccc(C#N)cc1F)c1ccc2cc(OC)ccc2c1 610812795 RJXUSDCKZGUBSA-QFIPXVFZSA-N 348.421 5.100 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1Oc1cccnc1 669675488 VBVGKDLIFRXTCB-UHFFFAOYSA-N 344.414 5.245 30 20 EKED N#Cc1c(Cl)nsc1N[C@@H]1CCc2c1ccc(Cl)c2Cl 733302373 QUBRVTJWPFNBQL-SNVBAGLBSA-N 344.654 5.074 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1nc(-c2ccccc2)cs1 740765509 DQMUTPCMIYIZJM-ZHACJKMWSA-N 342.423 5.254 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc4c(c3)COC4)cs2)cc1 742437867 YKVNTLXOJNFVQL-CMDGGOBGSA-N 347.439 5.045 30 20 EKED CCCCCCCCCN(C)C(=O)c1csc(-c2ccccn2)n1 747213962 JMZHSQBBLLJAAV-UHFFFAOYSA-N 345.512 5.028 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)Nc1ccc(F)cc1OCC#N 760785435 ANCBWKNBXJKHNT-LJQANCHMSA-N 334.435 5.053 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1cc(Cl)sc1Cl 772795628 CMQQGYKFIUKZAU-AATRIKPKSA-N 334.227 5.499 30 20 EKED C=CCC[C@@H](NCc1cc(=O)oc2cc(CC)ccc12)c1ccccc1 775463108 IHHPIUHJOOKQLT-OAQYLSRUSA-N 347.458 5.153 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3C=CCCC3)n2)cc1 778607170 SHEQHZSGFXXCDP-NVXWUHKLSA-N 336.460 5.041 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)c(Cl)c1 779712324 FERCNWWADANMGJ-NEPJUHHUSA-N 335.234 5.457 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccnc(Cl)c3)s2)cc1 782192899 CGWUAVXKVZONON-SREVYHEPSA-N 340.835 5.063 30 20 EKED C=CCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCC1 790291632 DQDIMTAGVHZWJN-FQEVSTJZSA-N 330.431 5.027 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(F)cc1C(F)(F)F)c1ccncc1 858365922 VBWWMQYGBBXGAE-SJCJKPOMSA-N 338.348 5.208 30 20 EKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccc(CC#N)cc2)c1 118009892 OPYIFFWOMBWWPL-OAQYLSRUSA-N 347.462 5.210 30 20 EKED CC(C)c1nccn1Cc1cccc(N[C@H](C)c2cccc(C#N)c2)c1 179925125 GPWPPMVRUXMLEN-QGZVFWFLSA-N 344.462 5.100 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ncc(C(C)(C)C)o1)c1ccc(F)c(F)c1 187777517 ZSIPBFJWCCCNMJ-SJKOYZFVSA-N 334.410 5.218 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCc1cccs1 264508514 STZOTEBUIILFAC-CQSZACIVSA-N 344.505 5.104 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)[S@](=O)CCCCC(C)(C)C#N 278365149 XIDVVKAWWRHDFO-LAJNKCICSA-N 346.323 5.523 30 20 EKED C=CCCc1ccccc1NC(=O)CCc1c[nH]c2ccc(C)cc12 410382117 YRAHCEONVRYIOZ-UHFFFAOYSA-N 332.447 5.166 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 461355624 VJFQRAATAKMWIX-SFHVURJKSA-N 328.799 5.011 30 20 EKED C=CCCC1(C(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)CC1 475105372 BXLLIZYQAPAEBB-HNNXBMFYSA-N 340.492 5.042 30 20 EKED CN(CC1CCCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 477715318 XNUCDWLIYYTXQS-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(C)CCCCCC1 511028977 OBIJBYUQBGTRNA-HNNXBMFYSA-N 330.497 5.237 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1C(F)(F)F 512619964 NUPSOSCTYLFWGP-NWDGAFQWSA-N 336.332 5.128 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)Nc3ccccc3F)c2)cc1 517080623 NRTCDJLHWTYMNW-UHFFFAOYSA-N 347.349 5.134 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCC1CCCCC1 518139899 CWMZCOWZZBAIRL-HNNXBMFYSA-N 330.497 5.237 30 20 EKED C=C[C@H](CC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F)c1ccccc1 533937480 ZSWVZLCTHZCLIX-FVJLSDCUSA-N 337.438 5.095 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 537408064 UKAPZCXLCACXST-GJZGRUSLSA-N 342.483 5.610 30 20 EKED C[C@@H](NC1CC(c2ccc(C(F)(F)F)cc2)C1)c1ccc(C#N)cc1 544041410 LGFVVQVBPSJLQF-UYCDIGJJSA-N 344.380 5.174 30 20 EKED N#CCCCCCC(=O)N(Cc1ccccc1)c1ccc(Cl)cc1 588885272 NSSVGPMXGAGPQQ-UHFFFAOYSA-N 340.854 5.347 30 20 EKED COc1cc(N[C@H](C)c2cccc(C#N)c2)c(C2CC2)cc1Cl 600852694 UCRZJUYHSXGIJJ-GFCCVEGCSA-N 326.827 5.271 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)Cc1cc(Cl)ccc1OCC#N 735311086 JMFNPGKQANSHNF-HXUWFJFHSA-N 342.870 5.071 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1ccc3ncccc3c1)C2=O 748146263 HAZYUSHJAVXKRL-ATVHPVEESA-N 331.440 5.169 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(N2CCCCCC2)cc1)c1ccncc1 766022880 YKHBHATWWWAYSO-WMZHIEFXSA-N 349.522 5.430 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1csc2ccccc12 775666373 JYKPKPYOGJKWOW-GFCCVEGCSA-N 326.852 5.277 30 20 EKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 805877015 BDTQYLYNSXIMGO-ZDUSSCGKSA-N 332.444 5.218 30 20 EKED N#Cc1ccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)cc1 853289721 PHRONTGTRLRMRH-UHFFFAOYSA-N 337.267 5.011 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(F)cc1F 918723402 QYFKHIVWXXWZDC-UHFFFAOYSA-N 328.472 5.344 30 20 EKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)c(C)c1Cl 1777436225 WZGKBLMMERGSEY-SOFGYWHQSA-N 349.213 5.205 30 20 EKED N#C[C@H](Sc1nn(-c2ccccc2)c(=S)s1)C1CCCCC1 115185334 FCFJUQYVHRCVMK-AWEZNQCLSA-N 347.534 5.228 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccccc1OC(F)F 172907488 NSCSCDOVXILTMN-CYBMUJFWSA-N 348.418 5.294 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nc(C)ccc2c1 189872929 RJXRPOGLYZUXDS-UHFFFAOYSA-N 344.458 5.647 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2CCCC[C@H]2C1 191508293 IWJNALBXOVVPNF-HDICACEKSA-N 326.484 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)(C)C)on1 276408821 FLUCTNOBACQLOS-UHFFFAOYSA-N 326.440 5.076 30 20 EKED Cc1nc(SCc2ccc(F)cc2C#N)n(C2CCCCC2)c1C 303226259 WWGXZFYDOVOURB-UHFFFAOYSA-N 343.471 5.308 30 20 EKED CC1(/C(O)=N/[C@H]2CC[C@H](/N=C(/O)C3(C)CCCC3)CC2)CCCC1 328753474 RYCRZVTXBKSWEN-WKILWMFISA-N 334.504 5.371 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2C(C)(C)C)n1 434390451 LOKBPXMYAQRLBL-CQSZACIVSA-N 326.465 5.054 30 20 EKED C=CC[C@H]1N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCCC1(C)C 444858833 LJPHXMBYSCINEG-GOSISDBHSA-N 339.483 5.086 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 449341875 XCYSEQILLOTSFF-IAGOWNOFSA-N 344.380 5.116 30 20 EKED N#Cc1ccc(NC(=O)c2cscc2-c2ccccc2)c(Cl)c1 464135531 MMXSVOUVMQVEOM-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C(C)(C)C1 475553651 ZKFXWWKUKXVBIY-MRXNPFEDSA-N 328.500 5.438 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](CC(C)C)C1 475579094 SXCKANOIBFSAOQ-QGZVFWFLSA-N 328.500 5.438 30 20 EKED CCC(CC)c1cc(CN[C@H]2CCCCc3cc(C#N)ccc32)on1 481671976 QXUPBOFNUZUELG-FQEVSTJZSA-N 337.467 5.007 30 20 EKED C[C@@H]1CCCC[C@H]1N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482605776 OBFGLNNKUWRORM-IIBYNOLFSA-N 348.446 5.001 30 20 EKED N#CC1(c2ccccc2)CCC(NC[C@@H]2CCCCC(F)(F)C2)CC1 495021572 ZAZRFSVHJVSCDR-QHGAOEGBSA-N 346.465 5.196 30 20 EKED C[C@@H](NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 503350056 VHFQBRRLFCZJGP-UZLBHIALSA-N 349.478 5.096 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 509820830 RMZGLTKGFIRVSS-SFHVURJKSA-N 328.799 5.011 30 20 EKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 540509471 OJXGKIZBOXWGLG-NRFANRHFSA-N 343.511 5.237 30 20 EKED CC(C)[C@H]1C[C@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542948399 UPTMCCHHLHCICS-JJEOQYAHSA-N 348.490 5.079 30 20 EKED COc1cccc2cc([C@H](C)NC3(c4ccc(C#N)cc4)CCC3)oc12 594520028 XZXUTANVCUWUFP-HNNXBMFYSA-N 346.430 5.043 30 20 EKED C[C@@H](SCc1csc(-c2cccs2)n1)c1ccc(C#N)cc1 609825472 ZSVZDAXJGSORMV-GFCCVEGCSA-N 342.514 5.738 30 20 EKED Cc1cc2cc([C@@H](C)N[C@H]3CCc4cc(C#N)ccc43)oc2cc1C 618803028 GMSPYKQPGTXYHY-QRWLVFNGSA-N 330.431 5.259 30 20 EKED CC(C)(CCC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 754522752 ADTCITOYJAELKV-INIZCTEOSA-N 348.471 5.231 30 20 EKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1occc1C 767788689 PMJQVQZRTWYRLF-UHFFFAOYSA-N 339.342 5.053 30 20 EKED Cc1ccc(NC(=O)OC(C)(C)C)c(OCCCC(C)(C)C#N)c1 771182008 LNKIHVJGGRXYDQ-UHFFFAOYSA-N 332.444 5.051 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(F)c(Br)c1)c1ccccc1 773113876 GIQGKZUFNBJKPM-SCLBCKFNSA-N 346.243 5.003 30 20 EKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 776086439 GUNCBXLXKPPQKB-JSGCOSHPSA-N 332.444 5.218 30 20 EKED N#C[C@@H](C(=O)c1cc2ccccc2o1)c1nc(-c2ccccc2)cs1 41536410 WTAISOJXXSNOBJ-HNNXBMFYSA-N 344.395 5.046 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1 60842997 UPHPYBPMFWEYAJ-FQEVSTJZSA-N 327.855 5.146 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(N2CCCCC2)cc1 90665259 YKAKEPSVVCSGCL-CVDCTZTESA-N 347.506 5.373 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(OC)cc1 189868020 RDCZYRUKXZCESD-UHFFFAOYSA-N 337.463 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CCSCC 191430543 OIYCSBBLLKVKLT-MRXNPFEDSA-N 348.556 5.534 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1C(F)(F)F 292456485 WMXLYMKZTYLMHF-UHFFFAOYSA-N 337.341 5.403 30 20 EKED N#Cc1ccc(NCc2ccc(C(F)F)cc2)cc1C(F)(F)F 301789996 YNISQSQYAQBXTB-UHFFFAOYSA-N 326.268 5.127 30 20 EKED CC(C)c1ccsc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430636634 YYVHHVZHRDKAEK-LBPRGKRZSA-N 332.494 5.116 30 20 EKED Cc1cc(C)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c(C)c1 431395234 AWMGUDHORDRGOB-UHFFFAOYSA-N 334.444 5.259 30 20 EKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)C[C@H](CC#N)c1ccccc1 475908030 VNOBVJZGJIPKHT-NZQKXSOJSA-N 348.490 5.238 30 20 EKED N#CCc1ccc(NC(=O)N2CCC[C@H]2CCC2CCCCC2)cc1 495113334 YLGWLDUHQYHIJT-FQEVSTJZSA-N 339.483 5.109 30 20 EKED C[C@@H](N[C@H]1CCc2c(Cl)cc(Cl)cc21)c1ccc(C#N)cc1 507841899 PXNUEFNJUXICBS-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED N#CC1(C(=O)Nc2ccc(SC3CCCC3)cc2)CCCCC1 512963063 ZJEZDRSYRNVLSK-UHFFFAOYSA-N 328.481 5.134 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2F)s1)c1ccc(C#N)cc1 520962101 PPRRTNIGVQJBRH-CQSZACIVSA-N 336.435 5.277 30 20 EKED CC(C)(C#N)c1ccccc1CSCc1csc(C2CC2)n1 534684000 UYOIJNISNJUPCB-UHFFFAOYSA-N 328.506 5.255 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(CC#N)cc1 542526050 PCKWKJQDLNYGOL-OAQYLSRUSA-N 346.499 5.196 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 553305228 KIOMBQXVPVVNGU-BFUOFWGJSA-N 344.380 5.305 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)c(F)c1 553770836 WAZWHYIRQQBTTL-QRQCRPRQSA-N 348.396 5.277 30 20 EKED N#Cc1ccc(CNC2(c3ccc(Cl)cc3)CCC2)c(Cl)c1 560206521 PHKMPAIKJUEGDS-UHFFFAOYSA-N 331.246 5.034 30 20 EKED CC1(C)CN(Cc2cccc(OCCCC#N)c2)[C@H]1c1cccs1 569968464 GOCYRZJFJTVMJE-IBGZPJMESA-N 340.492 5.014 30 20 EKED C[C@@H]1CCCCN1Cc1ccc(N[C@H]2CCc3ccc(C#N)cc32)cc1 571333804 KPJKFDXPGIINKR-HXOBKFHXSA-N 345.490 5.032 30 20 EKED Cc1nc(C)c(C#N)c(S[C@@H](C)c2ccc(Cl)cc2Cl)n1 603946855 REYOZEXJHDUUDH-VIFPVBQESA-N 338.263 5.125 30 20 EKED Cc1ccc(C)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609175945 QHTUYVBXKHKKLV-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C=C(C)CNC(=S)N(Cc1cccc2ccccc12)C1CCCC1 727979123 HNAHUQBZQSGENX-UHFFFAOYSA-N 338.520 5.035 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCC(C)(C)C)n2)cc1 739156326 NQANPVBKTPRQFW-HNNXBMFYSA-N 326.465 5.121 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cc(Cl)sc1Cl 740764910 KGOGREFZYRMPAZ-WAYWQWQTSA-N 334.227 5.499 30 20 EKED CC[C@H](C)C[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743094833 CMPBYUJFSGKGEE-XGHQBKJUSA-N 349.478 5.288 30 20 EKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2ccc(F)cc2F)ccc1OC 749450705 CVSQGPJWYVSNNJ-WYOARUQKSA-N 346.373 5.047 30 20 EKED CCc1oc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 760366196 VAFWSUXFLMPNND-LJQANCHMSA-N 344.414 5.058 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccncc1 766017377 ATEYUYDKGABYSI-VGSWGCGISA-N 329.447 5.112 30 20 EKED C#CC[C@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccccc1 773106230 KWTXMQDDIKZBHW-MSOLQXFVSA-N 329.390 5.093 30 20 EKED CCc1ccc([C@H](CC(C)C)NCc2ccc(OCC#N)cc2)cc1 795304883 YAWRFSJDNILGLH-QFIPXVFZSA-N 336.479 5.028 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2cccs2)cc1 915180967 UKSMTKCZFRNLHY-DRUFCSCSSA-N 344.439 5.055 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccccc1SCc1ccccc1 915330500 JVMAYSYSAZOUJW-UHFFFAOYSA-N 338.476 5.185 30 20 EKED C=CCN(Cc1ccccc1F)C(=S)Nc1cccc(C(C)C)c1 918164640 XHTKMOKCBGQLNO-UHFFFAOYSA-N 342.483 5.334 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cnn(C(C)(C)C)c1C)c1ccccc1 191386160 YSJYTUGTSCIMFT-OXJNMPFZSA-N 325.500 5.305 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(C2CC2)cc1 418104477 AEWWWNJVFROYEJ-KRWDZBQOSA-N 334.463 5.097 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(C2CC2)cc1 418104481 AEWWWNJVFROYEJ-QGZVFWFLSA-N 334.463 5.097 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 430613452 VNRPGYBDAVRDLZ-NSHDSACASA-N 346.521 5.290 30 20 EKED CCN(c1ccccc1)c1ccc(CNCc2ccc(C#N)cc2)cc1 462689300 VPANMTHMIOHOCR-UHFFFAOYSA-N 341.458 5.006 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(C(F)(F)F)CC1 482234691 YVAPUGVIDFPEBD-UHFFFAOYSA-N 340.389 5.003 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cc(C#N)ccc1F 520174206 YVZDIIMVTCECRA-LLVKDONJSA-N 337.225 5.197 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1ccccc1C#N 525599383 ONBFPDHGBNAWMM-CABCVRRESA-N 338.476 5.191 30 20 EKED C=C[C@H](CC(=O)N1CCCCC[C@H]1c1ccc(C)o1)c1ccccc1 533946003 GXVMJNZHPJGFEM-QUCCMNQESA-N 337.463 5.392 30 20 EKED C=CC1CCN(C(=O)c2csc(-c3cccc4ccccc34)n2)CC1 537553352 ZPULRDJPESESOB-UHFFFAOYSA-N 348.471 5.002 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(OCc2ccccc2)cc1 558249071 XCLYHQZZOODRCE-SFHVURJKSA-N 336.479 5.246 30 20 EKED C[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1cccc(C#N)c1 566347806 ZYBJJNCHQCZVBE-ORAYPTAESA-N 344.380 5.379 30 20 EKED Cc1ccc(C[C@@H](C#N)SC2CCC(C(F)(F)F)CC2)cc1 567859655 KATVJAINMGVMRQ-GPANFISMSA-N 327.415 5.284 30 20 EKED N#CCCCCCC(=O)Nc1cccc(-c2cccc(Cl)c2)c1 588166366 LJCWWBKAISLELV-UHFFFAOYSA-N 326.827 5.420 30 20 EKED CCC(CC)[C@@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1ccccc1 610400722 CQSBCUPTEYSRBM-HRAATJIYSA-N 349.478 5.096 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619754850 MMTKXGUWCMJPFI-AWEZNQCLSA-N 344.911 5.563 30 20 EKED N#C[C@@H](C(=O)/C=C/C1CCCCC1)c1nc(-c2ccccc2)cs1 735594070 UIBBCBGMJKUGCU-FLVLSHQESA-N 336.460 5.123 30 20 EKED C=C(C)COc1cc(/C=C\C(=O)c2ccc(Cl)s2)ccc1OC 747061158 CGTZUNNFYYCHBR-XQRVVYSFSA-N 348.851 5.261 30 20 EKED CC(C)n1cc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)cn1 760265799 VTBSAVXGGNSXMG-YHYXMXQVSA-N 341.263 5.045 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(Br)c(F)c1)c1ccccc1 773114977 LMGWCKDSJFHUAK-SCLBCKFNSA-N 346.243 5.003 30 20 EKED CC(C)(C)SCCCC(=O)Nc1cc(C(C)(C)C)sc1C#N 774165186 TVGYAMYRTWNHHP-UHFFFAOYSA-N 338.542 5.168 30 20 EKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc2cc(O)ccc2c1 789144684 WQQQLGCXYYLXQV-FPLPWBNLSA-N 347.395 5.158 30 20 EKED Cc1c(N=Cc2cc(Cl)cc(Cl)c2O)cccc1-c1ncco1 793655693 QCSYIZKTQDXURV-UHFFFAOYSA-N 347.201 5.413 30 20 EKED C=CCCc1ccccc1NCc1cccc(SC(=O)N(C)C)c1 799973332 LZKAASRRWDDGNB-UHFFFAOYSA-N 340.492 5.191 30 20 EKED COc1cc(C=NNc2cccc(C)c2)c(-c2ccccc2)cc1OC 915270327 UGMXGLXLSQSFTF-UHFFFAOYSA-N 346.430 5.125 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)CC(C)(C)C 917027074 VUQQEGLSFKUEJL-GDBMZVCRSA-N 340.492 5.449 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccccc3)cc2)cc1 920970388 IPMLNWIEFVUNHH-UHFFFAOYSA-N 340.426 5.223 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2cccc(Cl)c2)n1 80453351 HQXAPEABBAKIHA-AWEZNQCLSA-N 346.883 5.074 30 20 EKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCC(C)(C)CCC#N)cc1 174649573 OJMPYDZMSUAMJM-OAHLLOKOSA-N 345.487 5.014 30 20 EKED CC[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 237017648 FGWTYQVGEQOFKX-HXUWFJFHSA-N 342.870 5.263 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCO[C@@H](C(C)C)C1 276460147 NTRKHCBUIOUPBP-FXAWDEMLSA-N 343.511 5.318 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC[C@@H](C)C(C)=O 276567633 IFHLKYZZWUZIHA-MRXNPFEDSA-N 329.484 5.263 30 20 EKED C=CCC[C@H](NCc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 342189576 GIJYCONRJIGWHO-INIZCTEOSA-N 340.414 5.267 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1 352199063 UJKFMBFEGWDYAM-QGZVFWFLSA-N 347.245 5.158 30 20 EKED COc1cc(Cl)ccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 421855916 NISGUBIEZQDNSX-BEFAXECRSA-N 342.870 5.434 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccsc2)cc1)c1ccccc1 433026340 PEJPCTWEXMPRPM-JOCHJYFZSA-N 346.499 5.940 30 20 EKED C=CC[C@H]1N(C(=O)c2cnc(-c3ccsc3)s2)CCCC1(C)C 470285436 ILVBEODETRGHEF-OAHLLOKOSA-N 346.521 5.079 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccccn1 530500162 MCQNBPGGVNCXNL-HXUWFJFHSA-N 349.478 5.303 30 20 EKED Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(Cl)c1C 592273941 JBSDZDJSQPMVGK-CQSZACIVSA-N 341.842 5.053 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCCCC1 609378144 SLMCKQPUJIVINK-CVEARBPZSA-N 344.524 5.483 30 20 EKED Cc1cc(/C=C2\Cc3cc(F)ccc3C2=O)ccc1Oc1cccnc1 734305096 HXJQGHLBFBBSOM-LICLKQGHSA-N 345.373 5.144 30 20 EKED CC[C@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 738415483 DYVOOTNVZMEOFW-PKTZIBPZSA-N 344.433 6.044 30 20 EKED C#CC[C@H](NCc1csc(-c2ccc(CC)cc2)n1)c1ccccc1 775400098 IKNGMBUMWCCJHH-NRFANRHFSA-N 346.499 5.227 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)CCc1ccc(Cl)s1 780744656 LSZJHBRVMTYZJE-OLZOCXBDSA-N 334.872 5.126 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797572182 ZWCZFRLAJWQKIO-HUUCEWRRSA-N 332.513 5.223 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1c(C)cc(C)cc1Cl 799900703 OCWUSMMSMWEANR-UHFFFAOYSA-N 344.911 5.884 30 20 EKED CCC1(C(=O)[C@H](C#N)c2ccc3ccccc3n2)CCC(F)(F)CC1 850741612 LZVWVJVYWRCQGT-OAHLLOKOSA-N 342.389 5.017 30 20 EKED CC(C)(C)c1nc2cc(N=Cc3cc4ccccc4nc3O)ccc2o1 914703554 VECHQXJWIHCZDJ-UHFFFAOYSA-N 345.402 5.130 30 20 EKED CC(C)OCc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 920479826 SXLFQSYDGSTPEC-UHFFFAOYSA-N 338.234 5.375 30 20 EKED C=CCCCCCCCCCNc1ccc([N+](=O)[O-])c(C(=O)O)c1 1776172528 WQBGUOUMMJUBSQ-UHFFFAOYSA-N 334.416 5.012 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCC1CCC(C(C)(C)C)CC1 1776783284 MFCZQWBBSNOSOZ-CTWPCTMYSA-N 339.564 5.632 30 20 EKED N#Cc1ccc(CSc2ncc(-c3ccc(Cl)cc3)o2)c(F)c1 11300913 PXWSDRGXCXNDTA-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)cc1F 66907341 QLDDAIHMGJFEEG-LLVKDONJSA-N 347.390 5.003 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C(\Cl)c2nc3ccccc3s2)cc1 171539762 HZNZKYHAOWPDCG-DYTQJMLRSA-N 340.835 5.324 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1c(C)noc1Cl 188063267 QLDJKFGUBAUOBM-UHFFFAOYSA-N 346.858 5.060 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(CCC)nc1C 189910592 BETBJBRTFCOAPT-UHFFFAOYSA-N 342.508 5.508 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1cccnc1 191470952 SMVSFLBGEVGDIC-INIZCTEOSA-N 337.467 5.158 30 20 EKED C[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1F 427881097 HVENFPUAYZMKSM-WDEREUQCSA-N 337.225 5.416 30 20 EKED C[C@H](Sc1ccccc1C#N)c1nnc(-c2cccc(Cl)c2)o1 439689193 BQMLOGNFHGIPJT-NSHDSACASA-N 341.823 5.115 30 20 EKED CC[C@@H](N[C@H]1CCCOc2cc(Cl)ccc21)c1ccc(C#N)cc1 447578678 GKGXAFNWJMQYCW-MOPGFXCFSA-N 340.854 5.166 30 20 EKED CCC1CCC(N(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 458804126 SCBFGECXQQJUBC-UUKMXZOPSA-N 341.499 5.032 30 20 EKED C=C(C)[C@H](NC(=O)Nc1ccccc1Cl)c1ccc(F)c(F)c1 479772665 PTFLJNYIIYLGNH-INIZCTEOSA-N 336.769 5.057 30 20 EKED N#CCc1ccc(CNc2ccc(Oc3ccc(Cl)cn3)cc2)cc1 543151791 ZKVARHDVBYCDTK-UHFFFAOYSA-N 349.821 5.205 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 554366181 HXPNXYHLHVRQJC-SJORKVTESA-N 338.417 5.261 30 20 EKED CCCC[C@@H](C)N(CCCC)C(=O)c1ccc(C2(C#N)CC2)cc1 563982071 WCXPHCFLEVEHKK-QGZVFWFLSA-N 326.484 5.063 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 591499086 BNJRILWKFICIHF-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCC[C@H]1C 609436685 CTWGEKSPRFYZJE-OAGGEKHMSA-N 345.512 5.029 30 20 EKED CCCn1c(C)cc(C(=O)CS[C@@H](C)c2ccc(C#N)cc2)c1C 609826118 UOPHYMYXPRCELO-INIZCTEOSA-N 340.492 5.064 30 20 EKED CC(C)c1ccc(C[S@@](=O)CCCCC(C)(C)C#N)c(C(C)C)c1 618129625 SCKDIVQSCDSMOD-DEOSSOPVSA-N 347.568 5.902 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)/N=C\c1ccccc1O 729150144 UBECOUHYVMIZCH-WLQYJRLHSA-N 340.423 5.143 30 20 EKED O=C(/C=C\c1ccccc1-c1ccccc1)c1ccc2c(c1)COC2 742435179 QUKUYWIAWDBZTA-SEYXRHQNSA-N 326.395 5.280 30 20 EKED CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743094832 CMPBYUJFSGKGEE-FVJLSDCUSA-N 349.478 5.288 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(F)=C2CCCC2)cc1 763024643 LMPLLEBODYNLJD-IBGZPJMESA-N 334.394 5.078 30 20 EKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 764566833 GRNUSSGDQKJTLQ-HZPDHXFCSA-N 326.465 5.059 30 20 EKED C[C@@H](OC(=O)CCCCCC#N)c1cc(Cl)ccc1OC(F)F 805891932 HSBDUKNYZPDLKX-LLVKDONJSA-N 345.773 5.020 30 20 EKED CCN(C)c1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 815636323 SNWWJMJMUXSYQL-XMSQKQJNSA-N 335.495 5.228 30 20 EKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 916848216 GILPAEQNZJDUHI-HXUWFJFHSA-N 342.442 5.167 30 20 EKED CCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917046516 KOLBWFFOWBCTRY-DGCLKSJQSA-N 334.872 5.342 30 20 EKED CC(C)CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 66955585 WCNANRNVHGBLES-HNNXBMFYSA-N 345.512 5.123 30 20 EKED N#CCC[C@@H](Nc1ncnc2sc3c(c12)CCCC3)c1ccccc1 301779012 IMMPDDPDYMAWPR-MRXNPFEDSA-N 348.475 5.027 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(-c2ccccc2C)noc1C 410369157 AHINEVBPOOSOOZ-UHFFFAOYSA-N 346.430 5.329 30 20 EKED C=CCC[C@H](NCc1nc2ccc(F)cc2s1)c1ccccc1 428865193 VLRYUVYRCPADSK-INIZCTEOSA-N 326.440 5.233 30 20 EKED C=CCN(CC1CCCCC1)C(=O)CCCCC(=O)c1ccccc1 485122804 XRMWLDFSFZMNOL-UHFFFAOYSA-N 341.495 5.025 30 20 EKED CC(C)C[C@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 517550915 UENFFAQNHUJCAC-IBGZPJMESA-N 346.396 5.454 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(Oc2ccncc2)cc1)c1ccccc1 536099048 PTTZBFHHUIBOEI-QGZVFWFLSA-N 344.414 5.172 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(C2CC2)cs1 543153669 MPHGHPZLFDFAMC-UHFFFAOYSA-N 349.484 5.246 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(F)cc1Cl 546756730 UHUMXLSCYKPARD-GFCCVEGCSA-N 334.847 5.343 30 20 EKED COc1cccc2cc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)oc12 550832276 DGRGCKIHFBKGNO-VQIMIIECSA-N 348.446 5.527 30 20 EKED CCCCOc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 551532856 HHMSKCFNYKCFAO-AVRDEDQJSA-N 336.479 5.561 30 20 EKED CC(C)(CCC#N)CN[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 554366180 HXPNXYHLHVRQJC-IRXDYDNUSA-N 338.417 5.261 30 20 EKED C[C@H](NCc1cccc(Cl)c1Cl)c1ccc(C#N)cc1Cl 562413181 DZFZBEYKTCXYEZ-JTQLQIEISA-N 339.653 5.369 30 20 EKED CC[C@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccc(C#N)cc1 562494917 FBAQPHMNBPCFSB-QRWLVFNGSA-N 348.446 5.423 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1c(F)cccc1SCC 574608812 KTJUISIPMZBHFA-UHFFFAOYSA-N 344.455 5.158 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)CCCCCC#N 588327897 JGUZUGRWRUJVKL-QGZVFWFLSA-N 340.492 5.312 30 20 EKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)C[C@@H](CC#N)c1ccccc1 597885463 JTCWGLBTEYKMAZ-NHCUHLMSSA-N 346.474 5.055 30 20 EKED CC(C)c1cnc(SCc2cn3ccccc3c2C#N)n1C(C)C 610034097 QOLFUPBYAHXANN-UHFFFAOYSA-N 338.480 5.004 30 20 EKED CC(C)C[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 727955161 ZZRLNPCRPZJFFT-GOEBONIOSA-N 326.465 5.059 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(F)cc1Br)c1ccccc1 773113885 GNSWZUQKWTUROJ-UGSOOPFHSA-N 346.243 5.003 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)cc1 774390818 ILTBKDAAEPSKTQ-GOSISDBHSA-N 331.246 5.106 30 20 EKED FC(F)(F)Oc1ccc(NN=Cc2ccccc2C(F)(F)F)cc1 812461121 HOPIKTHOBGUROF-UHFFFAOYSA-N 348.246 5.050 30 20 EKED C[C@@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2c(O)ccc(F)c21 815636491 WDHXYACIYDWCIZ-ZTFGCOKTSA-N 338.426 5.104 30 20 EKED N#CCc1ccsc1-c1nc(-c2ccc(-c3ccccc3)cc2)no1 904549213 POFQKGGUIRDQCG-UHFFFAOYSA-N 343.411 5.198 30 20 EKED C[C@H]1CCN(C(=O)Nc2ccc(C#N)cc2C2CC2)[C@H](c2ccco2)C1 933846580 DCJSKPXLMPPCQN-LIRRHRJNSA-N 349.434 5.034 30 20 EKED Cc1ccccc1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777465256 CWPLLYCPNVFOQH-PKNBQFBNSA-N 348.423 5.318 30 20 EKED O=C(/C=C/c1ccnc2ccccc12)c1ccc(Cl)c(Cl)c1 38158573 QOOUKPFYIIBAAD-SOFGYWHQSA-N 328.198 5.438 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(C(F)(F)F)cc1 107842624 NYDIFPFFEVBPFY-ONNFQVAWSA-N 327.305 5.150 30 20 EKED N#CCCC[C@@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 433015949 ZOGLOISCINYPNI-HXUWFJFHSA-N 349.409 5.005 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(C2CC2)c1 436005091 QFKKWKABEUJGAN-UHFFFAOYSA-N 349.474 5.677 30 20 EKED CC[C@@H](C#N)Sc1nc(-c2cccs2)c(-c2cccs2)[nH]1 436041317 UMSAWBPEJJCJHR-JTQLQIEISA-N 331.491 5.261 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cc(F)ccc1Cl 438331741 YMDZXUTYSIARET-LBPRGKRZSA-N 334.847 5.343 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1cccc(Cl)c1)c1cccc(C#N)c1 443155557 QGMYDNVUMAFSSB-QWHCGFSZSA-N 344.867 5.033 30 20 EKED C=CCC[C@H](NCc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 450688751 WTRQVVIRHUZOTA-SFHVURJKSA-N 334.385 5.206 30 20 EKED CC(C)(C#N)c1ccccc1CNC(C)(C)c1cccc(Cl)c1F 473449861 QRFXJACORXVASR-UHFFFAOYSA-N 344.861 5.305 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 505000232 BBDPULFYCSMOGZ-AWEZNQCLSA-N 344.405 5.308 30 20 EKED CCN(Cc1nc(-c2ccccc2)cs1)[C@@H](C)c1ccc(C#N)cc1 508605570 RDCYNFTXCOLORX-INIZCTEOSA-N 347.487 5.265 30 20 EKED Cc1ccc(NCc2ccc(C#N)cc2)c(OCc2ccccc2)c1 513581816 BNORLHBIFJSNCF-UHFFFAOYSA-N 328.415 5.058 30 20 EKED C[C@@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)c(F)c1 540708567 ZLCKNHWKGHVFAX-YJYMSZOUSA-N 328.406 5.274 30 20 EKED C[C@H](NCc1ccc(Cl)o1)c1ccc(-c2cccc(C#N)c2)cc1 544041291 GJMIRDXROWMNEG-AWEZNQCLSA-N 336.822 5.322 30 20 EKED CC(C)(C#N)CC[S@@](=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 555509383 QYQDOEHALDXHGX-WZONZLPQSA-N 345.895 5.118 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 556203539 RUNMMQOUXMYNBP-DNVCBOLYSA-N 346.396 5.791 30 20 EKED C=CCC[C@@H](C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 567022948 QUDYBSHXCJNCMH-OAHLLOKOSA-N 349.808 5.966 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 578683537 ZAAUCULWZBNFDE-ZHRRBRCNSA-N 334.463 5.074 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(Oc2cccnc2)cc1)c1ccccc1 580361659 FXVJLTLDCUZCIJ-NRFANRHFSA-N 344.414 5.172 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3scc(C)c3C#N)sc2c1 589034628 YLYHWPNPGJZBLH-UHFFFAOYSA-N 346.864 5.357 30 20 EKED CCc1sc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 609376501 CVWGAFPOCLVDQS-GFCCVEGCSA-N 344.505 5.123 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)sc1Cl 610829841 OIDZZKALPYQGEI-ZJUUUORDSA-N 325.264 5.338 30 20 EKED CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)ccc1OC 619755934 ZQZNLWLYNZGZIW-QGZVFWFLSA-N 349.261 5.115 30 20 EKED C=CCC[C@H](NCc1ccnc(Oc2ccccc2)c1)c1ccco1 671740483 DYZOXOWLBLNHFJ-IBGZPJMESA-N 334.419 5.264 30 20 EKED C=CCN(C(=O)NCc1ccccc1-c1ccc(Cl)cc1)C(C)C 726851350 MNROIDYTOFIVGV-UHFFFAOYSA-N 342.870 5.113 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(-c2cccs2)cc1 728698531 KUMATEHQTPDEMA-KTKRTIGZSA-N 325.820 5.360 30 20 EKED CC[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)C 729316063 HGVQGLIBEHGQDL-LAUBAEHRSA-N 334.463 5.353 30 20 EKED CC[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 734079318 NYTSAGRFSMQPCB-MJGOQNOKSA-N 334.463 5.408 30 20 EKED CC(C)n1ncc2cc(N=Cc3c(O)ccc4ccccc34)ccc21 735229228 WEEHNDSRGLVJJH-UHFFFAOYSA-N 329.403 5.227 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(SC(F)F)cc1 766349900 KPGCGVOSRCZCMT-CHWSQXEVSA-N 332.419 5.285 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc2cccc(OCC)c2o1)c1ccccc1 776170266 IZFVBUXJULXWAU-LPHOPBHVSA-N 333.431 5.247 30 20 EKED CC(C)Sc1cccc(Cl)c1C=NNc1ccc(C#N)cc1 786038387 AOUWZRPJGYYIEW-UHFFFAOYSA-N 329.856 5.158 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2cc3cc(C)ccc3s2)cc1 813428070 RLJBEPNOAGZOFK-UHFFFAOYSA-N 334.444 5.079 30 20 EKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1ccc(C)nc1C 814769567 RYWJDVFZGJELOS-UHFFFAOYSA-N 338.842 5.045 30 20 EKED C#Cc1cccc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c1 913000085 SCVSXYSQYDPWAD-UHFFFAOYSA-N 346.238 5.442 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3cccs3)cc2)cc1 921010048 DZBXKHHUICMTON-QXMHVHEDSA-N 346.411 5.064 30 20 EKED CCCCCC(CCCCC)=NNc1ccc(C(=O)O)cc1OC 1776050055 SSWSBEXTYDWLDG-UHFFFAOYSA-N 334.460 5.322 30 20 EKED O=C(O)c1ccc(NN=C2CCCC[C@@H](c3ccccc3)C2)cc1F 1776074653 MBIKDWSYDISOCT-OAHLLOKOSA-N 340.398 5.040 30 20 EKED CCc1ccc(-c2ccc(/C=C/C(=O)c3cccc(C(=O)O)c3)o2)cc1 1776964170 OJKQMLQLUJSYBR-ZRDIBKRKSA-N 346.382 5.103 30 20 EKED Cc1ccccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777465337 SFKMOLHCIHYKJR-NVNXTCNLSA-N 342.394 5.256 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)oc2ccccc12 189884945 IMFLQXAAIHZNRX-UHFFFAOYSA-N 333.431 5.845 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CSCC)on1 189908243 YEUIOCAKWMBBQQ-UHFFFAOYSA-N 344.480 5.032 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2cccc(Cl)c2)cc1 303787533 PNXLSIBQXFPVER-UHFFFAOYSA-N 340.854 5.057 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1 303840287 LYHUGEYAPAQYME-YLJYHZDGSA-N 344.499 5.212 30 20 EKED C=CCC[C@@H](NCc1cnc(-c2ccncc2)s1)c1ccccc1 344863684 YWNJLAOZXCMFJA-LJQANCHMSA-N 335.476 5.002 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cccc(C2CCC2)c1)c1ccccc1 361798539 VJKAGMPNSAYJSD-HXUWFJFHSA-N 333.435 5.121 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(C)(C)C)cc1 438375137 JFWJRICRWVWEBQ-UHFFFAOYSA-N 344.480 5.146 30 20 EKED COc1ccc(CNc2cccc(CSC(C)C)c2C)cc1C#N 462755577 PWZDTCARJLCXKK-UHFFFAOYSA-N 340.492 5.129 30 20 EKED CCCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 516345112 WFGJOXACVDOENV-SFHVURJKSA-N 346.455 5.253 30 20 EKED CC(C)c1ccc(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cc1 518025593 WVNZKHXVYADDRX-MRXNPFEDSA-N 347.245 5.111 30 20 EKED N#CCC[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1 533360290 SESQGCSSJFUEKH-QHCPKHFHSA-N 326.443 5.488 30 20 EKED C=CCC[C@H](NCc1csc(Cc2ccccc2)n1)c1ccccc1 538258436 YNNPUASAOKNAKM-NRFANRHFSA-N 348.515 5.531 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cc(OC)c(OC)cc1F)c1ccccc1 539045908 BZHWAQXFUVLGEO-HNAYVOBHSA-N 343.442 5.201 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCC(F)(F)F)cc1 539942599 QAGHNBMCYXKZHG-UHFFFAOYSA-N 348.324 5.022 30 20 EKED CSCc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1 540272596 OICLIMHPZNZGPS-UHFFFAOYSA-N 344.505 5.033 30 20 EKED N#CCCCOc1cccc(N[C@H](c2cccnc2)C2CCCCC2)c1 593708262 MCMZORDZGFOUDK-QFIPXVFZSA-N 349.478 5.498 30 20 EKED N#Cc1ccc(N2CCC[C@H]2c2ccc(F)c(C(F)(F)F)c2)cc1 600852319 KAQGQQKEUCEEPF-KRWDZBQOSA-N 334.316 5.058 30 20 EKED C=CCCCSc1nnc(COc2ccc(Cl)cc2Cl)o1 605076496 JCVJHNTZAKDPQC-UHFFFAOYSA-N 345.251 5.014 30 20 EKED C[C@@H](NC(=O)CCCc1ccc(C(C)(C)C)cc1)c1ccc(C#N)cc1 608934952 DBRSIZCYHXEADD-QGZVFWFLSA-N 348.490 5.056 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 609208829 HUAKEZXVQGIPJH-INIZCTEOSA-N 349.434 5.004 30 20 EKED CC(C)(CCC#N)CNc1cccc(OCc2ccc(F)cc2)c1 610909734 VLHSIRPRVAFTNN-UHFFFAOYSA-N 326.415 5.147 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618805857 PIHWMCKBOLNPMM-VFNWGFHPSA-N 336.504 5.397 30 20 EKED CC(/C=C\C(=O)c1ccc(OCC#N)cc1)=C/c1ccc(Cl)cc1 753714782 POTIPAUFODGPJH-WAZDNBDMSA-N 337.806 5.085 30 20 EKED FC(F)(F)Oc1ccc(C=NOc2ccccc2C(F)(F)F)cc1 754723987 LYHREUGXRZXFAK-UHFFFAOYSA-N 349.230 5.017 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1cc(F)ccc1F 757473670 FWCHDQBQKNKNBR-GQCTYLIASA-N 333.384 5.046 30 20 EKED CC[C@H](Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(C#N)cc1 774317048 WJJMCAQORCENGU-SFHVURJKSA-N 334.419 5.163 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2ccccc2)cc1 779992417 IZJNSLXESTVADY-QGZVFWFLSA-N 328.415 5.257 30 20 EKED C[C@@H](NCc1cccc(Cl)n1)c1ccc(-c2cccc(C#N)c2)cc1 782522869 FURRYOINAGHLCX-OAHLLOKOSA-N 347.849 5.124 30 20 EKED CCCCCCCCCCC(=O)N1CCCC[C@H]1c1ccnn1C 798596430 HXWAHUCIBZFYTM-IBGZPJMESA-N 333.520 5.005 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCCC[C@@H]1c1nc(C)no1 804858716 FIEJHFGSAQGISF-SJLPKXTDSA-N 349.519 5.208 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1c(F)cccc1Cl 809159788 WTRUJZTWGSGKNW-MDZDMXLPSA-N 343.810 5.499 30 20 EKED Cc1c(C=NNc2cccc(C(=O)O)c2)sc2c(Cl)cccc12 1776037266 QUQGWTXEEASZBE-UHFFFAOYSA-N 344.823 5.007 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(F)c(C(=O)O)cc2F)cc1 1776699954 KFYOJMSXPAEQBT-BCPZQOPPSA-N 344.357 5.073 30 20 EKED Cc1ccccc1C(=O)/C=C\c1ccc(-c2ccccc2C(=O)O)cc1 1777465308 MELICZGHGALWKD-QINSGFPZSA-N 342.394 5.256 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 41537671 NGXUOHCXMPKDOI-MAUKXSAKSA-N 346.455 5.180 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3)c2)cc1 108013008 UGQRGXXRAZYKMB-SDNWHVSQSA-N 339.394 5.033 30 20 EKED C[C@H](Sc1nnc(-c2ccccc2Cl)o1)c1cccc(C#N)c1 189847032 LUCHWRSZLBCTDI-NSHDSACASA-N 341.823 5.115 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@H](CCC#N)c1ccccc1 191037857 SEJHNNBZLQEMRP-GOSISDBHSA-N 332.369 5.149 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2ccc(C#N)c(F)c2)cc1 192156081 WTEYVOCFIQTVCL-AWEZNQCLSA-N 328.456 5.049 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc2[nH]ccc12 192383691 GWYAMOBDYSDPRB-UHFFFAOYSA-N 333.435 5.664 30 20 EKED N#Cc1cccc(CN[C@@H](CCc2ccccc2)c2ccccc2)c1 237847353 LFXOAVVTIJEDQX-QHCPKHFHSA-N 326.443 5.022 30 20 EKED COc1cccc(-c2nc(/C=C3\CCc4ccccc4C3=O)cs2)c1 301492538 KRYDWESDLRDALV-RVDMUPIBSA-N 347.439 5.031 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 303665841 FGBQXQGEDMEUAU-HNNXBMFYSA-N 347.437 5.119 30 20 EKED C[C@@H](/N=C(/O)CC1CCCCC1)C(O)=Nc1nc(C2CCC2)cs1 328730450 HZHRLIRAEDDPMB-GFCCVEGCSA-N 349.500 5.314 30 20 EKED CSc1ccc(OCCS[C@H](C)c2ccc(C#N)cc2)cc1 437275218 KKHVFNLOKZCDND-CQSZACIVSA-N 329.490 5.153 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(F)cc1C 479989360 XAIMADBTOLVAMN-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1cccc(C#N)c1 521765119 XJZIOXUPXRJPKY-LLVKDONJSA-N 348.233 5.090 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 531309500 BEMAMTHWOPHCGR-UHFFFAOYSA-N 346.817 5.439 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCCC(C)(C)C1 535157961 RICFIUZNOQWHNE-CABCVRRESA-N 330.497 5.236 30 20 EKED Cc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542018119 RHZAEPMYIWSJIF-MRXNPFEDSA-N 332.472 5.446 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2F)o1)c1ccccc1 579335750 MJNDOHPUIDRNBQ-OAQYLSRUSA-N 348.421 5.610 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CC1)CC2(F)F 650154290 HZIYBSCKJCGREO-UHFFFAOYSA-N 348.437 5.192 30 20 EKED CCc1ccc(NC(=S)Nc2ccccc2SCCC#N)cc1 730953338 VJEALIKGPCZRAR-UHFFFAOYSA-N 341.505 5.064 30 20 EKED C=C(C)[C@H](CC(=O)Nc1ccc(SC(C)(C)C)cc1C)OCC 755838567 KYRKRSMFWQBPFE-KRWDZBQOSA-N 335.513 5.195 30 20 EKED CC(C)c1ccc(N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 763141578 MNUKJTXYMZKGIS-UHFFFAOYSA-N 343.883 5.168 30 20 EKED CCN(CC)c1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 814305068 WOYPNKRIKXRESV-JOCHJYFZSA-N 335.495 5.058 30 20 EKED CC(C)[Si](C#Cc1ccc(-c2ccccc2)cc1)(C(C)C)C(C)C 2171559365 SGXPZONOWUALFO-UHFFFAOYSA-N 334.579 6.923 30 20 EKED C[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 246207064 AEGXNIRHAVQKHB-UXLLHSPISA-N 345.512 5.123 30 20 EKED CC1(C)CCC(/N=C(/O)[C@H]2CCSc3ccccc32)(C(=N)O)CC1 328893967 VHWRJDTVNSDANO-AWEZNQCLSA-N 346.496 5.097 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]1 329126918 YUAYMJFVWGMUIF-IXDOHACOSA-N 337.467 5.580 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(-c2ccccc2)noc1CC 410346698 KGRNTOLQZBIWIK-UHFFFAOYSA-N 346.430 5.275 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)C(C)(C)C 433147069 XQLFKZVEDNIWBJ-ZDUSSCGKSA-N 333.501 5.027 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(C#N)cc1 464361028 DONYAYMNAHLFGW-QGZVFWFLSA-N 340.426 5.058 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cc(F)c(F)c(F)c1)c1ccc(F)c(F)c1 480667164 FXTZRYFKQJFATF-MLCYQJTMSA-N 341.323 5.350 30 20 EKED Cc1ccc(C)c([C@@H](NCCCCC#N)c2ccccc2Cl)c1 491004992 KERIVRFZDOJYEN-FQEVSTJZSA-N 326.871 5.330 30 20 EKED Cc1nc(-c2ccc(CNc3ccc(Cl)cc3C#N)s2)cs1 552009203 IZCGSVLSSASXDC-UHFFFAOYSA-N 345.880 5.317 30 20 EKED CC1=CC(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CC1 725839222 NEGLJTWZPSRXMF-UHFFFAOYSA-N 338.411 5.005 30 20 EKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1Cl 726426238 SXWGAPIBPUTQNS-UHFFFAOYSA-N 337.732 5.067 30 20 EKED N#CCCn1cc(-c2csc(Cc3ccccc3)n2)c2ccccc21 732821221 YJACQPKWFLDKMC-UHFFFAOYSA-N 343.455 5.269 30 20 EKED C[C@@H](ON=Cc1ccc(C(C)(C)C)cc1)c1nc(-c2ccccc2)no1 749255979 KQFHVAFFBDAJOO-OAHLLOKOSA-N 349.434 5.146 30 20 EKED CC(C)c1ccc(NC(=S)N(c2cccc(C#N)c2)C(C)C)cc1 749766135 BRZMJXYNIXPHTP-UHFFFAOYSA-N 337.492 5.293 30 20 EKED CCCC(CCC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 753541319 JYFNLQYJMPFYER-ZDUSSCGKSA-N 334.872 5.342 30 20 EKED Cc1cccc2c1[C@@H](C)/C(=C\c1cccc(OCCCC#N)c1)C2=O 766694281 BVEDOMMPSTVACD-RZKQZQCBSA-N 331.415 5.061 30 20 EKED Cc1ccoc1C(=O)/C=C/c1cccc(/C=C/C(=O)c2occc2C)c1 769784547 YYCJSQBVAJIKMR-CDJQDVQCSA-N 346.382 5.282 30 20 EKED CCCOc1ccc(NCc2ccc(O[C@@H](C)C#N)cc2)cc1Cl 770490013 ZNGPOPJVQUWLJJ-AWEZNQCLSA-N 344.842 5.032 30 20 EKED Cc1cccnc1[C@H]1CCCC(=NNc2ncc(Cl)cc2Cl)C1 799106592 CXVUWXNJLTYRCH-LBPRGKRZSA-N 349.265 5.218 30 20 EKED N#CCCCCCC(=O)OC(c1ccc(F)cc1)c1ccc(F)cc1 805867607 MOXJGZYNBKZEDH-UHFFFAOYSA-N 343.373 5.071 30 20 EKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCC1 838787810 KAYIIDWFTKGFPE-ABAIWWIYSA-N 344.867 5.076 30 20 EKED O=C1/C(=C/c2ccc3ncccc3c2)CCc2[nH]c3ccc(F)cc3c21 914558533 ZGHDAFFVUMEOCE-RVDMUPIBSA-N 342.373 5.068 30 20 EKED FC(F)(F)c1cccnc1NN=C1CCC(c2ccccc2)CC1 915051562 ZTMJJENIRLGTBT-UHFFFAOYSA-N 333.357 5.226 30 20 EKED N#CCOc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1 917516816 GEAPHDJXTUKUEL-ZHACJKMWSA-N 345.423 5.214 30 20 EKED COc1cc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)ccc1O 917517667 QVCPEFOVXAQKEM-NTMALXAHSA-N 336.412 5.025 30 20 EKED C=C(CC)C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 1548649946 LITVKSNGRDLONK-QGZVFWFLSA-N 338.451 5.095 30 20 EKED N#CCC[C@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 90666020 JPZGUJJRZSAEGW-VQTJNVASSA-N 332.447 5.068 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(C)c(C)c1 189874701 SNUWHWLIRKDQPO-UHFFFAOYSA-N 337.463 5.173 30 20 EKED N#Cc1csc(CNCc2ccccc2Sc2ccccc2)c1 237850006 GLOTZLIJQHHMBU-UHFFFAOYSA-N 336.485 5.061 30 20 EKED Cc1cccc(C2(NCc3cccc(OCCCC#N)c3)CCCC2)c1 237933293 LJHLTQBADXTEFS-UHFFFAOYSA-N 348.490 5.237 30 20 EKED CCCCCCCCOCc1cccc(N[C@H](C)c2nnc(C)o2)c1 264890872 TVOOXLUYRIDOSR-MRXNPFEDSA-N 345.487 5.428 30 20 EKED O/C(CC1CCCC1)=N/C/C(O)=N\C1(c2ccc(F)cc2)CCCC1 328918771 SGSVHURBVHFXNB-UHFFFAOYSA-N 346.446 5.088 30 20 EKED C[C@H](OC1CCCCCC1)/C(O)=N/[C@H](C)c1ccc2ncsc2c1 330122586 HGZJEBOBFCLXSF-KGLIPLIRSA-N 346.496 5.442 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1N1CCCCC1 410358481 GKCLZICOCSCRHZ-UHFFFAOYSA-N 334.463 5.048 30 20 EKED N#CCC[C@H](NC(=O)CCCCCc1cccs1)c1ccccc1 439674998 REKIBHHSLPJVFC-IBGZPJMESA-N 340.492 5.012 30 20 EKED Cc1c(NC2CCC(C#N)(c3ccccc3)CC2)cnn1C1CCCC1 446900922 SYNCFXZAJASDEZ-UHFFFAOYSA-N 348.494 5.123 30 20 EKED Cc1cccc([C@H]2CCCCN2C(=O)Nc2cccc(CC#N)c2)c1C 455918834 LOCQSAQTPKAJTO-OAQYLSRUSA-N 347.462 5.129 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1CCC(C)CC1 475557505 CDJBSKCHUNBVEU-UHFFFAOYSA-N 328.500 5.581 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1 483045741 KJJCRTQMDJITOZ-DYESRHJHSA-N 334.463 5.420 30 20 EKED CCC(CC)[C@@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 503348263 SRILSBCIFIRABN-HRAATJIYSA-N 349.478 5.096 30 20 EKED Cc1sc(CNc2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 505585238 MKOIIIPWYOEAIF-UHFFFAOYSA-N 339.851 5.256 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)Cc1ccc(C#N)cc1 531580939 BWZSORAEGSJTOZ-MRXNPFEDSA-N 347.487 5.183 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1 535397996 UWJSZVHKFWYAGI-VQIMIIECSA-N 339.866 5.016 30 20 EKED C[C@@H](NCc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 542944302 JOHBQNNOEAOBBC-MRXNPFEDSA-N 330.406 5.215 30 20 EKED N#CCC1CCN(Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)CC1 543783694 ZOSIAPYOQRJCTO-UHFFFAOYSA-N 348.368 5.091 30 20 EKED CC[C@H](C)n1c(S[C@H](C#N)c2ccccc2)nnc1-c1ccccc1 581201784 GRBIPMAASZIEHZ-MAUKXSAKSA-N 348.475 5.273 30 20 EKED N#CCCSc1ccccc1NC(=O)CCCC1CCCCC1 609375832 ALOJKRIKZINUOL-UHFFFAOYSA-N 330.497 5.381 30 20 EKED C=CCCSCc1csc(COc2ccc(Cl)cc2)n1 610092643 RDFUASCFNMSBFG-UHFFFAOYSA-N 325.886 5.185 30 20 EKED C[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1cccc(C#N)c1 610344686 FFMIAMVSQUSSFM-NSHDSACASA-N 338.760 5.081 30 20 EKED Cc1cc(C)cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 613403413 PAZHDHCKKVPNCM-AWEZNQCLSA-N 340.835 5.057 30 20 EKED C=C[C@H](CC(=O)N1CCCC[C@@H]1c1ccccc1OC)c1ccccc1 677541095 NEDYDCHGLIBWPY-WIYYLYMNSA-N 349.474 5.109 30 20 EKED Cc1cc(C)c(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1C 726742716 WRFBWRUZKQWEPA-MDZDMXLPSA-N 333.431 5.191 30 20 EKED N#Cc1ccc(NN=C2CC(c3ccccc3F)C2)cc1C(F)(F)F 743439205 XAXKVTRXKUEHCI-UHFFFAOYSA-N 347.315 5.062 30 20 EKED Cc1cc(C)cc(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)c1 745686425 ACTPNWZMWVHZFR-UHFFFAOYSA-N 337.492 5.035 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H](c2ccccc2)C(C)C)n1 747198481 XOHCUTRREDRNEO-DLBZAZTESA-N 340.492 5.273 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1ccc(C(F)(F)F)cc1Cl 768832844 HLRCLWPLRMPYFR-UHFFFAOYSA-N 347.764 5.236 30 20 EKED CCSc1cccc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)c1 769742782 PXAQVRLIRMKFMK-KHPPLWFESA-N 328.481 5.089 30 20 EKED C#CC[C@@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccccc1 773113298 CZXIFYIZLGQUIL-QFBILLFUSA-N 332.472 5.225 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(OC)c(OC)c2)cc1 776794410 HNCDGOMYBNJGJV-CQSZACIVSA-N 347.842 5.008 30 20 EKED CCCCCCCCC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C 778954264 GPUYYFMCQXZCKS-GOSISDBHSA-N 333.520 5.221 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc2ccccc2c1O 841763357 VWZHPUBDMJHYPU-NYHFZMIOSA-N 342.442 5.145 30 20 EKED CSc1cc(Cl)ccc1NCc1ccc(N(C)CCC#N)cc1 864041848 UNRYUHKDEUIWIC-UHFFFAOYSA-N 345.899 5.024 30 20 EKED CCCCc1nc(CON=C(C)c2cc3ccccc3o2)cs1 920399179 MENALVZLUHXMPQ-UHFFFAOYSA-N 328.437 5.173 30 20 EKED N#Cc1cccc(COc2cccc(/C=C/C(=O)c3ccccc3)c2)c1 59269310 XPTUGYKARUJWQG-OUKQBFOZSA-N 339.394 5.033 30 20 EKED CC(C)Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 326611197 LWEMOLMRLCFILE-MSOLQXFVSA-N 336.479 5.199 30 20 EKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1C(C)(C)C 340449682 VSNVNKUWSKSAQW-OXJNMPFZSA-N 338.499 5.032 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1 413741112 CSDWDHDSBTZYNJ-LEWJYISDSA-N 346.474 5.376 30 20 EKED N#CC1(CC[S@](=O)Cc2ccc(Cl)c(Cl)c2)CCCCC1 417172033 HLJUZXCSKBTGML-NRFANRHFSA-N 344.307 5.106 30 20 EKED CC(C)c1ccsc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443884802 OOJTUQHYWINEKZ-UHFFFAOYSA-N 338.354 5.014 30 20 EKED C[C@H](c1cccc(C#N)c1)c1nc(-c2c(Cl)cccc2Cl)no1 461800470 IIVICRKZONCOCM-SNVBAGLBSA-N 344.201 5.067 30 20 EKED C[C@H](C#N)C(=O)Nc1ccc(-c2ccc(C(C)(C)C)cc2)cc1Cl 468498715 QHXFAPMBVYZAHP-CYBMUJFWSA-N 340.854 5.403 30 20 EKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1Cl 469081676 XQLCSBQWJZLADB-GFCCVEGCSA-N 344.867 5.153 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](SC)C(C)(C)C 475578690 QMFNLPQOTAIQTM-QGZVFWFLSA-N 348.556 5.438 30 20 EKED CCN(C(=O)c1cccc2ccccc12)c1ccc(C#N)c(Cl)c1 539174779 BHDOEJQIRDPWQE-UHFFFAOYSA-N 334.806 5.032 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 539497211 YOCSPCROMONZAV-XOBRGWDASA-N 336.435 5.199 30 20 EKED Cc1ccc(Oc2ccc(NC(=O)c3cccc(CC#N)c3)cc2)cc1 603730484 FOYYEBCKUYUAKI-UHFFFAOYSA-N 342.398 5.106 30 20 EKED N#Cc1ccccc1/C=C/c1nc(-c2c(Cl)cccc2Cl)no1 609474215 RUXAUQWUZMXJOX-CMDGGOBGSA-N 342.185 5.085 30 20 EKED C[C@@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1cccc(C#N)c1 610878455 KPTZHGZKGXEWFA-SNVBAGLBSA-N 349.768 5.032 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400533 QNJLPOHUDBTSJU-HUUCEWRRSA-N 333.501 5.171 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\C2CCCCC2)cc1 735427628 DOTOPVDIERLWFV-PNLXHIIUSA-N 344.458 5.417 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1nccc2ccccc12 740764831 HRWAGGIMFGDAIN-KTKRTIGZSA-N 336.460 5.193 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)c(F)c1 776741865 KELXVNYXOUMVSL-BUXKBTBVSA-N 346.396 5.414 30 20 EKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C/c1scnc1C1CC1)CCO2 782349508 ZAFSVSVJNPKYGV-XYOKQWHBSA-N 345.851 5.031 30 20 EKED CC(/C=C\C(=O)c1ccccc1C#N)=C/c1ccccc1OC(F)F 811690354 BHSGYVKRLNOOLX-QDUUWUCGSA-N 339.341 5.002 30 20 EKED C=CCCCCC[C@@H](C)N[C@H](C(=O)O)c1ccc2ccccc2c1 901514376 GMHPXAQOFJURNX-UZLBHIALSA-N 325.452 5.080 30 20 EKED CCCCCCCCC(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1 918372445 JWXBMDSXZQVMLA-UHFFFAOYSA-N 343.511 5.167 30 20 EKED CC1(C)/C(=C/c2csc3ccc(C(=O)O)cc23)C(=O)c2ccccc21 1776515341 MCXRJFFAIDOCNZ-LICLKQGHSA-N 348.423 5.157 30 20 EKED CCCOCc1ccccc1CNc1ccc(C#N)c(C(F)(F)F)c1 78582945 DHUWQOMNSOUWQT-UHFFFAOYSA-N 348.368 5.116 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1 89705984 QSOMSWSFAYNNDD-UHFFFAOYSA-N 330.387 5.000 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1OC(F)F 193905629 ODYPOLDAZGZYAZ-CQSZACIVSA-N 346.377 5.144 30 20 EKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 261366588 FNJWRKBMKNGKPX-UHFFFAOYSA-N 344.848 5.254 30 20 EKED COc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)c(Cl)c1 424302403 MCSRTAALNBOIEO-KUHUBIRLSA-N 328.843 5.044 30 20 EKED C=CCC[C@@H](NC(=O)N(C1CC1)[C@@H](C)c1ccco1)c1ccccc1 435760196 KGRBUCXUJLGHOR-QFBILLFUSA-N 338.451 5.222 30 20 EKED C[C@@H](c1ccccc1Br)N(C)CCCCC(C)(C)C#N 444591975 DPMHZCYSLQBAQC-AWEZNQCLSA-N 337.305 5.162 30 20 EKED CCC(C)(C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 465166871 OBPDDLGKSLWVOI-UHFFFAOYSA-N 336.435 5.424 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CC(C)(C)C 467468745 PBJYFIUZLWACHK-AWEZNQCLSA-N 347.528 5.275 30 20 EKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 480549895 FRZQZUXSQOXJSA-YWZLYKJASA-N 349.434 5.003 30 20 EKED CSc1cccc([C@@H](NCCCCC#N)c2ccc(F)c(F)c2)c1 491060123 MVJVMQHOBFHZLR-LJQANCHMSA-N 346.446 5.060 30 20 EKED C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)Nc1ccccc1S[C@H](C)CC#N 503221169 CACUNRQQVJUJPV-QXSJWSMHSA-N 345.512 5.027 30 20 EKED CCS[C@@H]1CCC[C@@H](NC2CCC(C#N)(c3ccccc3)CC2)C1 507612572 FHSMPUQYGQDXEQ-JWFWCLOMSA-N 342.552 5.044 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2ccsc2c1 530454962 XNTUFPPEOHERTR-UHFFFAOYSA-N 336.460 5.401 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1ccc(F)cc1)c1ccccc1Cl 532412974 BIAMOTHAJNDIDQ-IBGZPJMESA-N 344.861 5.488 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 537289414 AAQFEYFLNAFLGA-KSFYIVLOSA-N 346.861 5.652 30 20 EKED C=CCC[C@@H](NCc1nc(-c2cccs2)oc1C)c1ccccc1 539360810 TZNCCRHPFWCDLM-QGZVFWFLSA-N 338.476 5.509 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc2nc(C(C)C)sc2c1 539398535 KOBULICLBVORTJ-UHFFFAOYSA-N 346.496 5.121 30 20 EKED Cc1c([C@@H](NCc2ccc(CC#N)cc2)C(C)C)oc2ccccc12 544124010 RUPZOOOARNDKDP-NRFANRHFSA-N 332.447 5.294 30 20 EKED CCc1ccc(-c2nc(CN[C@@H](C)c3ccc(C#N)cc3)cs2)cc1 548930567 FHPZPEUHZOWGON-HNNXBMFYSA-N 347.487 5.095 30 20 EKED C=CCCCCCN(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610051576 VVBVULMFLLDSQE-UHFFFAOYSA-N 348.446 5.169 30 20 EKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)sc12 647379781 NIYDDDGSBXGUKZ-CYBMUJFWSA-N 338.457 5.034 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc(C)cc2C)c1 727284172 GACYVSGKNMAWCI-UHFFFAOYSA-N 326.465 5.067 30 20 EKED Cc1ncccc1/C=C\C(=O)c1ccc2ccccc2c1OC(F)F 728786187 UIEZRLFAINHVSC-LUAWRHEFSA-N 339.341 5.041 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccc(OC(F)F)cc1 741840402 SMBKVVSBQYRDML-SREVYHEPSA-N 332.277 5.069 30 20 EKED C[C@@H]1C/C(=C/c2cccc(OCCCC#N)c2)C(=O)c2ccccc21 751537727 ZJFNPSZZWOQDAV-VVZNPABPSA-N 331.415 5.143 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1 793372204 ZSCKQTAGDGWAMW-AWEZNQCLSA-N 346.402 5.027 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1O 810221197 MILAHCDPOFSTLE-YVEFUNNKSA-N 348.368 5.085 30 20 EKED CCN(CC(C)(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 812920384 WGHXFLMBIIQNBG-HXUWFJFHSA-N 349.478 5.242 30 20 EKED CCCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 845456252 VKMYCTCKMJUMBQ-NSHDSACASA-N 348.418 5.091 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCO2 850471893 UFGIIANDTDEHNS-LAUBAEHRSA-N 334.463 5.097 30 20 EKED C=CCC1(C(=O)O)CCN([C@@H](CC(C)C)c2ccc(CC)cc2)CC1 1776158168 VRCQZJROPFYYSM-FQEVSTJZSA-N 343.511 5.079 30 20 EKED CC(C)[C@@H](NC[C@H](C#N)CCC#N)c1ccc(C2CCCCC2)cc1 23678014 WEVZYRSPUVNCNN-PGRDOPGGSA-N 337.511 5.465 30 20 EKED C=CCN(CCc1ccccc1)Cc1csc(-c2ccsc2)n1 65959272 LNQUEFKYVOUKRZ-UHFFFAOYSA-N 340.517 5.102 30 20 EKED C=CCN(CC=C)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 71952046 XLBVKNANIZIXSO-UHFFFAOYSA-N 338.398 5.003 30 20 EKED C[C@@H](SCCC(=O)Nc1ccccc1Cl)c1ccc(C#N)cc1 118446334 PUDWYYBCJNLXRA-CYBMUJFWSA-N 344.867 5.035 30 20 EKED C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(OCC#N)cc1 182337193 TVQVSGMBELXELL-AWEZNQCLSA-N 348.368 5.257 30 20 EKED Cc1c(CSC(C)C)cccc1NCCCC1(C#N)CCOCC1 280919679 DCGJTPLCXFBSLG-UHFFFAOYSA-N 346.540 5.149 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCC1CCCC1 463750023 ABGLXDDVLBXSBO-HNNXBMFYSA-N 330.497 5.380 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)NCC(C)(C)CCC#N 482232890 POOFSOFNOVIYDF-UHFFFAOYSA-N 329.488 5.214 30 20 EKED C[C@H](Sc1cccc(C#N)c1)c1nnc(-c2ccccc2F)s1 484499582 GSMBYRDIQRMIQB-NSHDSACASA-N 341.436 5.069 30 20 EKED Cc1ccc(F)cc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519163990 XPCLITWMUQWHLR-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCC[C@@H](NCc1cc(C(C)=O)ccc1OCC)c1ccccc1 540457569 FRKMEVNVGRQALC-OAQYLSRUSA-N 337.463 5.085 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@H](CCCC#N)c1ccccc1 572065020 MMCRLBHSCFDHPO-YADHBBJMSA-N 348.490 5.442 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 590068700 ROIQXOKZUZDKEU-NRFANRHFSA-N 330.431 5.471 30 20 EKED CCC(CC)N(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 609126297 IZJHRFQMHFTETB-UHFFFAOYSA-N 348.446 5.144 30 20 EKED C#CC[C@@H](NC(=S)Nc1c(C)cc(C)cc1Cl)c1ccccc1 756857244 QEHRCTVWBFHFHO-QGZVFWFLSA-N 342.895 5.008 30 20 EKED N#CCOc1cc(F)ccc1NCc1ccc(-c2cccs2)cc1 766116335 CYKDXUPNDRLMNJ-UHFFFAOYSA-N 338.407 5.069 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccc(C(F)F)cc3)c2c1 794941895 BDXMYOTVESESPI-WTKPLQERSA-N 327.330 5.010 30 20 EKED C=CCOc1ccc(CNc2ccccc2NC(C)(C)C)cc1OC 798500590 RWYOASZNIORSGH-UHFFFAOYSA-N 340.467 5.083 30 20 EKED CC(C)c1noc([C@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 66903746 NIMWUYXVDUYSMY-AWEZNQCLSA-N 348.406 5.030 30 20 EKED CCCCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 173122951 WYHGCRPRGDYJDE-MRXNPFEDSA-N 347.528 5.513 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cc3ccccc3s2)cc1 187232610 LFZDMNBMPYGLBD-ZHZWZMEUSA-N 333.412 5.088 30 20 EKED C/C(O)=N/C1CCC(/N=C(/O)C2(C3CCCCC3)CCCCC2)CC1 329422091 DXBWCEMIXHCRNC-UHFFFAOYSA-N 348.531 5.761 30 20 EKED CCN(C(=O)CC1CC(c2ccccc2)C1)[C@@H](C)c1ccc(C#N)cc1 409753760 QQFJVIUXGYSSOZ-QXAHSBQVSA-N 346.474 5.052 30 20 EKED N#Cc1ccc(NC(=O)C2(c3cccs3)CCCCC2)c(Cl)c1 430368422 XHVRTTAVCSAUKJ-UHFFFAOYSA-N 344.867 5.114 30 20 EKED CCSc1ccc(Cl)cc1NC(=O)[C@@H](C)c1cccc(C#N)c1 463945835 BVILCMFTRCBWKA-LBPRGKRZSA-N 344.867 5.066 30 20 EKED CC(C)CC1(C(=O)Nc2ccccc2SC[C@H](C)C#N)CCC1 465457277 DFFVLNMYDUTOHK-OAHLLOKOSA-N 330.497 5.093 30 20 EKED Cc1nc(CSc2cccc(C#N)c2)oc1-c1ccc(Cl)cc1 468648725 RIQVBTFJQHZPOF-UHFFFAOYSA-N 340.835 5.467 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(Cl)c1 476123067 NOWHXKDTHDNIIY-HNNXBMFYSA-N 341.882 5.934 30 20 EKED CSc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1Cl 476233689 FICVVMZHYKBKAI-AWEZNQCLSA-N 344.867 5.088 30 20 EKED C=CC1CCN(C(=O)Nc2cc(Cl)ccc2SC(C)C)CC1 523585493 LKBJJFHEGYFRLL-UHFFFAOYSA-N 338.904 5.270 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c2ccccc12 551221094 AQBLUAQDLXIGBA-SBUREZEXSA-N 346.449 6.065 30 20 EKED CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)CCCCC#N 594013169 TWDBUPQZUASIOX-LJQANCHMSA-N 334.891 5.360 30 20 EKED C=CCCCSCc1csc(-c2ccc(OC)cc2OC)n1 609803835 CRJPUHYWTCORDB-UHFFFAOYSA-N 335.494 5.027 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1cc(Cl)sc1Cl 726743354 DZDYKQKJSBCGGQ-AATRIKPKSA-N 337.227 5.270 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC[C@](C)(C#N)C1 752583248 YXGNJCBCCQXKGG-LJQANCHMSA-N 345.512 5.043 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3c(Cl)sc(Cl)c32)cc1 765011023 LXJLDWYBMZTNTP-ZDUSSCGKSA-N 337.275 5.094 30 20 EKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(C#N)c(F)c3)c2)cs1 776804687 IRUZAAVFPGVHIR-LBPRGKRZSA-N 337.423 5.302 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1csc2ccccc12 784345801 CRYPQTUJOVCFLR-LBPRGKRZSA-N 326.852 5.277 30 20 EKED Fc1ccccc1CCNC(CCC(F)(F)F)CCC(F)(F)F 827371050 OLUMOMMZXQIJAZ-UHFFFAOYSA-N 345.302 5.011 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCO2 850471894 UFGIIANDTDEHNS-UTKZUKDTSA-N 334.463 5.097 30 20 EKED Cc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 915086143 HOZQPIVKILCGCC-QFIPXVFZSA-N 340.426 5.211 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)CC(C)(C)C 917027076 VUQQEGLSFKUEJL-GOEBONIOSA-N 340.492 5.449 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C=C2CCCCC2)cc1 919841937 NFULVOJYGHITLD-NRFANRHFSA-N 330.431 5.171 30 20 EKED C=CCSc1ccccc1NC(=O)CSc1ccc(C)cc1 15402781 OQTRDUSNJSXNBZ-UHFFFAOYSA-N 329.490 5.004 30 20 EKED N#Cc1cccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)c1 55043022 NDOVAFJDJLUGJF-HSZRJFAPSA-N 338.410 5.184 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)c(C)c1 189845197 PAGHLWPCYHWALD-OAHLLOKOSA-N 349.459 5.387 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1F 189912741 HJKVBQYEEHTCOI-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccccc2[C@@H]1C 191428407 LIALUHGIUACVAL-KRWDZBQOSA-N 348.490 5.690 30 20 EKED C=CCCCN(C)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 303847261 MWBTUXBCPOYBFO-QGZVFWFLSA-N 338.451 5.257 30 20 EKED CC(C)(C)[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 440209661 ASKBWKKIMWRRCS-PMACEKPBSA-N 349.478 5.118 30 20 EKED C=CCC[C@H](NC(=O)NCc1ccc(C(F)F)cc1)c1ccccc1 462204099 PHEONFZIMBNAQE-SFHVURJKSA-N 344.405 5.131 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 468684170 JLEBMUCJTMYJCM-UHFFFAOYSA-N 345.446 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(SCC)cc1 476089289 GALDQZNLXVIGKT-UHFFFAOYSA-N 339.504 5.903 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(OCCC)cc1C 486232522 MQABXVPDLRMQHA-UHFFFAOYSA-N 341.476 5.314 30 20 EKED Cc1ccc2sc(C(=O)N[C@@H](CCCC#N)c3ccccc3)cc2c1 487531877 FCOAHNCCCDBZFS-SFHVURJKSA-N 348.471 5.375 30 20 EKED CC(C)[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 487606989 WSGUHPXSUBVHDN-FCHUYYIVSA-N 348.490 5.368 30 20 EKED C=CCC[C@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 560545433 VLQUSINXSXGNDY-IRXDYDNUSA-N 329.415 5.318 30 20 EKED C=C(C)COc1cccc(NC(=O)N(Cc2ccccc2)C(C)C)c1 589741514 KDTOZYBKSLACMT-UHFFFAOYSA-N 338.451 5.084 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@H](C)c2ccc(C#N)cc2)o1 609677608 OXHWJSMIWNVJOM-OAHLLOKOSA-N 334.394 5.117 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)sc1Cl 619754766 KCAXVPQVTZQECX-QMMMGPOBSA-N 345.682 5.431 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CCCCC1)C1CC1 682777160 GESWDOAGYOFBAJ-UHFFFAOYSA-N 340.511 5.868 30 20 EKED C#Cc1cccc(NC(=S)N(CC)[C@H](C)c2cc3ccccc3o2)c1 726475877 SNYSMZUUDLTTBE-OAHLLOKOSA-N 348.471 5.194 30 20 EKED C[C@H](C(=O)OCc1ccc(-c2ccccc2C#N)cc1)c1ccsc1 738828027 CQTHMMOPVRKXQU-HNNXBMFYSA-N 347.439 5.134 30 20 EKED C/C(=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)(C)C 742537743 OYCFNWZAQAVNJA-VISDOYDDSA-N 332.447 5.273 30 20 EKED CCCN(CC(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746658258 FCVHIFUQEPSBTK-NRFANRHFSA-N 349.478 5.242 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1c[nH]c2cc(F)ccc12 749453365 QVWISMMWGISGHD-VQHVLOKHSA-N 348.402 5.327 30 20 EKED CCCCCCCCCC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 765328984 VJBMNSHGGZYLQC-UXHICEINSA-N 331.500 5.164 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(F)cc1Br)c1ccccc1 773113884 GNSWZUQKWTUROJ-SCLBCKFNSA-N 346.243 5.003 30 20 EKED CC(CCCC(F)(F)F)=NOCc1ccc(C(F)(F)F)cc1 774392207 DEIBQBKLNPVGFB-UHFFFAOYSA-N 327.268 5.331 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1ccc(Cl)c(Cl)c1 779712336 FERCNWWADANMGJ-RYUDHWBXSA-N 335.234 5.457 30 20 EKED CCSc1ccc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)cc1 788354587 MIELDBNPNCZQNF-FPLPWBNLSA-N 343.395 5.170 30 20 EKED C=CC[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccncc1 808697123 WIXIIPVHKNJLCT-TZIWHRDSSA-N 331.463 5.156 30 20 EKED N#CCCCCCC(=O)O[C@@H](c1ccc2ccccc2c1)C(F)(F)F 851584065 WYAMCUQYNAIACQ-SFHVURJKSA-N 349.352 5.460 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)c1sccc1CC#N 866082441 BREAFQLARBTIMI-UHFFFAOYSA-N 344.505 5.017 30 20 EKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)Nc2cccc(C#N)c2)cc1 96721471 XCBPXXFQXYJCHR-FQEVSTJZSA-N 347.462 5.225 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@H](C#N)C3CCCCC3)o2)c(C)c1 115187868 VHAGUGLPHGCNQH-MRXNPFEDSA-N 341.480 5.226 30 20 EKED C[C@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(OCC#N)cc1 181265079 KBHZFVWFRMBMDP-HTAPYJJXSA-N 334.463 5.171 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2c1O 193906362 COCTXOBCQOSPHZ-MRXNPFEDSA-N 346.430 5.401 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1cccc(C#N)c1 303149376 MKOGTJQJWLHUMK-BJMVGYQFSA-N 348.402 5.025 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cc(Cl)ccc1F)c1ccccc1 432632799 NCDTYOWKRKNYMS-INIZCTEOSA-N 345.805 5.036 30 20 EKED CC[C@@H](NCc1ccc(-c2ccco2)cc1F)c1ccc(C#N)cc1 448024420 YHLKYCWDBDGNQE-HXUWFJFHSA-N 334.394 5.198 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)c(C)c1 460080183 VJQVMQCDUALDMD-FOIQADDNSA-N 342.508 5.298 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OCC)cc1C 471241434 PRGNPOOQWBBASS-UHFFFAOYSA-N 338.451 5.004 30 20 EKED CC(C)c1occc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 479966406 WXEMGUGKMHWEFQ-UHFFFAOYSA-N 346.386 5.319 30 20 EKED Cc1cc2cc(C(=O)[C@H](C#N)c3nccc4ccccc34)oc2cc1C 483219772 VDMMBPWLXBTFGQ-GOSISDBHSA-N 340.382 5.088 30 20 EKED CC(C)(C#N)c1ccccc1CNc1cccc(OCC(F)(F)F)c1 486433800 KXPVXGVDPNQOCK-UHFFFAOYSA-N 348.368 5.041 30 20 EKED CC(C)c1ccc(CCC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487607866 YJZVHHJKWAEXLZ-QFIPXVFZSA-N 348.490 5.294 30 20 EKED N#Cc1ccc(S[C@@H](C(=O)Nc2ccccc2)c2ccccc2)cc1 509641998 WFHXFUQUNGWGLA-HXUWFJFHSA-N 344.439 5.030 30 20 EKED C[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 510075765 WCJIUWHBOSVWNL-JKSUJKDBSA-N 349.434 5.003 30 20 EKED CC(C)(CC(=O)Nc1ccccc1CC#N)Cc1ccc(Cl)cc1 519788726 WMQHEMYGGAFPSM-UHFFFAOYSA-N 340.854 5.004 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1)c1ccccc1 536204776 PPDYXXWTABAVBS-HQRMLTQVSA-N 337.463 5.248 30 20 EKED Cc1oc(-c2ccsc2)nc1CSc1cccc(Cl)c1C#N 542102310 MFKJLNZNDYTTKG-UHFFFAOYSA-N 346.864 5.529 30 20 EKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(C#N)cc1 542936547 SLAOMEAIUKYYHY-LLVKDONJSA-N 332.350 5.302 30 20 EKED C[C@H](CCc1ccc(F)cc1F)N[C@H](CCCC#N)c1ccccc1 551211860 YKLQENXZIFPINS-IIBYNOLFSA-N 342.433 5.311 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 559857160 CJMWNTPFACYYAE-CRAIPNDOSA-N 344.405 5.374 30 20 EKED C=C[C@H](CC(=O)N1CC(C)(C)[C@H]1c1cccs1)c1ccccc1 564003804 NSDJLDQRFWKUOO-DNVCBOLYSA-N 325.477 5.018 30 20 EKED C=C(C)[C@@H](NCc1ccc(SC)s1)c1ccc(F)c(F)c1 567431614 SOURTZJWUKLQPH-MRXNPFEDSA-N 325.449 5.155 30 20 EKED CCC(CC)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 569168527 STBARCMKGBGUPI-AWEZNQCLSA-N 333.501 5.123 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(Cl)c1 570067730 YRUITUZDESYGFV-BUXKBTBVSA-N 328.818 5.079 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CCc2sc(Cl)cc21 573352948 NYMKOLFIWXOQBA-DLBZAZTESA-N 342.895 5.318 30 20 EKED Cc1c([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)oc2ccccc12 594920887 BJSCIAWEVBKFSG-MRXNPFEDSA-N 330.431 5.147 30 20 EKED C[C@H](N[C@H]1CCSc2c(Cl)cccc21)c1cccc(C#N)c1 610830290 KBMYTADKCSGKOL-SJCJKPOMSA-N 328.868 5.099 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(OC(C)(C)C)cc1 619754498 BFPIFHYPLBMKMU-AWEZNQCLSA-N 342.870 5.240 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 740765658 MEWJVYPKQFQCGW-VAWYXSNFSA-N 333.456 5.631 30 20 EKED C=CC[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccncc1 766018778 IUTNWAAQLPOLAT-SJORKVTESA-N 333.262 5.283 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3F)o2)s1 790224391 BFTMZGWBSLZOPX-DAXSKMNVSA-N 341.338 5.054 30 20 EKED C=CCC[C@H](Nc1ccc(O[C@@H]2CCCC[C@@H]2O)cc1)c1ccco1 796895324 BSVGOJFUZBCDIC-IRFCIJBXSA-N 341.451 5.081 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1c(F)cccc1Cl 809159692 URTNXHHPWMVDBV-VOTSOKGWSA-N 349.839 5.560 30 20 EKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc(Cl)cc1 915043862 BPZAJMYIPLTYGH-KMKOMSMNSA-N 349.817 5.210 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)c1ccc(Cl)cc1Cl 915050959 HNYOHDMBHUCDTD-UHFFFAOYSA-N 348.155 5.243 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776370216 HHMJSXOVSHPUHT-KHPPLWFESA-N 328.795 5.058 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(CC2CCC2)c1 1776783691 DRQJOGBOPNTQMH-OAQYLSRUSA-N 345.527 5.323 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776806000 PVEQJWCQWWEHJA-YRNVUSSQSA-N 348.398 5.370 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1C(C)(C)C 120019170 ASRSPKGHXWPXNL-UHFFFAOYSA-N 347.462 5.076 30 20 EKED N#CCC[C@H](NCc1cnc(-c2cccs2)s1)c1ccccc1 130494750 AAWDIDHHFJQNPJ-INIZCTEOSA-N 339.489 5.006 30 20 EKED C[C@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(OCC#N)cc1 179960101 VYXNYDJMFQNZOX-SFHVURJKSA-N 349.478 5.142 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)s1 212108585 MTNJUYCAVFVYDK-FPLPWBNLSA-N 329.421 5.215 30 20 EKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303655444 GCRVQLFURUXBMJ-KRWDZBQOSA-N 349.478 5.320 30 20 EKED CC(C)c1nc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cs1 340447103 OZKHUOOLQBORHN-NVXWUHKLSA-N 327.497 5.352 30 20 EKED C[C@@H](c1ccc(CSCc2nc(C#N)cs2)cc1)C(F)(F)F 419518682 OAHBTYZPSWZQHT-JTQLQIEISA-N 342.411 5.114 30 20 EKED C=CCCc1ccccc1NC(=O)CCCCC(=O)c1ccccc1 504267064 XIIJSILXMGEXEY-UHFFFAOYSA-N 335.447 5.187 30 20 EKED Cc1ccccc1CCC(=O)Nc1sc(-c2ccccc2)cc1C#N 504311864 UNQCUWOZWHPUGD-UHFFFAOYSA-N 346.455 5.167 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](c1cccs1)C1CC1 505001228 QGSLGHLZQTXVTR-SFHVURJKSA-N 326.465 5.140 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1SCCC#N 513437548 NULDDFUKPXOVQW-INIZCTEOSA-N 330.497 5.237 30 20 EKED CCCCCC(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 514536693 ZLXRCIZFRKLGTM-UHFFFAOYSA-N 338.426 5.119 30 20 EKED C=CCCCCCN(C)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 523512005 CRBQCHBTKGGUAJ-CVEARBPZSA-N 339.401 5.014 30 20 EKED CCC(C)(C)OCc1cccc(NCc2cc(C#N)cs2)c1C 531163678 OVGMBFDPJJWIQI-UHFFFAOYSA-N 328.481 5.246 30 20 EKED C[C@H](NC1(c2c(Cl)cccc2Cl)CC1)c1cccc(C#N)c1 540791626 UONYNQJVKFIWFE-LBPRGKRZSA-N 331.246 5.205 30 20 EKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)s1 541626925 JYUCJZLYECXXPX-OAHLLOKOSA-N 332.900 5.444 30 20 EKED C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)C[C@H](CC#N)c2ccccc2)C1 561279920 WGOPMVJJSXDDNH-BVYCBKJFSA-N 346.474 5.074 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3cc(C#N)ccc3C)sc2c1 609149861 KIAQGXLNQBOTHA-UHFFFAOYSA-N 340.835 5.296 30 20 EKED Clc1ccc([C@@H]2CCCC2=NNc2nncc3ccccc23)cc1 741453716 UNPGQEKIMLDVLA-INIZCTEOSA-N 336.826 5.019 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(C#N)cc2)cc1 741470474 RAVKSPCNYPUUCQ-GDNBJRDFSA-N 339.394 5.130 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1ccc(-c2ccncc2)cc1 745990720 XEOVOGIVUFUYKQ-ALCCZGGFSA-N 325.820 5.360 30 20 EKED COc1cc(C(=O)/C=C/C=C\c2ccccc2)ccc1SC(F)F 746684580 SMBJVWLXFWZJBO-VTBWALSUSA-N 346.398 5.462 30 20 EKED CCc1ccc(C(=O)/C=C\c2cccc(OC)c2OC(C)C)s1 747200778 JLXWDJKRGAQYTH-LUAWRHEFSA-N 330.449 5.002 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(O)c(Cl)c1 768757745 QJLMKPIUYFBNQV-RQOWECAXSA-N 347.848 5.127 30 20 EKED N#CCCCCCC(=O)OCc1ccc(Oc2ccccc2)c(F)c1 805695596 BAFJMCMMISTWLX-UHFFFAOYSA-N 341.382 5.135 30 20 EKED N#CCCC[C@H](NC(=S)Nc1ccc(Cl)cc1)c1ccccc1 814209379 ACOLICYGINSGLC-KRWDZBQOSA-N 343.883 5.062 30 20 EKED C=CCN(Cc1ccccc1)C(=S)Nc1cccc(Cl)c1C 914601768 OQENRILQCPTURF-UHFFFAOYSA-N 330.884 5.033 30 20 EKED O=C(O)c1cccc(/C=C/C(=O)c2csc3ccccc23)c1Cl 1777685276 IVTDHXHYBWTTEZ-CMDGGOBGSA-N 342.803 5.149 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cn1ccc(=S)c2ccccc21 68616898 HXWIAMACYGVSRS-UHFFFAOYSA-N 347.487 5.111 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2cc(C#N)cs2)cc1)c1ccccc1 84283502 BSMNEADGTIGKLO-AWEZNQCLSA-N 347.443 5.045 30 20 EKED C=C1CCN(C(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)CC1 111073548 DLTBZRXREFCRSG-UHFFFAOYSA-N 342.442 5.002 30 20 EKED CC[C@H]1CCCCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 159278076 UMERCLMQMHAJDH-CVEARBPZSA-N 345.512 5.125 30 20 EKED N#Cc1csc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 177690198 LRXGQDAJLMWAAN-QGZVFWFLSA-N 344.892 5.214 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCSC(C)(C)C 189896091 PZMOKPKPQZXQBZ-UHFFFAOYSA-N 333.541 5.789 30 20 EKED FC(F)(F)c1ccccc1C=NNc1nc(-c2ccccc2)cs1 252460694 HLLIJGAEGDAOMP-UHFFFAOYSA-N 347.365 5.275 30 20 EKED C=CCOc1ccc(CN[C@@H]2CCSc3ccc(Cl)cc32)cc1 320083768 YCESMCMUCKZOMO-GOSISDBHSA-N 345.895 5.232 30 20 EKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@@H]3CCC[C@@H]3c3ccccc3)ccc21 328882568 LUOQCFXPMIPAGD-SJLPKXTDSA-N 348.446 5.207 30 20 EKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)[C@H]3CCCCC(O)=N3)c3cccc1c32 329897147 LESAQPNVBWMUDU-XYPHTWIQSA-N 340.467 5.142 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F 410377120 ZVKPQEJLFVLPLS-CABCVRRESA-N 325.374 5.112 30 20 EKED Cc1cccc(C)c1C(=O)Nc1sc2c(c1C#N)CCCCCC2 443878822 OOIAQDCUPYDMCE-UHFFFAOYSA-N 338.476 5.148 30 20 EKED C=C(C)[C@@H](NCc1cc2cc(OC)ccc2o1)c1ccc(F)c(F)c1 479405237 FWNPALQWTWCDGE-HXUWFJFHSA-N 343.373 5.127 30 20 EKED COCC[C@@H]1CCC[C@H]1N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 502413092 HRCDZGRASARRFI-FRGLQRNOSA-N 348.490 5.081 30 20 EKED C=CCCc1ccccc1NC(=O)CCC(=O)c1cc(C)ccc1C 504289325 LFBVJBIIGHQXTR-UHFFFAOYSA-N 335.447 5.024 30 20 EKED N#CC1(CCCS[C@H]2CCCCc3ccccc32)CCOCC1 507717442 XKYDOIRKBRXTKD-IBGZPJMESA-N 329.509 5.288 30 20 EKED CCN(C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 510423830 HTHIGAORSUYRMA-LBPRGKRZSA-N 347.245 5.022 30 20 EKED COc1ccc([C@@H](Nc2ccc(C#N)cc2)c2ccc(C)cc2)cc1 513197428 WBLXYRPQAOGYRM-QFIPXVFZSA-N 328.415 5.077 30 20 EKED N#CCCCCN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538321561 OMSWKPXZJZKEQL-OAHLLOKOSA-N 330.781 5.093 30 20 EKED C=CCC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1F)c1ccccc1 539045906 BZHWAQXFUVLGEO-BEFAXECRSA-N 343.442 5.201 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)cn1)c1ccc(-c2cccc(C#N)c2)cc1 543961580 XWIYARNOPIOLSO-JKSUJKDBSA-N 345.421 5.171 30 20 EKED CC(C)COc1cccc(CN[C@@H](CCCC#N)c2ccccc2)c1 552311855 FGFHERFHEDEWRA-QFIPXVFZSA-N 336.479 5.246 30 20 EKED N#CCCC[C@@H](NCCc1ccc(F)cc1Cl)c1ccccc1 577596274 YVXHNYVTNNUDSL-LJQANCHMSA-N 330.834 5.046 30 20 EKED CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1cccc(CC#N)c1 608952885 LXJHSGJBGYINBE-QFIPXVFZSA-N 348.490 5.016 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2)s1)c1cccc(C#N)c1 612572598 VUBKYKRJDMQIQW-HOTGVXAUSA-N 332.472 5.699 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(OCC(C)C)cc1 730149216 CTZBMOXJKBHYIC-FMIVXFBMSA-N 340.467 5.012 30 20 EKED COc1ccccc1-c1ccc(C=NN[C@H](C)c2ccccc2)cc1 741462162 ZBGNABFABHXEQK-QGZVFWFLSA-N 330.431 5.047 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccc(OC(F)F)cc1)c1ccncc1 766018377 HCYFRSYJSMTMKI-MSOLQXFVSA-N 332.394 5.041 30 20 EKED C/C(=C\c1ccc(C)cc1)C(=O)Nc1ccccc1SCCC#N 778717428 CQIDUOOQNHEDTL-JQIJEIRASA-N 336.460 5.043 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)NCC(C)(C)CCC#N 806198347 MRAYNYGWECIGFR-UHFFFAOYSA-N 335.451 5.114 30 20 EKED CC[C@H](C)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776698336 LJZZBQXZNWXKTF-CCNLRRDASA-N 348.442 5.501 30 20 EKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)sc1C 1776784607 PQIYYFLYGYOSLU-UHFFFAOYSA-N 339.545 5.717 30 20 EKED CCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 56745112 FIEDGTTZIRCMGO-OAHLLOKOSA-N 337.423 5.003 30 20 EKED CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 159277599 UMERCLMQMHAJDH-JKSUJKDBSA-N 345.512 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)OC1CCCCC1 189872383 GTHULDCMRBKBTJ-FQEVSTJZSA-N 343.511 5.605 30 20 EKED CC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(Cl)c1 192970316 ZPELXWNRSVJFGI-KUHUBIRLSA-N 328.843 5.044 30 20 EKED C[C@H](Nc1ccccc1SCC(F)(F)F)c1cccc(C#N)c1 319837390 RSLJCYFPUKGVLK-LBPRGKRZSA-N 336.382 5.386 30 20 EKED CC[C@H](C)n1ncc(N=C(O)N2CC(C)(C)CC(C)(C)C2)c1C1CC1 329847800 RDYUJSKPHCEMAZ-AWEZNQCLSA-N 346.519 5.035 30 20 EKED N#Cc1c(F)cccc1CN(Cc1cccs1)Cc1cccs1 428452672 CRGHIVPLQHLBKN-UHFFFAOYSA-N 342.464 5.023 30 20 EKED CC(C)(C#N)CCCSCc1cccc(OCC(F)(F)F)c1 480391432 AVAJURUQZQGWRN-UHFFFAOYSA-N 331.403 5.191 30 20 EKED Cc1ccccc1COc1cccc(NCc2ccc(C#N)cc2F)c1 484694964 QPTNKQWSRLWCKD-UHFFFAOYSA-N 346.405 5.197 30 20 EKED C[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccc(C#N)cc1 497245751 GUPJPYDNGXKUDM-JTQLQIEISA-N 349.768 5.032 30 20 EKED CN(Cc1ccc(C#N)cc1)Cc1sc2ccccc2c1Cl 506138306 WFUTYOQALQLAJF-UHFFFAOYSA-N 326.852 5.058 30 20 EKED CC(C)Sc1ccc(CSCCCC2(C#N)CCOCC2)cc1 512332075 NKMNJXVVKREEAP-UHFFFAOYSA-N 349.565 5.521 30 20 EKED N#CCC[C@@H](NCc1cnc(C2CCCCC2)s1)c1ccccc1 533360373 IHQDEMNABOWHEB-LJQANCHMSA-N 339.508 5.325 30 20 EKED CCc1cnc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541382613 AGULJYICPWIKOE-HNNXBMFYSA-N 347.487 5.095 30 20 EKED C=CCCCC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 543297462 JYYMYWFJKMCIKS-GGAORHGYSA-N 349.474 5.109 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 550829417 FXEAIYWWCLMYJV-LIRRHRJNSA-N 330.834 5.565 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594058614 KNUAPHOGQBFHEJ-UHFFFAOYSA-N 347.462 5.191 30 20 EKED N#CCC[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1 749036588 YIPCJTFOOCROFZ-JOCHJYFZSA-N 340.426 5.128 30 20 EKED Cc1ccc(C)c2c1CC/C(=C\c1csc(-c3ccccn3)n1)C2=O 769746754 LRAMMFWJWPTNND-RVDMUPIBSA-N 346.455 5.034 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2cc3cccc(C)c3s2)cc1 813427826 MSQXDBIVZFDASQ-UHFFFAOYSA-N 334.444 5.079 30 20 EKED CCCCCOc1ccc(/C=C/C(=O)c2ccc(OCC#N)cc2)cc1 916152080 OXAWEWJEPFVXGG-VGOFMYFVSA-N 349.430 5.054 30 20 EKED Cc1nn(C)cc1C(=O)/C=C\c1ccc(-c2ccc(Cl)cc2)s1 917520662 WGYJMKADJFQDSR-CLFYSBASSA-N 342.851 5.007 30 20 EKED O=C(/C=C/c1ccc(C(=O)O)s1)c1ccc(C2CCCCC2)cc1 1777569664 BOYCGJNFBMFPJG-ZRDIBKRKSA-N 340.444 5.390 30 20 EKED CC(C)C[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 109028022 CFVHEAAXBBXMQO-HZPDHXFCSA-N 345.512 5.123 30 20 EKED CC(C)c1nccn1Cc1cccc(N[C@@H](C)c2cccc(C#N)c2)c1 179925109 GPWPPMVRUXMLEN-KRWDZBQOSA-N 344.462 5.100 30 20 EKED Cc1cccc(/N=C2\N=C(O)/C(=C\C3=Cc4ccccc4OC3)S2)c1 206402433 FWNQSSDYJLNVLS-WOJGMQOQSA-N 348.427 5.046 30 20 EKED CC(C)COc1ccccc1[C@H](CC(C)C)NCc1ccc(C#N)o1 236660922 PARIQUSKYBHUEY-FQEVSTJZSA-N 340.467 5.063 30 20 EKED Cc1cccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 303287258 AJWUZZVDMMOLSQ-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C[C@H](Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(C#N)cc1 439559510 ACLUVCZJBQLDFL-INIZCTEOSA-N 346.405 5.449 30 20 EKED C=CCCCC(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 480892446 APTXNYJNUUEHFN-MRXNPFEDSA-N 325.374 5.115 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1ccccc1)C(C)(C)C 503386416 UFXKMGLLJJHOGA-GOSISDBHSA-N 342.508 5.233 30 20 EKED C[C@@H](NC(=O)Nc1ccccc1-c1ccccc1)c1ccc(C#N)cc1 505320438 XGRLRJWJPOJQIY-MRXNPFEDSA-N 341.414 5.108 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cc2sccc2s1 517441379 XYJUCWLARGCRBW-UHFFFAOYSA-N 344.486 5.221 30 20 EKED C=C[C@H](CC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1)c1ccccc1 536182900 RDAGAUWIJRHXDX-CSODHUTKSA-N 337.438 5.095 30 20 EKED CC(C)c1ccc(Cc2noc(C[C@H](CC#N)c3ccccc3)n2)cc1 554792663 KWABOSVSHSJWOI-FQEVSTJZSA-N 345.446 5.024 30 20 EKED COCc1ccccc1/C=C(/C)CN[C@@H](CCCC#N)c1ccccc1 556908326 MACVMUASRCJUED-NMJXDZPISA-N 348.490 5.261 30 20 EKED C=CCC[C@@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccco1 560545435 VLQUSINXSXGNDY-SJORKVTESA-N 329.415 5.318 30 20 EKED CC[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 561129866 CKWINSOJHJBVOA-HOTGVXAUSA-N 330.884 5.391 30 20 EKED N#Cc1c(N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cccc1C(F)F 572687360 YWEZMPRBYPCZTE-DLBZAZTESA-N 348.780 5.091 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C(F)(F)F)c1cccc(C#N)c1 600850557 CQRRGBSMRUYVSG-QWHCGFSZSA-N 334.341 5.061 30 20 EKED COc1cc(-c2ccccc2)ccc1CN[C@@H](C)c1cccc(C#N)c1 611585611 YHYBCXHRSOHKMO-KRWDZBQOSA-N 342.442 5.085 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1Cl 619754915 OLJAQGRJDJGORH-SFHVURJKSA-N 331.246 5.106 30 20 EKED C=CCC[C@@H](N[C@H](C)c1c[nH]nc1C)c1ccc(C(F)(F)F)cc1 679357088 VMRPKACUUPSAOV-SJKOYZFVSA-N 337.389 5.095 30 20 EKED CC[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1nc(C)cs1 729641792 XSYOFSLHTYZXSV-SQFMLPEHSA-N 329.252 5.034 30 20 EKED C#CCCOc1ccc(CN[C@H](C)c2cccc3ccccc23)cc1 733322791 DKQZTATWADJNCC-GOSISDBHSA-N 329.443 5.093 30 20 EKED CCCCC[C@@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 742648753 AZHTYQYWGJRBLS-HZPDHXFCSA-N 332.513 5.483 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3cnc(-c4ccncc4)s3)oc2c1 754823631 DMKAHZUIDDERPK-PLNGDYQASA-N 346.411 5.156 30 20 EKED C#CC[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 773117332 VJKXBJYYAQRRLA-ROUUACIJSA-N 327.880 5.231 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCCC3(C)C)n2)cc1 773982090 DGXGQEHYHPKQRL-HZPDHXFCSA-N 338.476 5.121 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(SC(F)F)cc1 777250516 QTXQTBBERDRNGK-ZDUSSCGKSA-N 344.430 5.213 30 20 EKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1csc2ccccc12 793445155 OGICYIYJLJFVIM-AWEZNQCLSA-N 348.471 5.193 30 20 EKED C=CC[C@@H](N[C@@H](C)CC(C)(C)c1c[nH]c2ccccc12)c1ccncc1 812716697 PFCRBSGNQOVCIQ-LAUBAEHRSA-N 347.506 5.526 30 20 EKED C[C@H](Nc1ccccc1COC(C)(C)C)c1ccc(OCC#N)cc1 903293551 LDHDERVZMLCERQ-INIZCTEOSA-N 338.451 5.077 30 20 EKED O=C1/C(=C\c2ccc3ncccc3c2)CCc2[nH]c3ccc(F)cc3c21 914558532 ZGHDAFFVUMEOCE-PTNGSMBKSA-N 342.373 5.068 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc([C@H](C)CC)cc1 1776784306 STISTECVKFCCFS-YLJYHZDGSA-N 333.516 5.494 30 20 EKED CC(C)c1ccc([C@H](/N=C(/O)C[C@@H]2CCCC(O)=N2)C(C)C)cc1 329263413 BRCIYWNRQLKWHD-FXAWDEMLSA-N 330.472 5.363 30 20 EKED COc1cc(Cl)ccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 421855924 NISGUBIEZQDNSX-HNAYVOBHSA-N 342.870 5.434 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1CCC(C)(C)CC1 438049822 QXCXXMRSXHFPNV-CQSZACIVSA-N 345.512 5.029 30 20 EKED Cc1oc(C#N)cc1C(=O)N(c1ccc2[nH]ccc2c1)[C@@H](C)CC(C)C 439089933 JXQHVVXYWDFRJC-AWEZNQCLSA-N 349.434 5.022 30 20 EKED C#C[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(F)cc1 491538188 XIBMWPLNFMKNPI-OAQYLSRUSA-N 344.389 5.048 30 20 EKED C[C@H](NC(=O)C1(C#N)CCCCC1)c1ccccc1Oc1ccccc1 506190074 MDJKSCPLLMJZMS-KRWDZBQOSA-N 348.446 5.130 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1OCCCC 511614817 RRUNINWJDBEZGY-UHFFFAOYSA-N 344.480 5.147 30 20 EKED C[C@H](CCc1c(F)cccc1F)N[C@@H](CCCC#N)c1ccccc1 551222459 LJJJLDDPLLZBDY-IERDGZPVSA-N 342.433 5.311 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cncc(Br)c1)c1ccccc1 578643983 IVKSDPZWBZRGRZ-RDTXWAMCSA-N 345.284 5.202 30 20 EKED CC(C)(CCC#N)CN[C@H](c1ccc(Cl)c(Cl)c1)C1CC1 581625342 CQUWFBPVGMXPLI-INIZCTEOSA-N 325.283 5.364 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 582501794 IFWSPJSOMWHJFO-VBNZEHGJSA-N 342.895 5.044 30 20 EKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc2ccccc12 594929302 UWDPLFYRVNIWFS-QGZVFWFLSA-N 326.443 5.246 30 20 EKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1 609826181 ZHTNSHQGYBPAMG-STQMWFEESA-N 344.867 5.033 30 20 EKED CC(C)(C#N)c1ccc(CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1 614174042 GAIPJWKEVCOCGL-OAQYLSRUSA-N 336.454 5.258 30 20 EKED Cc1cc2cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)oc2cc1C 682127842 PNPGHYYFHFKHID-QGZVFWFLSA-N 340.382 5.088 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2ccccc2s1 733679580 BLLCRHDMMHUQEX-CVEARBPZSA-N 340.492 5.469 30 20 EKED C=CCN(C(=O)Nc1cccc(CSC2CCCC2)c1)C(C)C 741072506 VFXYJOMMRPLAIH-UHFFFAOYSA-N 332.513 5.291 30 20 EKED C=C[C@@H](CC(=O)OCc1nc(-c2ccccc2)oc1C)c1ccccc1 758911592 JRMMJKQTHVRIKU-KRWDZBQOSA-N 347.414 5.053 30 20 EKED CCOc1c(Cl)cccc1C=NOc1ccccc1C(F)(F)F 782255522 SZLORBIAROKJNX-UHFFFAOYSA-N 343.732 5.170 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1ccc(F)cc1 789721311 ZOVFRXGBFNYWNK-PEZBUJJGSA-N 337.438 5.720 30 20 EKED CC(=NNc1nc2cc(Cl)ccc2cc1C)c1coc(C(C)C)n1 799486110 YMZVHWOHQXUIEA-UHFFFAOYSA-N 342.830 5.144 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccc2c(c1)oc1ccccc12 806208147 HHQAZGPHDSSITN-UHFFFAOYSA-N 335.407 5.037 30 20 EKED Cc1ccc(NCCCC2(C#N)CCOCC2)cc1-c1ccsc1 871869918 DFKJIGLSPGPATC-UHFFFAOYSA-N 340.492 5.236 30 20 EKED O=C(/C=C/c1cccc(Cl)c1)c1sccc1Br 915113736 TZZGAXZFNOAUOM-SNAWJCMRSA-N 327.630 5.060 30 20 EKED O=C(/C=C/c1csc(C(=O)O)c1)c1ccc(-c2ccccc2)cc1 1776131058 GEEGBRJSWJQRPX-IZZDOVSWSA-N 334.396 5.009 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1cccc(C#N)c1 177391389 LJENSLQFDXEKJN-OPAMFIHVSA-N 330.406 5.138 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C#N)cc1 189972886 MPHMEWHYVSLVIE-UHFFFAOYSA-N 349.478 5.298 30 20 EKED Cc1nc(S[C@H](C)c2ccc(C#N)cc2)c2c(C)c(C)sc2n1 303646550 ABWWGAWYBHJIGD-GFCCVEGCSA-N 339.489 5.342 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@@H]3CCC(=O)C[C@@H]3C)n2)s1 328909063 DKEQNLBQXWQIKY-GXFFZTMASA-N 348.493 5.027 30 20 EKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)Nc1ccc(C(C)C)cc1C(C)C 436314669 YZSDSAZIWNVDGU-PXNSSMCTSA-N 344.499 5.036 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2cc3ccccc3o2)C1 463301040 MBIJUTOJFKORHK-WVBUVRCRSA-N 330.431 5.194 30 20 EKED CC(C)c1ccc2c(c1)[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)CC2 476876660 HSOOHBSQSXNUSP-IFMALSPDSA-N 346.474 5.001 30 20 EKED N#C[C@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nccc2ccccc12 483204309 XFWACSGLRSNEHD-AWEZNQCLSA-N 341.197 5.032 30 20 EKED N#CCCC[C@H](NC(=O)CCCC1CCCCC1)c1ccccc1 487245411 XWVRDVKWQXDCGW-FQEVSTJZSA-N 326.484 5.288 30 20 EKED Cc1c(C(=O)N2CCCC23CCCCC3)sc2ccc(C#N)cc12 491429495 AFOAPWBSSDVPEP-UHFFFAOYSA-N 338.476 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)cc(OC)c1 506045585 HFLCGGKLSAJXRB-UHFFFAOYSA-N 343.854 5.453 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC(F)(F)F)cc1 513647225 GWNZCRTVWUXVKX-FZKQIMNGSA-N 348.368 5.259 30 20 EKED Cc1cc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c(C)c1 520171015 DGMSVDAKHAOMBQ-UHFFFAOYSA-N 349.478 5.174 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCC1CCCC1 521811144 VISGLWRLELGYCT-OAHLLOKOSA-N 345.512 5.173 30 20 EKED Cc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 540313313 GSMHKSDFKCNXFR-INIZCTEOSA-N 332.472 5.446 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4Cl)o3)CC2)c1 560072277 SRERTUJKECEGFD-UHFFFAOYSA-N 348.833 5.251 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1c(F)cccc1Cl 561403869 PQWHCTUEAKHIDU-LBPRGKRZSA-N 334.847 5.485 30 20 EKED CCSc1ccccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 565764205 XUXMEBNRVDUHEC-XLIONFOSSA-N 338.520 5.884 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1nccc2ccccc12 577431489 ZMLBJCSSPHIMCG-MRXNPFEDSA-N 331.419 5.090 30 20 EKED N#Cc1c(NCc2cccc(C(F)(F)F)c2)cccc1C(F)F 583842535 YHQNHHBNZBXKJF-UHFFFAOYSA-N 326.268 5.127 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 591513058 FKNZHUGBMCEEBA-UHFFFAOYSA-N 330.378 5.062 30 20 EKED COc1ccc2cc([C@H](C)N[C@H](C)c3cccc(C#N)c3)ccc2c1 610343451 HOJHMPGVYRJPIM-CVEARBPZSA-N 330.431 5.132 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CCCCCC3)n2)cc1 726321307 FSBFHKYIUJIFJX-QGZVFWFLSA-N 338.476 5.265 30 20 EKED CC(C)(C)OC(=O)Nc1ccc(N=Cc2cc(Cl)ccc2O)cc1 729150129 SUEKZGDLQMIRLO-UHFFFAOYSA-N 346.814 5.143 30 20 EKED COc1ccc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1F 734982095 WTBMPUCSTYMCQP-ALCCZGGFSA-N 325.166 5.037 30 20 EKED CCCCCC[C@@H](C)NN=C1CCC(C#N)(c2ccccc2)CC1 743450964 VOQJUPLNEDBSTM-ITUIMRKVSA-N 325.500 5.326 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCCC1 749346434 JJUBBLSDKBHOKW-IIBYNOLFSA-N 332.447 5.107 30 20 EKED C=CC[C@@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccncc1 760332250 YILLTESRLIXJFB-IAGOWNOFSA-N 333.262 5.283 30 20 EKED C#CCCCCC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 773299436 YCGSDMQJNYBYHC-SFHVURJKSA-N 335.447 5.267 30 20 EKED N#Cc1cccc(CN[C@@H]2CCCc3cc(SC(F)F)ccc32)c1 775372133 YRWNLEGIOCGDHP-GOSISDBHSA-N 344.430 5.040 30 20 EKED CCCCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 776155206 DCBCJHGJSUMKAK-AVRDEDQJSA-N 336.479 5.561 30 20 EKED CC1CCN(c2ccc(N[C@@H](C)c3ccc(C#N)cc3F)cc2)CC1 781423448 VSWIDIQAGVWAGI-INIZCTEOSA-N 337.442 5.107 30 20 EKED C/C(=C\c1ccc(C)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567834 MRTLNRBRQBVWFK-HFQYIWAZSA-N 338.476 5.029 30 20 EKED N#CCCC[C@@H](NCc1ccc(N2CCCCC2)cc1)c1ccccc1 814304099 FUGZZJBZRXPRKB-HSZRJFAPSA-N 347.506 5.202 30 20 EKED N#C[C@H](C(=O)/C(F)=C/C1CCCCC1)c1nc2cc(F)ccc2s1 815941691 KVMBISYJCSRXFO-HRYODUOUSA-N 346.402 5.045 30 20 EKED O=C(/C=C/c1cn(C2CCCC2)nc1-c1ccccn1)c1cccs1 840712273 IDSRZHBMTIYAHN-ZHACJKMWSA-N 349.459 5.018 30 20 EKED COc1ccc(C(=O)/C=C/c2cccc(OC3CCCC3)c2)c(F)c1 917516357 ULAJLFZBYLPIDA-FMIVXFBMSA-N 340.394 5.052 30 20 EKED C=CCn1c(S[C@H](C)c2cccc(F)c2)nnc1-c1ccoc1C 59832597 DEWOBNPQRSWRIM-CYBMUJFWSA-N 343.427 5.025 30 20 EKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 179635853 MKKLYVUBWLEEFF-LJQANCHMSA-N 328.406 5.007 30 20 EKED C[C@@H](Nc1cccc(NC(=O)C2CCCCC2)c1)c1cccc(C#N)c1 180028440 VHFGRKGNMCSSCF-MRXNPFEDSA-N 347.462 5.250 30 20 EKED Cc1sc([C@H](C)NCCCCC#N)nc1-c1ccc(Cl)cc1 184946679 KCSIMOKVTSZVLP-LBPRGKRZSA-N 333.888 5.116 30 20 EKED CCOc1cccc2cc([C@H](C)Nc3cc(C(C)=O)ccc3C#N)oc12 302135235 ZQRSBNDWVIDXCL-ZDUSSCGKSA-N 348.402 5.079 30 20 EKED C[C@H](SCc1ccc(Oc2ccccc2)nn1)c1cccc(C#N)c1 443138720 XREICAJYXHULSX-HNNXBMFYSA-N 347.443 5.135 30 20 EKED CC[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 447573956 JYBXYYRSXWLAAT-DHIUTWEWSA-N 344.433 5.528 30 20 EKED C[C@@H](N[C@H]1CCCc2occc21)c1ccc(-c2cccc(C#N)c2)cc1 447593277 QUQBDWVBROWMKT-ZHRRBRCNSA-N 342.442 5.546 30 20 EKED N#CC[C@H](CC(=O)N1CCCC2(CCCCC2)CC1)c1ccccc1 476938912 ITKWUFHUAOGBQD-HXUWFJFHSA-N 338.495 5.037 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccc2s1 500306021 MRYLSGJMXOWHNU-UHFFFAOYSA-N 348.471 5.071 30 20 EKED CC(C)c1ccc([C@@H](NC(=O)c2cccc(CC#N)c2)C(C)C)cc1 514431706 KRVDFPFHNGQSHI-NRFANRHFSA-N 334.463 5.003 30 20 EKED CCN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CCCCC1 523140479 TZFDYLJZTDKCGV-UHFFFAOYSA-N 347.462 5.097 30 20 EKED N#Cc1c(F)cccc1Oc1ncnc2scc(-c3ccccc3)c12 533675983 PLESQBPJPIZFEI-UHFFFAOYSA-N 347.374 5.161 30 20 EKED C=C[C@@H](CC(=O)Nc1cccnc1-c1ccccc1)c1ccccc1 533999198 JUEVABLQOFPZFK-KRWDZBQOSA-N 328.415 5.047 30 20 EKED C=C[C@@H](CC(=O)N(Cc1cscn1)c1ccccc1)c1ccccc1 535472914 YAUQDGJDQYIOPY-KRWDZBQOSA-N 348.471 5.036 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc3ccccc3c2)o1 538404221 DEYGBJOTOKEDMW-HSZRJFAPSA-N 338.410 5.184 30 20 EKED C=CCC[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccco1 552282886 QQTDOAMLDUOWMO-GOSISDBHSA-N 334.419 5.931 30 20 EKED C=CCOc1ccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)cc1 556093710 NYJNARPKPSGMCR-UHFFFAOYSA-N 349.396 5.295 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)CC2 581161252 QVUSJMRUJQSCRZ-GOTSBHOMSA-N 342.417 5.064 30 20 EKED N#CC1(Cc2nc(CSc3ccc(Cl)cc3)no2)CCCCC1 596580601 ZINJOKDQCYXULU-UHFFFAOYSA-N 347.871 5.032 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2ccccc2F)n1 603748183 DMNBPQCOTQBNFK-JTQLQIEISA-N 340.345 5.273 30 20 EKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1(C)C 609376736 IWFQWNPEXYYPOO-DAYGRLMNSA-N 342.508 5.115 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(Br)c1 610830280 KAOCDGQRPZVATR-ACJLOTCBSA-N 343.268 5.123 30 20 EKED CC(CSC(C)(C)C)=NNc1nc(Cl)c(Cl)cc1Cl 729636365 ZVGOEHQESVWOII-UHFFFAOYSA-N 340.707 5.361 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc2cccc(OCC)c2o1)c1ccncc1 776155824 IWLHGRUZCVJCKK-MAUKXSAKSA-N 336.435 5.195 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 788595548 KTJYEACJQODLLC-XDQVBPFNSA-N 346.883 5.296 30 20 EKED CCCCCCCOc1cccc(CNC(C)(C)C[C@H](C)C(=O)O)c1 1776788067 NZAGPFBIOWOXJH-KRWDZBQOSA-N 349.515 5.015 30 20 EKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1C 7276448 FXJXEWLQTNTTAR-UHFFFAOYSA-N 326.399 5.094 30 20 EKED C=C(C)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 58044345 WUAGPMDGBGWKGH-UHFFFAOYSA-N 333.888 5.382 30 20 EKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 90664585 IAPTZIOTMPMNFX-MSOLQXFVSA-N 344.405 5.374 30 20 EKED CC(C)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1Cl 115619940 IKSKMNNUWRSADF-MGPUTAFESA-N 342.870 5.118 30 20 EKED Cc1ccc(-c2ncc(CNc3ccccc3O[C@H](C)C#N)s2)cc1 181128245 ZOHHXMZDYIOWBJ-OAHLLOKOSA-N 349.459 5.022 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)NCCCC(C)(C)C#N)s2)cc1 184539749 NFBQDQJEOCJZOU-OAHLLOKOSA-N 341.524 5.408 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc2ccccc12 192943503 LOWUYDQBXUGKPK-SJORKVTESA-N 330.431 5.154 30 20 EKED CC(C)(C)n1ncnc1C/N=C(/O)C1(C2CCCCC2)CCCCC1 328643383 AICVLIJTIVTAKS-UHFFFAOYSA-N 346.519 5.020 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 340443205 FMLFIBIZQQOUOI-YJBOKZPZSA-N 341.524 5.661 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(CSC(C)C)c1C 488485667 MVODYVWVQADVIB-KRWDZBQOSA-N 332.513 5.209 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2ccccc2n1 508893113 ZOWXRLGVFIDMKK-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 536196699 HAXUALMHMGGXCM-QGZVFWFLSA-N 344.414 5.172 30 20 EKED CSc1ccc(Cl)cc1NCc1cccc(OCCCC#N)c1 538834687 MUPKEYYOCBHTFE-UHFFFAOYSA-N 346.883 5.357 30 20 EKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)c(F)c1 539609522 JDWWVTFUVUZIMR-PXAZEXFGSA-N 336.332 5.042 30 20 EKED CCCC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(OC)cc1 539610284 TYFPSBJAIBKHLC-QVKFZJNVSA-N 340.442 5.288 30 20 EKED Cc1ccc2[nH]c(CN[C@@H](CCCC#N)c3ccccc3)cc2c1C 552082860 GGGMNRJZPAZIKK-NRFANRHFSA-N 331.463 5.310 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cc(C)on1)c1ccc(C(F)(F)F)cc1 569654116 YZELVQHMODXYJE-BBRMVZONSA-N 338.373 5.360 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@]2(C#N)C[C@H]2C)cc1 590675853 CJZVYEWIGGWKGL-SIFCLUCFSA-N 336.460 5.028 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)F)nc1 595038133 JOGKHLDPORBXEZ-PBHICJAKSA-N 329.394 5.105 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C2CC2)cc1 597186826 LTIULSVPWQQXIM-AWEZNQCLSA-N 336.460 5.211 30 20 EKED CCCC[C@@H](CC)CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609435449 OOWJGOHXCAQZJA-HZPDHXFCSA-N 347.528 5.419 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(Cl)ccc1C(C)(C)C 667037863 NBQNRQBRZWBWOJ-GASCZTMLSA-N 332.875 5.352 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cccc(OCCCC#N)c1 726743873 RZQZIFRQMPMINH-QXMHVHEDSA-N 344.414 5.055 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1cnc(C(C)(C)C)s1 742437325 STUPRMVTRHVDDV-PPLKPFPSSA-N 335.519 5.263 30 20 EKED Cc1c(C(=O)/C=C\c2coc(-c3ccccc3)n2)oc2ccccc12 749892225 UAWAAMCELOAKGQ-QXMHVHEDSA-N 329.355 5.292 30 20 EKED CC[C@@H]1CCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 757196981 CDMRVEFLQJUEGS-MAODMQOUSA-N 347.462 5.042 30 20 EKED Clc1scc(C=NNc2nccc3sccc23)c1Cl 761783487 ZEDVDEXSEBRPAR-UHFFFAOYSA-N 328.249 5.111 30 20 EKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1ccc(O)c(Cl)c1 768753546 YHJBPHUXNJZFRP-HJWRWDBZSA-N 341.819 5.065 30 20 EKED C=C(Cl)COc1ccc([C@H](C)Nc2cccc(COC)c2)cc1 776837641 WAUHSJQISJAERC-HNNXBMFYSA-N 331.843 5.137 30 20 EKED CC[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(F)cc1F 795994359 WQVNLQBAXDMGRG-BEFAXECRSA-N 343.373 5.047 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)c1ccncc1 873832936 UTRUXVUVYWZSKX-ALCCZGGFSA-N 325.820 5.360 30 20 EKED COc1cccc(-c2nc(/C=C/C(=O)c3ccccc3C)cs2)c1 916155975 SVEJMWAHCURNIH-ZHACJKMWSA-N 335.428 5.023 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Br)cc1 37284435 SBCTXRUKVOTQAR-ACJLOTCBSA-N 343.268 5.123 30 20 EKED C=CCc1ccc(OCc2csc(-c3cccs3)n2)c(OC)c1 60804519 UAGRBXZKGULXAT-UHFFFAOYSA-N 343.473 5.188 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)s1 176955116 VJKNHLCSOWXVSM-KRWDZBQOSA-N 344.892 5.214 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1sccc1C 189884390 HTSNQEVUSUZQLE-QZTJIDSGSA-N 339.504 5.651 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)s1 193931484 PSDWXEQIFRWMQO-UHFFFAOYSA-N 333.884 5.435 30 20 EKED C[C@@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccsc2S1 340450301 MDNRCZHJYVSMCT-JLSDUUJJSA-N 342.533 5.698 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1F 512641643 JBSAMKAVOINDBW-BUXKBTBVSA-N 346.396 5.414 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1cccc(CSC2CCCCC2)c1 512728905 OETUMOXQUVHJFO-LJQANCHMSA-N 330.497 5.131 30 20 EKED C=CCCCCCN(C)C(=O)c1ccccc1OCc1cccs1 523511096 UCPMJPSOIJXJFG-UHFFFAOYSA-N 343.492 5.146 30 20 EKED CC[C@H](C)Sc1ccc(NCCCC2(C#N)CCOCC2)c(C)c1 538610055 LRKOAVWMTNHQIJ-KRWDZBQOSA-N 346.540 5.398 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)cn1)c1ccc(-c2cccc(C#N)c2)cc1 543961578 XWIYARNOPIOLSO-HOTGVXAUSA-N 345.421 5.171 30 20 EKED CC(C)(C)c1ccc(CCCC(=O)Nc2ccccc2CC#N)cc1 564161619 TWRSRBZEFNHMAX-UHFFFAOYSA-N 334.463 5.012 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 576057006 DYHSSXSUQJAKOU-HNAYVOBHSA-N 346.396 5.791 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N1Cc2ccc(C#N)cc2C1 594096021 NLPCHFSVWPAWMH-UHFFFAOYSA-N 347.462 5.182 30 20 EKED C[C@@H](Nc1ccccc1O[C@H](C)C(F)(F)F)c1cccc(C#N)c1 600850553 CQRRGBSMRUYVSG-CHWSQXEVSA-N 334.341 5.061 30 20 EKED CN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1-c1ccccc1 614476180 ZVAWOFDOOXSCOS-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@@H](OC(C)(C)C)C1 646374567 MYLHQZSEGPVCJB-CALCHBBNSA-N 344.499 5.006 30 20 EKED C=CCN(C(=O)Nc1ccc(OCc2ccccc2)cc1C)C(C)C 735367862 DBTOZKKSNPPDOD-UHFFFAOYSA-N 338.451 5.002 30 20 EKED C=CCOc1cccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741471619 CDFGZHPKPAFJPW-KTKRTIGZSA-N 341.410 5.210 30 20 EKED C#CCC(C)(C)C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1 767091027 HJIPPDUVOJRETO-UHFFFAOYSA-N 344.414 5.015 30 20 EKED O=C(/C=C\c1cscc1Cl)c1cccc(-c2ccncc2)c1 771861014 UPSOLCMCJJEBGZ-PLNGDYQASA-N 325.820 5.360 30 20 EKED Cc1nc(F)ccc1/C=C/C(=O)c1ccc(Cl)c(C(F)(F)F)c1 782348135 PVABCJCPOXALFO-ZZXKWVIFSA-N 343.707 5.097 30 20 EKED Cc1cc(Cl)cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1O 815635617 GLKBWXTVWHXJSS-KXBFYZLASA-N 342.870 5.440 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c(C)c1 1776133374 VIHDYZDMJHTOPF-DAXSKMNVSA-N 336.412 5.112 30 20 EKED C=C[C@@H](CC(=O)N(c1ccccc1)c1nc(C)cs1)c1ccccc1 179882853 SULNYQMLJIYFPA-KRWDZBQOSA-N 348.471 5.476 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cnc2ccccc2c1 189902704 KMPPKJIBXHDTMJ-UHFFFAOYSA-N 344.458 5.268 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@H](C)c2cccc(C#N)c2)o1 237417850 BKGXFBAYGHWVNN-OAHLLOKOSA-N 334.394 5.117 30 20 EKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(C#N)c1 442790985 HXMRVNOZIQZYBV-INIZCTEOSA-N 339.398 5.395 30 20 EKED CC[C@H](NCc1ccccc1OC1CCCC1)c1ccc(C#N)cc1 447542663 PKJSDOPLFGYQIF-NRFANRHFSA-N 334.463 5.121 30 20 EKED N#Cc1cc(F)ccc1CN(Cc1cccs1)Cc1cccs1 489567948 QMVPLCPUAYJLDP-UHFFFAOYSA-N 342.464 5.023 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2sccc2[C@H]1CC 505016243 DJZNACKTZNAVEX-GOSISDBHSA-N 340.492 5.408 30 20 EKED C[C@H](Nc1ccc2nc(C(F)F)sc2c1)c1ccc(C#N)cc1 507250807 DDVDRJQGRSQRKY-JTQLQIEISA-N 329.375 5.279 30 20 EKED C=C(C)CN(CC)C(=O)c1oc2cc(OC)ccc2c1-c1ccccc1 512663498 MMNDKAULKCWVIV-UHFFFAOYSA-N 349.430 5.147 30 20 EKED CCC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 514514380 IZDUPMIRILPVIP-IBGZPJMESA-N 335.451 5.151 30 20 EKED C[C@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccc(C#N)cc1 532465918 VQMRVTHVYSJOKJ-YVEFUNNKSA-N 328.868 5.099 30 20 EKED COc1ccc2cc(CN[C@@H](CCCC#N)c3ccccc3)ccc2c1 552311982 KQMWXVTZSMBMEJ-QHCPKHFHSA-N 344.458 5.373 30 20 EKED N#Cc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)cc1 580980886 GHRFCHUBNCHBOE-SFHVURJKSA-N 331.246 5.106 30 20 EKED CC(C)(CCC#N)CN[C@@H](c1ccc(Cl)c(Cl)c1)C1CC1 581625343 CQUWFBPVGMXPLI-MRXNPFEDSA-N 325.283 5.364 30 20 EKED N#Cc1ccc(Oc2nc(C(F)F)nc3ccc(F)cc23)c(Cl)c1 590571082 BYMGGSVIVIRUKO-UHFFFAOYSA-N 349.699 5.024 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)CC1 601168559 NVRJRTVWURFRDJ-UHFFFAOYSA-N 342.389 5.062 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 606813989 GCGXBMAEAPIPAN-DLBZAZTESA-N 339.401 5.014 30 20 EKED CCCCSCCC(=O)Nc1sc(-c2ccccc2)cc1C#N 610040643 CLZWBJYHORNSMD-UHFFFAOYSA-N 344.505 5.149 30 20 EKED C=CCC[C@@H](N[C@@H]1CCCn2ccnc21)c1ccc(C(F)(F)F)cc1 655734470 JAUHJQWYDHDOAU-IAGOWNOFSA-N 349.400 5.034 30 20 EKED C=CCN(C(=O)N[C@H](c1oc2ccccc2c1C)C(C)C)C(C)C 732705098 PYAIDNPZPGFNNC-SFHVURJKSA-N 328.456 5.044 30 20 EKED Cc1ncsc1C(=O)/C=C\c1cc(Cl)cc(C(F)(F)F)c1 780186681 LOTZSBSBMMEINQ-IHWYPQMZSA-N 331.746 5.020 30 20 EKED COc1cc(NN=CC2CCC(C(F)(F)F)CC2)ccc1Cl 788472374 UABYCTJUFPCCQB-UHFFFAOYSA-N 334.769 5.115 30 20 EKED C=CC[C@@H](NC[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 809621198 WVWFUDCPSWIMEZ-RDTXWAMCSA-N 334.385 5.111 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 915086982 OLTXIIIKGAAQIF-JOCHJYFZSA-N 340.426 5.211 30 20 EKED C[C@@H]1CCN(C(=O)Nc2ccc(C#N)cc2C2CC2)[C@@H](c2ccco2)C1 933846566 DCJSKPXLMPPCQN-AUUYWEPGSA-N 349.434 5.034 30 20 EKED O=C(O)Cc1ccc(NN=C2CCCCCCCCCCC2)cc1 1776083461 HXECBPMJXPPGFF-UHFFFAOYSA-N 330.472 5.386 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 90664940 HUUTWZVLPTVYKW-KDOFPFPSSA-N 332.369 5.401 30 20 EKED C[C@H]1C[C@H](Nc2cccc(OCCCC#N)c2)c2ccsc2S1 120860556 POTCBFQEDGAUKK-GUYCJALGSA-N 344.505 5.468 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C1CCCC1)C1CC1 175855239 VUKBGNMSCUJOJA-CQSZACIVSA-N 343.496 5.020 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1ccc(O)c(Cl)c1 207716289 QAQPAAPBGNQACI-VURMDHGXSA-N 335.856 5.004 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccccc2)C2CC2)cc1Cl 303228089 XFWFSHXFSBVRTC-FQEVSTJZSA-N 327.855 5.146 30 20 EKED Cc1c(C(=O)Nc2ccc(F)c(C#N)c2)oc2c1ccc1ccccc12 303234768 YWWJLLIKGPUDKM-UHFFFAOYSA-N 344.345 5.158 30 20 EKED CCCOc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 326590425 GEFMRGZCTHGRCR-QGZVFWFLSA-N 338.451 5.331 30 20 EKED CC(C)(C#N)CCCCSCc1coc(-c2cccc(F)c2)n1 435881253 OLZFDPFWILAAAB-UHFFFAOYSA-N 332.444 5.434 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccnc(Oc2ccccc2)c1 438495844 RHORSKZRWNBRGB-UHFFFAOYSA-N 339.439 5.084 30 20 EKED Cc1nc(NC(c2cccs2)c2cccs2)c(Cl)cc1C#N 461949892 SHPSMXHMOFCYDI-UHFFFAOYSA-N 345.880 5.240 30 20 EKED Cc1cc(C)c2cc(CNc3cccc(OCCCC#N)c3)[nH]c2c1 479552470 GQPJBVCCMARNBY-UHFFFAOYSA-N 333.435 5.079 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC1CCCCC1 516226745 PQIVFYLQKPOMNC-UHFFFAOYSA-N 349.434 5.113 30 20 EKED C=CCOc1ccc(CN[C@@H](CC)c2ccccc2OC(F)F)cc1 518268005 SUNMEPOSQWQIJM-SFHVURJKSA-N 347.405 5.094 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1Cl 538508165 ZOUIYZYKDUDWBL-MNOVXSKESA-N 337.225 5.416 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 559863924 WDIGLDQRURCISR-WZONZLPQSA-N 332.491 5.651 30 20 EKED CCOc1cccc(Cl)c1CN[C@H](CCCC#N)c1ccccc1 566863862 KHSOLHJJTFDCCI-LJQANCHMSA-N 342.870 5.263 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1c(C)cc(C(F)(F)F)cc1C 640769976 NVSYLAGTEUFISS-GASCZTMLSA-N 338.373 5.037 30 20 EKED CCOc1cccc2cc(C(=O)/C=C\C3=Cc4ccccc4OC3)oc12 726741849 IDJNMWAQTBOEMI-KHPPLWFESA-N 346.382 5.046 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1cc(Cl)sc1Cl 727975236 VEFULSXFRDUJQV-UPHRSURJSA-N 337.149 5.368 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1 731835650 LTAQQCVAUWWDOB-MDZDMXLPSA-N 343.304 5.257 30 20 EKED CCC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 733679895 GREXDSISQAXBHO-RTBURBONSA-N 334.463 5.408 30 20 EKED Cc1ccc(SCc2cccc(C(=O)O[C@@H](C)CC#N)c2)c(C)c1 733711818 NJVWMKROLILCTP-INIZCTEOSA-N 339.460 5.055 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 739144422 XMRXUCJMPYWXPZ-OXJNMPFZSA-N 342.442 5.167 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1C 747193098 FCCJIHKMKTXZMW-LXXRFIIISA-N 338.476 5.081 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(Cl)s3)co2)cc1 748442203 XQJVYCOLSVOQOU-SREVYHEPSA-N 329.808 5.261 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccc(C)cc2)C2CCC2)c1 779033769 ZNUYENODOIEVTM-GGAORHGYSA-N 348.490 5.307 30 20 EKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CC1 805855723 OWZSZKMKEMIBKO-AWEZNQCLSA-N 344.867 5.076 30 20 EKED N#Cc1ccccc1Sc1ccc(-c2nc(-c3ccco3)no2)cc1 904758104 KNMKRWSMBKRVIB-UHFFFAOYSA-N 345.383 5.019 30 20 EKED CCOc1cccc2cc(C(C)=NNc3cccc4ncccc34)oc12 915964808 PJZBIYWTZYVASR-UHFFFAOYSA-N 345.402 5.216 30 20 EKED N#CCCn1cc(-c2csc(-c3cccc(F)c3)n2)c2ccccc21 7846007 PPFRQUVTNKUTAO-UHFFFAOYSA-N 347.418 5.485 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(F)c(F)c1 63277363 ATJXIDUHRVNLPU-DUXPYHPUSA-N 333.384 5.046 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2c1 97465036 YGJCTCBIPURUGW-KRWDZBQOSA-N 330.431 5.695 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(OCC)cc1)c1ccccc1 125777765 HKYWUSYMQDSSSI-GCJKJVERSA-N 349.474 5.109 30 20 EKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2)cc1 194887837 HFARJFQAZKUJGG-SFHVURJKSA-N 342.442 5.107 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCC(C)(C)C#N 289490825 YFJGTMXVWJQQFY-OAHLLOKOSA-N 332.513 5.119 30 20 EKED Cc1cc(N[C@@H](CCC#N)c2ccccc2)c(Cl)cc1[N+](=O)[O-] 301797942 REGBPSJKEMFBSV-HNNXBMFYSA-N 329.787 5.014 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cccc(Cl)c1F)c1ccccc1 432628448 CESWVQQQDVOVPH-OAHLLOKOSA-N 345.805 5.036 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)N[C@@H](CCC#N)c1ccccc1 435193810 PBKDDTIMYFMRCJ-FQEVSTJZSA-N 349.478 5.286 30 20 EKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)s1 468286164 MJSBFNBHSWJFQH-UHFFFAOYSA-N 338.819 5.192 30 20 EKED CC(C)(C)c1ccc(CN[C@H](CCCC#N)c2ccccc2)s1 552083466 GOKMFFHUEYLBIM-GOSISDBHSA-N 326.509 5.570 30 20 EKED N#Cc1ccsc1C(=O)Nc1cccc(Sc2ccccc2)c1 609375148 IJKKMECDNMNALT-UHFFFAOYSA-N 336.441 5.023 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 611465505 WDGOGRIHKGACQD-NWDGAFQWSA-N 336.332 5.128 30 20 EKED CCSc1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619755211 CRXFIWIUYCCBAU-ZDUSSCGKSA-N 330.884 5.174 30 20 EKED C=CCC[C@H](Nc1cccc(Cn2ccnc2C(C)C)c1)c1ccco1 671755699 HBWFCBXMFMTIQP-FQEVSTJZSA-N 349.478 5.767 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)Oc2c(Cl)cccc21 729150644 LGRYBSYRBQZFQX-AWNIVKPZSA-N 345.832 5.141 30 20 EKED CCCCCCCCC(=O)Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1 743836710 ACJGSCAQARUVJG-GOSISDBHSA-N 343.471 5.104 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 766350661 NKORMMIAIOKRGY-HOTGVXAUSA-N 340.854 5.101 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccccc1 773104641 FMJBLVHRJMKPBX-WZONZLPQSA-N 326.443 5.164 30 20 EKED C[C@@H](Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(C#N)cc1F 781423844 YYSJKKYKNSCMDG-SECBINFHSA-N 340.732 5.125 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 792102501 FJOOMJXVVCTBQJ-ROUUACIJSA-N 349.478 5.049 30 20 EKED CC[C@@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 796800212 VWKWCWNLKXEZPG-CZUORRHYSA-N 326.465 5.121 30 20 EKED C=CCCc1ccccc1NC(=O)/C=C\c1ccc2ccccc2n1 800155914 BAKDCQUJOTUEBT-NXVVXOECSA-N 328.415 5.005 30 20 EKED CCCCCCCCN1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 805782241 WOCJDFKGJVZZPS-CQSZACIVSA-N 347.425 5.062 30 20 EKED CC(/C=C/C(=O)c1cccc(C#N)c1)=C\c1ccccc1OC(F)F 811686868 BJZZVQXIRBGEIK-QDCWQMMGSA-N 339.341 5.002 30 20 EKED CCCCCCCC(=O)N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1 887332084 SGCSPRGDYXLPDZ-QFIPXVFZSA-N 349.478 5.129 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(C(C)=O)cc1 918722269 ABKZPSRQTFINSN-UHFFFAOYSA-N 334.529 5.268 30 20 EKED CSc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 25721997 JDTRCAZSUSFWHG-UHFFFAOYSA-N 344.439 5.199 30 20 EKED CC(C)(NCc1cccc(OCCCC#N)c1)c1cccc(Cl)c1 119379146 DNKQUBKXWKVQNC-UHFFFAOYSA-N 342.870 5.047 30 20 EKED C[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccc(OCC#N)cc1 180541204 BRPHLNDZOLVUFW-STQMWFEESA-N 349.261 5.308 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)SCCC(C)(C)C#N 289391556 LUGUPVZETBKRSA-HUUCEWRRSA-N 332.513 5.200 30 20 EKED C[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)/N=C(/O)C1CCCC1 328861563 LTVMSJJAMMVXGU-CYGHRXIMSA-N 334.504 5.227 30 20 EKED C[C@H](SC/C(O)=N/C1CCCCCC1)c1nc2ccccc2o1 329253831 WKQXJNOBLLSCLK-ZDUSSCGKSA-N 332.469 5.301 30 20 EKED N#CCCC[C@@H](NCc1cc(Br)cs1)c1ccccc1 353917169 SNODHPWJWGJURD-MRXNPFEDSA-N 349.297 5.035 30 20 EKED C[C@@H](N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccc(C#N)cc1 435672904 LGFVVQVBPSJLQF-OMWUSAIZSA-N 344.380 5.174 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc(C(F)(F)F)c1 439443738 ANRPHJZPWLTTRL-LLVKDONJSA-N 338.760 5.081 30 20 EKED CC[C@@H]1CCCC[C@@H]1N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458802304 PMXJHKUGSSHPKN-RLLQIKCJSA-N 341.499 5.032 30 20 EKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(C#N)s1 462644694 FZAJHFXEYMFOPY-MRXNPFEDSA-N 346.455 5.023 30 20 EKED CN(C(=O)c1ccc(C2=CCCC2)cc1)c1cc(Cl)ccc1C#N 464270517 DWIVMZZGCNNRGL-UHFFFAOYSA-N 336.822 5.056 30 20 EKED CC(C)[C@H]1C[C@@H](NC(=O)C[C@@H](CC#N)c2ccccc2)c2ccccc21 477125793 IXZOSZDRQCDLJF-STZQEDGTSA-N 346.474 5.075 30 20 EKED Cc1ccc2sc(C(=O)N[C@H](CCCC#N)c3ccccc3)cc2c1 487531876 FCOAHNCCCDBZFS-GOSISDBHSA-N 348.471 5.375 30 20 EKED Cc1ccc(C)c2c(C)c(C(=O)Nc3cc(C#N)cn3C(C)(C)C)oc12 518125596 NUYVDNGWZLITFT-UHFFFAOYSA-N 349.434 5.039 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cccc2ccccc12 519424723 BMQPTNDMVMCVID-MRXNPFEDSA-N 332.472 5.704 30 20 EKED C=CCCCN(C)C(=O)c1ccccc1SCc1cccs1 522954330 WXINWKYWRBJCHZ-UHFFFAOYSA-N 331.506 5.079 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccc(C#N)cc1 524215607 LPDLMCBOWIYQHA-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1 536842117 WGTAMCMSPHQEJY-YLJYHZDGSA-N 337.463 5.206 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 538394662 JONPKPBHCXSPFF-VBKZILBWSA-N 336.435 5.199 30 20 EKED C[C@@H](c1cccc(O)c1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 561733664 DGXNUTOUCYLGKY-KRWDZBQOSA-N 342.442 5.124 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Cl 609376489 BBJGGKSMBBVBJO-GFCCVEGCSA-N 344.867 5.153 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)[C@@H](C)c1c(Cl)cccc1Cl 615926003 SOSCNXIPILQNJD-LBPRGKRZSA-N 341.282 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCc2ccccc21 682803867 WDGAFIWQKYEKSE-LJQANCHMSA-N 333.475 5.597 30 20 EKED C=CCCCCCN(C)C(=S)Nc1ccc(SC(F)F)cc1 739458589 NWCOVMKKFGMNEZ-UHFFFAOYSA-N 344.496 5.376 30 20 EKED C#Cc1cccc(NC(=O)N(CC2CCC2)[C@@H](C)c2ccccc2)c1 741057170 RXEDJLYZRSTFCH-KRWDZBQOSA-N 332.447 5.063 30 20 EKED Clc1ccccc1-c1ccc(C=NOCc2cccnc2)s1 746576280 IEENDTHYPMPXGC-UHFFFAOYSA-N 328.824 5.014 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCCC3(C)C)n2)cc1 773982089 DGXGQEHYHPKQRL-HOTGVXAUSA-N 338.476 5.121 30 20 EKED C[C@H](Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(C#N)cc1F 781423849 YYSJKKYKNSCMDG-VIFPVBQESA-N 340.732 5.125 30 20 EKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 784834109 URYIEFWKQMDXKC-KGLIPLIRSA-N 347.409 5.214 30 20 EKED C=CCC1(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)CCC1 790757917 KPDYRBIGHJPQLF-OAQYLSRUSA-N 349.474 5.038 30 20 EKED CC(C)n1nccc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 794937738 IVTTZPJYIDYFCX-HJWRWDBZSA-N 330.387 5.260 30 20 EKED CC(C)c1ccc(N2Cc3ccc(N[C@H]4CC[C@H](C#N)C4)cc3C2)cc1 799718835 AKRYIODLKXMAMX-UWJYYQICSA-N 345.490 5.434 30 20 EKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1cnn(C2CCCC2)c1 799897358 SOBMWPSRZJHOSW-ZHACJKMWSA-N 349.459 5.018 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)c1cc(C2CC2)[nH]c1C1CC1 875779591 FEYYWNJTVRBZFD-UHFFFAOYSA-N 341.414 5.047 30 20 EKED O=C(/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1cccs1 912773505 WEUMMPBUGAZQET-VURMDHGXSA-N 341.413 5.281 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(SCC2CCC(C#N)CC2)o1 916908974 WKMQKTSKZPTKIR-DQPZFDDXSA-N 341.480 5.034 30 20 EKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccc(Cl)cc3)c2c1 1776114960 HIQSRBJZQAOEQF-XVNBXDOJSA-N 342.803 5.149 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1 1776697837 QJWHJSFMEOEMON-LNSGVDSJSA-N 334.415 5.194 30 20 EKED N#Cc1ccc(Oc2nc(C3CC3)nc3sc4c(c23)CCCC4)cc1 60217741 AMILTFFBGFARHQ-UHFFFAOYSA-N 347.443 5.111 30 20 EKED CC(C)c1c(CC#N)nc2sc3c(c2c1-c1ccncc1)CCC3 186985353 HKGUWLKJNSDRQO-UHFFFAOYSA-N 333.460 5.036 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC(F)F)cc1 189887343 FSXJTMYZMJTJIJ-UHFFFAOYSA-N 345.389 5.392 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cnc2ccsc2c1 340450384 YAGKIKCVGIWCMD-CRAIPNDOSA-N 335.476 5.382 30 20 EKED N#CCC[C@H](NCc1csc(Cl)c1Cl)c1ccccc1 432256931 IBTQOVMALKVTBZ-ZDUSSCGKSA-N 325.264 5.190 30 20 EKED CCN(C(=O)c1cccc(C2CCC2)c1)c1ccc(C#N)c(Cl)c1 462112022 LXQHGXYEKGBSRX-UHFFFAOYSA-N 338.838 5.146 30 20 EKED N#Cc1cc(Cl)ccc1CNc1ccc(CCC(F)(F)F)cc1 478352350 FSEJVVLQFBVTQD-UHFFFAOYSA-N 338.760 5.319 30 20 EKED CC(C)c1ccccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 479656936 HESKTOAOHHWHTL-FPOVZHCZSA-N 347.462 5.114 30 20 EKED Cc1nc(-c2ccccc2NCc2ccccc2C(C)(C)C#N)cs1 480161965 KMRCBKAHZRDMCG-UHFFFAOYSA-N 347.487 5.532 30 20 EKED C=CC[C@H](C(=O)N(C)Cc1ccccc1C(F)(F)F)c1ccccc1 494891168 IJLGSELNGKBVKI-KRWDZBQOSA-N 347.380 5.024 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 504171647 LVWSTRWUSUAEDG-IBGZPJMESA-N 342.870 5.037 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 505000233 BBDPULFYCSMOGZ-CQSZACIVSA-N 344.405 5.308 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2cc(Cl)ccc2C1 505010037 ARTHFGNXFNFAMH-UHFFFAOYSA-N 340.854 5.049 30 20 EKED C[C@H](NC(=O)Nc1ccccc1-c1ccccc1)c1ccc(C#N)cc1 505320437 XGRLRJWJPOJQIY-INIZCTEOSA-N 341.414 5.108 30 20 EKED C=CCC[C@H](NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 556869335 GVFJDBJVYGAHLO-IBGZPJMESA-N 336.435 5.083 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(OC(F)(F)F)cc1 586790326 SMDIWGQVQHEGBF-UGSOOPFHSA-N 348.368 5.259 30 20 EKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CCCCC#N 593974437 ZIQJUYQRDIGIOW-QGZVFWFLSA-N 336.435 5.158 30 20 EKED N#Cc1ccc(SCc2cc(-c3ccc(Cl)cc3)no2)c(F)c1 610165842 ZRBQJIYNCKHOQS-UHFFFAOYSA-N 344.798 5.298 30 20 EKED CCC[C@H](C#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732658588 UADSVYVEBQBOPM-GFCCVEGCSA-N 334.872 5.100 30 20 EKED C[C@@H]1CCC[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 741537421 DMKSGTOGAJHVDT-LKUPVBHCSA-N 332.447 5.107 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(OC(C)C)cc2)ccc1SC 746342610 XDFCKULIJXDEBQ-WZUFQYTHSA-N 342.460 5.100 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)n1 756571961 QIGXRRURFZFSHR-CAOSSQGBSA-N 330.497 5.049 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccccc1 773118448 ZRHQBHHLTBIODT-RDTXWAMCSA-N 331.431 5.417 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccccc1C(F)(F)F 775654903 RBHDYPVSBLWCHL-AWEZNQCLSA-N 346.396 5.357 30 20 EKED CCCC[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)C(C)C 857010643 STMMMGWTVRPBET-KGLIPLIRSA-N 347.409 5.070 30 20 EKED N#CCc1ccc(NCc2ccc(OCc3ccccc3F)cc2)cc1 916840355 CNUQKEGMDWFMJK-UHFFFAOYSA-N 346.405 5.083 30 20 EKED Cc1ccc(-c2ncc(CN[C@H](CCC#N)c3ccccc3)s2)cc1 130455247 KYVDPGBPVWZZBY-HXUWFJFHSA-N 347.487 5.253 30 20 EKED N#CCCC[C@@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1 353915935 ORDPUNKAHYZAIK-GOSISDBHSA-N 348.368 5.110 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](CC(F)F)c1ccccc1 421877273 LOILLMWUPKOCSN-PMACEKPBSA-N 340.417 5.312 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)[C@H](CC)c1ccncc1 505010618 JMVSAYIVZBKJKC-HXUWFJFHSA-N 337.467 5.205 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 505242261 IOKNDRVWADRANU-SFHVURJKSA-N 328.799 5.011 30 20 EKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(F)cc1F 507596796 PQBHUSVCGOEASO-SBGRQLAYSA-N 340.417 5.020 30 20 EKED C=CCCCCCN(C)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 523512006 CRBQCHBTKGGUAJ-HOTGVXAUSA-N 339.401 5.014 30 20 EKED CCCCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](C)CCC 538532320 VBYADCJCUDYYKZ-KRWDZBQOSA-N 326.484 5.063 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 539047620 UVZGTIPLFWCBLN-DYESRHJHSA-N 338.520 5.883 30 20 EKED CC[C@H](C)Oc1cccc(N[C@@H](CCC#N)c2ccc(OC)cc2)c1 550855701 CQFKOSJSPSOEFD-KKSFZXQISA-N 338.451 5.329 30 20 EKED C=C(C)[C@H](N[C@H](C)c1nccc2ccccc12)c1ccc(F)c(F)c1 569860964 JHDLDYYKWRGORW-VLIAUNLRSA-N 338.401 5.481 30 20 EKED CC(C)(C)c1nc2ccc(NC(=O)CCCCCC#N)cc2s1 588160038 WSAIIZXDHPIGSN-UHFFFAOYSA-N 329.469 5.006 30 20 EKED N#CCCC[C@@H](NCc1ccc(CC(F)(F)F)cc1)c1ccccc1 601123805 KEHUYYWWKXYGGC-LJQANCHMSA-N 346.396 5.316 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3ccco3)s2)n1 675925243 IURGTWLOXNLLJV-NSHDSACASA-N 342.445 5.078 30 20 EKED CCn1nc(C)c(/C=C/C(=O)c2cccc(-c3ccccc3)c2)c1C 727975714 VPPLWTBHXXMOLU-BUHFOSPRSA-N 330.431 5.083 30 20 EKED O=C1/C(=C/c2ccc(O)c(Cl)c2)CSc2c(Cl)cccc21 731939309 MQMLJLJQSJZBLJ-UXBLZVDNSA-N 337.227 5.071 30 20 EKED C#CCOc1ccc(CN[C@@H](C)c2ccc(SC(C)C)cc2)cc1 733326822 DSJJRPDHIQPCJI-KRWDZBQOSA-N 339.504 5.050 30 20 EKED Clc1ccc(C=NOCc2csc(C3CCCCC3)n2)cc1 744179715 CVHQXXRDLGCNNG-UHFFFAOYSA-N 334.872 5.395 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2cccc(Cl)c2)c1 746047704 PWYYSUUBOLPMIX-UYAOXDASSA-N 342.870 5.262 30 20 EKED O=C(/C=C/c1cnn(-c2ccccc2)c1)c1ccc(Cl)cc1Cl 747003187 AFUYJZKJZIGRHM-RMKNXTFCSA-N 343.213 5.075 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccccc1Cl 751511839 CKONXVFMJGSSHA-BQYQJAHWSA-N 331.849 5.421 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1nc2ccccc2s1 756519443 OJBLXMHIHOXFSW-KLHDSHLOSA-N 338.476 5.079 30 20 EKED CC(CCCC(F)(F)F)=NNc1nc(Cl)c(Cl)cc1Cl 774336782 XAOICQJOXLJQNT-UHFFFAOYSA-N 348.583 5.562 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCC[C@@H]1CC1(Cl)Cl 819066988 FRFJPUIREABBDK-VXGBXAGGSA-N 329.296 5.077 30 20 EKED Cc1cc(NN=C2CCC(C)(C#N)CC2)nc2ccc(Cl)cc12 834935876 QUOYBSHGQVLDAX-UHFFFAOYSA-N 326.831 5.068 30 20 EKED CC(C)c1cccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)c1 1776375347 IFQDQOJECQAVNL-CMDGGOBGSA-N 328.795 5.058 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC1CCCCC1 108145965 AAHJHLJAHDLGSR-AWEZNQCLSA-N 348.537 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1cccs1 189908627 LOZJWVDQYNIVPU-UHFFFAOYSA-N 327.493 5.561 30 20 EKED CCN(Cc1cccc(C#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 195732725 PMWNRFVDUXXTPR-AWEZNQCLSA-N 332.369 5.160 30 20 EKED CCc1ccc(C(=O)/C=C\c2cc(Br)cs2)s1 210369940 XRMWJSXECRYUHB-HYXAFXHYSA-N 327.268 5.031 30 20 EKED CCC[C@@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 236917672 XDGSGOIUZUCZKI-GOSISDBHSA-N 332.369 5.208 30 20 EKED Cc1ccc(C)c2c(C)c(/C(O)=N/[C@@H]3CCCC34CCOCC4)oc12 328684707 WZEMJWMJVBIJTO-MRXNPFEDSA-N 341.451 5.012 30 20 EKED CC(C)(C)c1csc(NC(=O)Cc2cccc(C(F)F)c2)c1C#N 410933558 YIFJRLYNNJZSKH-UHFFFAOYSA-N 348.418 5.036 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccccc1C(F)F)c1ccccc1 425708129 YTCYZLPDJOBPJV-INIZCTEOSA-N 343.377 5.181 30 20 EKED C=CC[C@H](CC)NC(=O)Nc1cccc(COC(C)(C)CC)c1C 439455905 WQTIGSYIJDEAPH-KRWDZBQOSA-N 332.488 5.176 30 20 EKED C[C@@H]1CCCc2ccccc2[C@@H]1NCc1cccc(OCCCC#N)c1 462542363 MIAUPNMYFBRZDB-WZONZLPQSA-N 348.490 5.172 30 20 EKED Cc1sc(NC(=O)C[C@H](c2ccccc2)C(C)C)c(C#N)c1C 482267726 OQBTTZWTAVDKGV-INIZCTEOSA-N 326.465 5.005 30 20 EKED CC[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 487519361 ZIMNTFRGTUTFHZ-GHTZIAJQSA-N 334.463 5.122 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccccc1OCC(F)F)c1ccccc1 489714226 YIORWJPTUNVCQF-MRXNPFEDSA-N 345.389 5.019 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1/C=C/c1ccccc1)c1ccccc1 505366193 KTZUNMANTNCZSX-GGKOYUFUSA-N 331.459 5.051 30 20 EKED N#Cc1ccc(F)c(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c1 516818351 NACOHQOVKKXSCN-SFHVURJKSA-N 349.236 5.245 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc2oc3ccccc3c2c1 538265440 IOIOQHJKJZTMQE-UHFFFAOYSA-N 337.419 5.288 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540127090 BXWZMTVDDVPLON-CRAIPNDOSA-N 349.434 5.145 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCSc3ccc(Cl)cc31)CC2 569413805 XOJPXPDOWKMINF-QZTJIDSGSA-N 340.879 5.026 30 20 EKED N#Cc1cccc(C2(NCc3ccc(F)c(-c4cccs4)c3)CC2)c1 579384140 AORWJQKHTFIELC-UHFFFAOYSA-N 348.446 5.205 30 20 EKED C[C@@H](NC[C@@H](C#N)CCC#N)c1ccc(-c2ccc(Cl)cc2)s1 580543415 XXOWJPRZUFEOHU-ZIAGYGMSSA-N 343.883 5.163 30 20 EKED C=CCOc1cccc(NC(=O)N(C2CC2)[C@H](C)c2ccccc2)c1 582804072 APYSGSOJCXUSIT-MRXNPFEDSA-N 336.435 5.009 30 20 EKED Cc1cccc2sc(C(=O)Nc3ccc(CC#N)cc3)c(Cl)c12 601908086 OCZUCLGBYKFJEW-UHFFFAOYSA-N 340.835 5.182 30 20 EKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1ccco1 725827469 RHBGKIZWJPDWJF-UHFFFAOYSA-N 348.431 5.096 30 20 EKED CCCc1ccc([C@H](NCc2ccc(OCC#N)cc2)C(C)C)cc1 726702865 LYVGLQMPLWSDLD-JOCHJYFZSA-N 336.479 5.028 30 20 EKED N#CCCSc1ccccc1NC(=S)Nc1ccccc1Cl 730953170 RCSMCJKQEZYJCO-UHFFFAOYSA-N 347.896 5.155 30 20 EKED C=C(C)COc1cc(/C=C\C(=O)c2ccccc2Cl)ccc1OC 747061887 OUIXLVLIIBTOGU-NTMALXAHSA-N 342.822 5.200 30 20 EKED CC(=NNc1ccc(Cl)cc1)c1sc(-c2cccnc2)nc1C 747602878 SGAUKAOMUSEJRU-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CC(C)(C#N)CCCNc1ccc(OCc2ccccc2F)cc1 762793688 KOPWPICHHCGLJR-UHFFFAOYSA-N 326.415 5.147 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 765333483 VFZBKXPGULHXJL-JKSUJKDBSA-N 340.854 5.101 30 20 EKED C#CC[C@H](N[C@H](C)c1cc(Br)ccc1F)c1ccccc1 773117137 UDZHJTLDETVWSY-ACJLOTCBSA-N 346.243 5.003 30 20 EKED Cc1nc(F)ccc1/C=C\C(=O)c1ccc(Cl)c(C(F)(F)F)c1 782348126 PVABCJCPOXALFO-UTCJRWHESA-N 343.707 5.097 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccncc1 793543780 WBMPQGRBYSRJDC-HNAYVOBHSA-N 344.886 5.490 30 20 EKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1c(F)cccc1Cl 809159633 SWBDGYBAGBMMNK-GQCTYLIASA-N 330.573 5.077 30 20 EKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1 842940844 FKKJIJHGHQNBLE-SJORKVTESA-N 338.476 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCC(C)(C)CO1 890165470 FHQHBJVARUMGMB-KRWDZBQOSA-N 329.484 5.072 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccsc3)s2)cc1 1777671217 UIMXTKBSFJPSEA-FNORWQNLSA-N 340.425 5.071 30 20 EKED COc1cc(C(=O)/C=C\c2ccccc2OC(C)C)ccc1SC 207747121 QHUWKJXFKSJNSX-LUAWRHEFSA-N 342.460 5.100 30 20 EKED Cc1cccc(C2(/C(O)=N/CCc3nc(C)oc3C)CCCCC2)c1 329109506 IYRJSIMYIKWNJX-UHFFFAOYSA-N 340.467 5.001 30 20 EKED Cc1cc(NCc2ccc(Cl)cc2C#N)ccc1-c1ccncc1 427409967 YQYVMNCGKHTLTC-UHFFFAOYSA-N 333.822 5.194 30 20 EKED N#Cc1ccc(Oc2ncnc3sc4ccccc4c23)c(Cl)c1 440643645 SUAMNDYIQHBCOG-UHFFFAOYSA-N 337.791 5.162 30 20 EKED CC[C@@H](Nc1cc(NC(=O)C(C)C)ccc1C)c1ccc(C#N)cc1 447588274 UMWPETWNZZVWIE-LJQANCHMSA-N 335.451 5.024 30 20 EKED CC(C)(C)c1cnc(CSc2nc(-c3ccccc3)ccc2C#N)o1 510188400 ZYPZSUXSAKLKPW-UHFFFAOYSA-N 349.459 5.198 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(C)cc1OCc1ccccc1 591497871 OBUCGZDGGUHZLK-UHFFFAOYSA-N 338.451 5.004 30 20 EKED CC[C@H](C)[C@H](C(=O)Nc1sc(C)c(C)c1C#N)c1ccccc1 603444844 CQXJRFWMOYRLJG-SJCJKPOMSA-N 326.465 5.005 30 20 EKED Cc1oc(C)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 609176239 BWGGJXWWXYUCIT-UHFFFAOYSA-N 346.386 5.121 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 609387253 VKZHFAVUCWNGQO-KGLIPLIRSA-N 330.884 5.765 30 20 EKED Cc1ccsc1-c1nnc(S[C@H](C#N)c2ccc(Cl)cc2)o1 619864440 PQLUITCXIUCCSS-GFCCVEGCSA-N 347.852 5.117 30 20 EKED O=C(/C=C\c1cc(Cl)ccc1Br)c1ccsc1 742435005 QFTHPYLTNXECRL-RJRFIUFISA-N 327.630 5.060 30 20 EKED CCCCCCC[S@@](=O)Cc1csc(-c2ccccc2F)n1 764453597 INIQPKQDFOSTCT-JOCHJYFZSA-N 339.501 5.168 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(OC(C)(C)C)cc2)cc1 764921345 RXNIAYXBDKCZDM-VFXTVZEFSA-N 349.430 5.051 30 20 EKED CC[C@H](CC#N)OC(=O)c1sc2cccc(Cl)c2c1Cl 787092082 MGLFGYSKTOQZPV-MRVPVSSYSA-N 328.220 5.057 30 20 EKED Clc1ccc2c(NN=C3CCC[C@@H]3c3ccccn3)ccnc2c1 794858704 SWLZXWLMJNYQMT-CQSZACIVSA-N 336.826 5.019 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC2CCCC2)cc1 915349926 AZCKKMXDKQSZOO-OAQYLSRUSA-N 347.462 5.044 30 20 EKED CCCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 915350189 KVHZDXIHYCMNTE-OAQYLSRUSA-N 347.462 5.138 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1ccc2ncccc2c1 916249717 HIFKRDKPMVTKJK-UHFFFAOYSA-N 337.426 5.276 30 20 EKED O=C(O)c1ccc(NN=C2CCC[C@H](c3cccc(Cl)c3)C2)cc1 1776013264 RPOMJNODRRDIKI-HNNXBMFYSA-N 342.826 5.164 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cc1O 96973273 SWIVIGIGQOKVGK-WMZJFQQLSA-N 336.412 5.025 30 20 EKED CCCCCCCC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 116028928 JKSJQRLJNGVUHH-QHCPKHFHSA-N 337.529 5.033 30 20 EKED CC[C@]1(C)CCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 173123068 VHDAPHPHXKHJGO-HNAYVOBHSA-N 345.512 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2ncccc12 189881669 ABKMBLNWWOGHJV-UHFFFAOYSA-N 330.431 5.339 30 20 EKED OC(=Nc1cc(C(F)(F)F)cnc1O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 329026672 VRYYLGLIKLMVMZ-KGYLQXTDSA-N 342.361 5.001 30 20 EKED C=CCC[C@H](NCc1ccncc1F)c1ccc(C(F)(F)F)cc1 449195384 VGTCKICBCOJIHN-KRWDZBQOSA-N 338.348 5.037 30 20 EKED CC[C@]1(C)CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 467908771 HTORDJBZLBKSJE-OAQYLSRUSA-N 349.434 5.004 30 20 EKED CSc1ccc(Cl)cc1NC(=O)C[C@H](CC#N)c1ccccc1 475179854 XQUWLLPQLSXJOH-AWEZNQCLSA-N 344.867 5.088 30 20 EKED CC(C)(C#N)CCCSc1nnc(-c2ccccc2)c2ccccc12 476499601 MJWBPXSJOKKVSK-UHFFFAOYSA-N 347.487 5.719 30 20 EKED C=CCN(Cc1csc(-c2ccccc2F)n1)Cc1cccs1 477654401 STGZKTDRWJCSNV-UHFFFAOYSA-N 344.480 5.199 30 20 EKED C[C@@H](c1cc2ccccc2o1)N(C)Cc1cccc(OCCCC#N)c1 506328902 ZNAORMJFBRPRDJ-KRWDZBQOSA-N 348.446 5.308 30 20 EKED C[C@@H](CCc1ccc(Cl)s1)N[C@H](CCCC#N)c1ccccc1 522018818 GEXJIGUJRJNJFR-MAUKXSAKSA-N 346.927 5.747 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)c(F)c1 537407151 IYJCPKVHPFHDGQ-NYHFZMIOSA-N 348.396 5.277 30 20 EKED C=CCC[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)C1CC1 537448256 OCZRUEVXKNIMGS-FQEVSTJZSA-N 341.499 5.251 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1NCC1CCCCC1 589845465 RLDVZKMIFZENHC-UHFFFAOYSA-N 327.472 5.091 30 20 EKED C=CCN(C(=O)[C@@H]1CCC[C@H](C)C1)c1nc(-c2ccccc2)cs1 607443558 HLGGISNHZBFEGH-DOTOQJQBSA-N 340.492 5.155 30 20 EKED CC(C)c1ccccc1NC(=O)CSc1ccc(C#N)cc1Cl 611103399 JAOBKUJEULOUBG-UHFFFAOYSA-N 344.867 5.066 30 20 EKED N#CCCCn1cc(-c2nc(C3CCCCC3)no2)c2ccccc21 618136441 IBFOICBZXIZIKB-UHFFFAOYSA-N 334.423 5.043 30 20 EKED C#Cc1cccc(NC(=S)N(C)[C@H](c2ccccc2C)C(C)C)c1 732722354 AGJSZJONVYDIJM-FQEVSTJZSA-N 336.504 5.002 30 20 EKED CCOc1cccc2cc(C(=O)/C=C/c3nccc4ccccc34)oc12 740764622 ADTVEFQPAHKMQD-ZHACJKMWSA-N 343.382 5.276 30 20 EKED CC(=NOCc1cc(C)nc2ccccc12)c1cc2ccccc2o1 742352343 PANXSQSTSZSDKC-UHFFFAOYSA-N 330.387 5.230 30 20 EKED CCc1ccc([C@@H](NCc2ccc(N(C)CCC#N)cc2)C(C)C)cc1 743767442 QKSPXIVPFKMDJN-QHCPKHFHSA-N 349.522 5.086 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cc(F)cc(F)c1 755704176 IIJWFCSOALMACJ-OWOJBTEDSA-N 333.384 5.046 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccc2cc(OC)ccc2c1)c1ccncc1 766020507 PYCKXMYKHMWTTD-PKTZIBPZSA-N 346.474 5.602 30 20 EKED Cc1nc(-c2ccc3ccccc3c2)n(CCCCC(C)(C)C#N)n1 767061311 GYLFYQKLYUXVAP-UHFFFAOYSA-N 332.451 5.127 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc2cc(OC)ccc2c1)c1ccccc1 773115134 LRPDVTWZTGASCO-SBUREZEXSA-N 329.443 5.264 30 20 EKED CC1(C)CC[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 781618718 YYORRPNNVXDZMD-AZUAARDMSA-N 332.447 5.107 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1cccc(C(F)(F)F)c1 782299703 AAXPVKLEJWSFBI-FNORWQNLSA-N 327.305 5.150 30 20 EKED CC(C)(CCC#N)CNc1ccc(OCC(F)(F)F)c(Cl)c1 800290398 FBRFRPSIZHFTSO-UHFFFAOYSA-N 334.769 5.023 30 20 EKED CC[C@H](Cc1ccccc1C)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 820183683 DCTHMDMTVIXPTB-WBVHZDCISA-N 340.492 5.020 30 20 EKED CC1(C)CC[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762982 SCDZCESEWDZHHR-ZIAGYGMSSA-N 344.867 5.076 30 20 EKED CC(C)(C)c1nc(CSCCCOc2ccc(C#N)cc2)cs1 917953919 GRWCAUIMOFVUTB-UHFFFAOYSA-N 346.521 5.015 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1C(C)(F)F 1776787005 ICQFVRGJMFHEJI-INIZCTEOSA-N 341.442 5.092 30 20 EKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccccc2)cc1 41779399 MNIVBKXAPPNSIH-UHFFFAOYSA-N 344.439 5.103 30 20 EKED N#C[C@@H](C(=O)CC1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 60477547 BYHHXOQFWYSFOA-HNNXBMFYSA-N 344.867 5.220 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2cc(C#N)ccc2F)cc1 90117367 SSUAFYGLMCPYOS-AWEZNQCLSA-N 328.456 5.049 30 20 EKED COc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)c2ccccc12 90665154 CQRQEMJFXNJLPX-VGOFRKELSA-N 344.458 5.544 30 20 EKED C[C@H](Sc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 118172199 BCSABCRVGOHYHV-NSHDSACASA-N 341.823 5.115 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(C)c1F 154331847 XLJHIDXBURRBFX-AWEZNQCLSA-N 342.439 5.089 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2F)o1)c1ccc(F)cc1F 210980705 AUFXZFCZKROVAD-TWGQIWQCSA-N 328.289 5.260 30 20 EKED CCOc1cccc2cc([C@@H](C)Nc3cc(C(C)=O)ccc3C#N)oc12 302135234 ZQRSBNDWVIDXCL-CYBMUJFWSA-N 348.402 5.079 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1ccc(OCC#N)cc1 327067552 CCZHXPDMNAZKCC-IAGOWNOFSA-N 336.479 5.298 30 20 EKED CC[C@H](N[C@@H](c1cccc(C)c1)c1ccccn1)c1ccc(C#N)cc1 364662048 OWKKGRGTBOSTNI-GMAHTHKFSA-N 341.458 5.092 30 20 EKED C[C@@H](N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1cccc(C#N)c1 435659402 JFHXFAYBWOTONP-OMWUSAIZSA-N 344.380 5.174 30 20 EKED C=CCC1(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)CCCCC1 459986857 GSXXIDRYJSTUSC-UHFFFAOYSA-N 342.483 5.055 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(C(F)F)c1 468378260 DZEADHVUHHRFBD-UHFFFAOYSA-N 343.417 5.657 30 20 EKED C[C@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 480556783 RHFFYNPEDVRJPD-INIZCTEOSA-N 349.434 5.004 30 20 EKED Cc1c([C@@H](C)NCc2ccccc2C(C)(C)C#N)oc2ccccc12 484360051 YAFSQJKWZZPSFO-MRXNPFEDSA-N 332.447 5.393 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1ccccc1 487349329 BDHHVGLLIOQQBM-KCLUMXDGSA-N 338.495 5.144 30 20 EKED CCN(Cc1c(Cl)ccc2cccnc12)[C@@H](C)c1ccc(C#N)cc1 497618688 GSSBWTSXWVOHIA-HNNXBMFYSA-N 349.865 5.343 30 20 EKED C=CCc1cc(CN[C@@H](c2ccccc2)C(C)(C)C)cc(OC)c1O 500262049 BNIBVCLEBIHMGB-NRFANRHFSA-N 339.479 5.006 30 20 EKED CCCc1occc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 503898843 CAJMQIQNWJZODN-UHFFFAOYSA-N 336.416 5.085 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCc1ccc(CC#N)cc1 521997497 JSULBCIPVLWKFM-UHFFFAOYSA-N 349.478 5.321 30 20 EKED CC[C@@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccc(C#N)cc1 562494915 FBAQPHMNBPCFSB-MGPUTAFESA-N 348.446 5.423 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc2c1CCN2 568853939 HNSOGCQODTUFQH-UHFFFAOYSA-N 335.451 5.151 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1cc(Cl)ccc1C(C)(C)C 588300324 UGOPQFJDIXDFRA-UHFFFAOYSA-N 335.879 5.089 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(F)cc1C(F)(F)F 599042264 AKEGQVLMIORUTL-BBATYDOGSA-N 348.343 5.054 30 20 EKED C=CCCCCCN(C)C(=O)c1cccc(OCc2cccs2)c1 606814600 NLHSBONDADAJRH-UHFFFAOYSA-N 343.492 5.146 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccc(F)c(F)c1 657980320 AZNVVYGXKQDLPT-DIFFPNOSSA-N 338.348 5.265 30 20 EKED C=CCN(C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C)C(C)C 726716896 UOLTXPSVDVWOLS-MRXNPFEDSA-N 342.405 5.009 30 20 EKED N#Cc1cccc(Cl)c1N1CCC(c2cc3ccccc3[nH]2)CC1 742397100 BEBVMLFJNDSQFZ-UHFFFAOYSA-N 335.838 5.077 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cc(Cl)cc(Cl)c1 754711749 ACWAOGOIDIVSNS-UHFFFAOYSA-N 334.124 5.425 30 20 EKED C[C@H](N[C@H](C)c1ccc(N2CCCCCC2)cc1)c1ccc(C#N)cc1 765332478 PSCQTJSMGMYAOK-RBUKOAKNSA-N 347.506 5.350 30 20 EKED O=C(/C=C/c1cc(Cl)cs1)c1sccc1Br 782331738 XNGGJGHWTSWACA-OWOJBTEDSA-N 333.659 5.122 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1csc(C)n1 812374425 ZXLYTYQLVYTZJE-UHFFFAOYSA-N 334.659 5.248 30 20 EKED Cc1ccc(C)c(C(=O)/C=C/c2ccccc2OCc2ccccn2)c1 819843391 YBVUVBQNLUGEMG-OUKQBFOZSA-N 343.426 5.174 30 20 EKED C=CCCC[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)c1ccccc1 883209097 VOSFELLKQWTHFP-GQOCTPOGSA-N 341.520 5.172 30 20 EKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)oc1CC 1776784547 CHUVMFXTJDNELG-UHFFFAOYSA-N 337.504 5.503 30 20 EKED N#Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3)cc2)c1 16182475 UGOWRWQUQFAINM-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CC(C)CN(CC(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955073 GHTGULWPTXCIQQ-INIZCTEOSA-N 347.528 5.227 30 20 EKED COc1ccc2cc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)ccc2c1 90665694 YKRUXWGNILMACI-HXOBKFHXSA-N 344.458 5.544 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1cccc(F)c1 189869698 ZWGVMOKXJUJGFN-OAHLLOKOSA-N 341.426 5.084 30 20 EKED C=C[C@H](CC(=O)N(Cc1ccsc1)c1cccnc1)c1ccccc1 193520888 YQJDJPVZZRNWNL-GOSISDBHSA-N 348.471 5.036 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2)nnc1-c1cccs1 216443117 FXNSDLHENVQXTA-CYBMUJFWSA-N 327.478 5.046 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1 303840284 LYHUGEYAPAQYME-XLIONFOSSA-N 344.499 5.212 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc3ccccc3s2)s1 430589027 BOEJPVRPSZGYIA-LBPRGKRZSA-N 340.473 5.145 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H]3CCC[C@H](C#N)C3)s2)cc1 463235730 DIUSADQGMHNYDU-QILLFSRXSA-N 339.508 5.160 30 20 EKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 467706773 YKRDTMNQYSVULB-QAPCUYQASA-N 349.434 5.003 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(Cl)c1Cl 512626100 RYNNZIVRJQGFJV-MNOVXSKESA-N 337.225 5.416 30 20 EKED Cc1ccnc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 519559034 KVBUQAFNMXLTIH-ZWKOTPCHSA-N 341.458 5.341 30 20 EKED Cc1scc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1C 538048168 GFXWGWZYNWRQEU-UHFFFAOYSA-N 338.457 5.217 30 20 EKED Cc1nc(C(F)(F)F)c(CSc2ccc(C#N)cc2Cl)s1 543693598 AAAHSWTXYRCHFC-UHFFFAOYSA-N 348.802 5.288 30 20 EKED CC(C)(C#N)CCSCCOC(c1ccccc1)c1ccccc1 561733107 ORJQECCHWWGPQY-UHFFFAOYSA-N 339.504 5.466 30 20 EKED C=CCC[C@H](NCc1cccc(C(=O)OC(C)(C)C)c1)c1ccco1 586791545 YVJCKFLEGSPYJT-SFHVURJKSA-N 341.451 5.032 30 20 EKED CCC[C@@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccccc1 603747586 UHQMTYYZHAOTBH-OAQYLSRUSA-N 349.478 5.021 30 20 EKED C=CCOc1ccc(CNC(C)(C)c2cccc(F)c2)cc1Cl 605827213 FLQIGLHSKMATJJ-UHFFFAOYSA-N 333.834 5.069 30 20 EKED N#CCCCCN1CCC(CCc2cccc(C(F)(F)F)c2)CC1 608832479 XYNWZVWKBOSFBP-UHFFFAOYSA-N 338.417 5.044 30 20 EKED O=C1/C(=C\c2ccc(O)c(Cl)c2)CSc2c(Cl)cccc21 731939308 MQMLJLJQSJZBLJ-POHAHGRESA-N 337.227 5.071 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cccc(-c2ccncc2)c1 741469010 ITUWENWGPSSPEH-HJWRWDBZSA-N 336.394 5.193 30 20 EKED COc1cc(C(C)=NNc2ccc(C)cc2)ccc1SC(F)F 746483855 AJSYSSBDAAAXJZ-UHFFFAOYSA-N 336.407 5.154 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1ccc2ccccc2c1 750897654 ZUEUIYZHHHUVKD-PJGMZRAFSA-N 329.355 5.200 30 20 EKED CC[C@H](C)[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 780311449 CCRPBJKXRFZURB-ZOWXZIJZSA-N 346.883 5.322 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CC(C)(C)C3)n2)cc1 796765971 WCDDZUYCIQWGDL-INIZCTEOSA-N 338.476 5.121 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(SCc2ccc(C#N)cc2C)o1 186274941 NNPICPPXHYQKTJ-SFHVURJKSA-N 349.459 5.084 30 20 EKED C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(OCC#N)cc1 192938903 YPPOXQFKBMRHTG-CHWSQXEVSA-N 349.261 5.308 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1 255871381 DYUDIGXZQWVPEP-UMAGTOLTSA-N 346.213 5.180 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCCC2=O 294998643 UPAFCQJQWJPHBG-UHFFFAOYSA-N 347.458 5.310 30 20 EKED CC(O)=Nc1ccc(C/C(O)=N/[C@H]2CCCCC23CCCC3)cc1 329645671 ZNHXJKLNNMHBQD-SFHVURJKSA-N 328.456 5.297 30 20 EKED C=CCC[C@@H](NCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 342222497 MFHZSRMQSITPJG-QGZVFWFLSA-N 338.373 5.107 30 20 EKED C=CCC(C)(C)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 426583173 CWCAUWSBFVZHMY-LBPRGKRZSA-N 328.309 5.001 30 20 EKED CC(C)c1ccc(-c2nnc(SCCCCC(C)(C)C#N)o2)cc1 436200305 VJASJPFIQMPEFT-UHFFFAOYSA-N 343.496 5.672 30 20 EKED C=C(C)[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(F)c(F)c1 447593447 SAPGDSAKUYFXIG-UXHICEINSA-N 326.390 5.195 30 20 EKED CC(C)C[C@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458794595 BHWBPPPLFAJFHM-UXHICEINSA-N 341.499 5.032 30 20 EKED CC(C)(C)C[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462726298 QNIRGWAMWINWDE-IBGZPJMESA-N 326.871 5.479 30 20 EKED Cc1ccc(SCC(F)(F)F)c(N[C@@H]2CCC[C@H](C#N)C2)c1 463289982 RKOBYBMMFNEGMH-QWHCGFSZSA-N 328.403 5.144 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc2c(C)cccc2c1C 476128389 BLJWPUXBCAKYQU-UHFFFAOYSA-N 347.458 6.154 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(Cl)c1F 477835155 GFCABPHFICCBGG-QWHCGFSZSA-N 348.874 5.904 30 20 EKED C[C@H](Oc1ccccc1NC(=O)c1sccc1C#N)c1ccccc1 522332218 FEZSWBGRGRNONG-AWEZNQCLSA-N 348.427 5.012 30 20 EKED CC(C)c1nc2cc(NC(=O)c3ccc(C(C)(C)C#N)cc3)ccc2o1 525989146 NAFRDJFREXUQNJ-UHFFFAOYSA-N 347.418 5.005 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccccc1 534625527 JCEILCBJRJFYPS-KRWDZBQOSA-N 346.430 5.257 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@@H](CCC#N)c2ccccc2)o1 537325570 LZBRDZYSBNROMW-NRFANRHFSA-N 348.421 5.529 30 20 EKED Cc1ccsc1[C@H]1C[C@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N 538072982 CGFSMLVFZJNJMR-NWDGAFQWSA-N 344.505 5.029 30 20 EKED COc1ccc(-c2ccc(CN[C@H](C)c3cccc(C#N)c3)s2)cc1 539495988 BRCGNHLYOWLRJF-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 556208582 WGGCIGREEVVQNJ-KUHUBIRLSA-N 347.289 6.079 30 20 EKED C[C@H](NCc1cc2ccccc2s1)c1ccc(C#N)cc1Cl 583038349 OCRYARJPWAAWCC-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=C(C)COc1cccc(NC(=O)c2cc(Cl)sc2Cl)c1 589381955 FCJRJULGJIULNK-UHFFFAOYSA-N 342.247 5.262 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 604903980 CFZAVPYGMLFBED-CYBMUJFWSA-N 337.448 5.049 30 20 EKED CCCCc1noc([C@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)n1 609850359 TYJRSCZVHQDHSJ-HNNXBMFYSA-N 347.418 5.091 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1nc(-c2ccccc2)cs1 730086159 YHNYPODNFCYNFV-CLFYSBASSA-N 341.819 5.065 30 20 EKED O=C(/C=C\c1cnn(-c2ccccc2)c1)c1ccc(Cl)cc1Cl 747003188 AFUYJZKJZIGRHM-TWGQIWQCSA-N 343.213 5.075 30 20 EKED Cc1nc(F)ccc1/C=C1/CCc2cc(SC(F)F)ccc2C1=O 782330106 XUUYJBDYBXDLBM-JYRVWZFOSA-N 349.377 5.056 30 20 EKED CC(=NNc1ccccc1F)c1sc(-c2ccccc2)nc1C 814789442 IAHIROIVPHFOKX-UHFFFAOYSA-N 325.412 5.094 30 20 EKED CSc1ccc(C(=O)/C=C/c2cc(Br)cs2)cc1 916133514 UYNDCUVMTRKAMQ-VOTSOKGWSA-N 339.279 5.129 30 20 EKED C=CCCC1(C(=O)O)CCN([C@H](C)c2ccc(C(C)C)cc2)CC1 1776167942 HRNPZRZNVGFHRU-QGZVFWFLSA-N 329.484 5.004 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(C(C)(C)C)oc1C 1776783654 APHHFWGPNRKJQL-KRWDZBQOSA-N 337.504 5.179 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 159685254 UOPXCCLOMACQBR-CQSZACIVSA-N 348.233 5.160 30 20 EKED Cc1cc([C@H](C)/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)c(C)s1 328741831 JDNPUZYXFMVMRX-NSHDSACASA-N 342.464 5.310 30 20 EKED C/N=C(/O)c1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c(Cl)c1 329630531 HWTGQDPAXKIWRU-AEGPPILISA-N 348.874 5.469 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340448768 KLMUODIKDVBPEV-VQTJNVASSA-N 328.406 5.441 30 20 EKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 439131476 MAGMHNVABVMCHW-INIZCTEOSA-N 348.233 5.160 30 20 EKED CC(C)c1oc([C@@H]2CCCN2CC2(C#N)CCC2)nc1-c1ccccc1 450562049 HIXXSKICDQZWQI-SFHVURJKSA-N 349.478 5.296 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCCC1(C)C 467468489 OOUZSGGOJGPMCJ-YOEHRIQHSA-N 345.512 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1sccc1C 476083073 ZQAMHUGNGYPVGY-UHFFFAOYSA-N 341.520 5.870 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](CC#N)c1ccccc1 476996704 BUVLZUSAHQWOKZ-HXUWFJFHSA-N 346.474 5.565 30 20 EKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)s1 480809585 CWILVVIXDWGXBK-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CC[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(F)cc1F 507713317 JCYPRPJIOFLWED-QGZVFWFLSA-N 339.451 5.250 30 20 EKED N#C[C@H](C(=O)c1csc2ccccc12)c1nc2ccccc2s1 513695975 PWQWNHDVIQHPRO-GFCCVEGCSA-N 334.425 5.001 30 20 EKED C=CCCOCCCCC(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 539404518 UMOYZYJOYSRLSN-DENIHFKCSA-N 343.511 5.058 30 20 EKED C=CCOc1ccc(C(=O)N(c2ccc(F)cc2Cl)C(C)C)cc1 587993878 KJWJGWDPBAKDMQ-UHFFFAOYSA-N 347.817 5.099 30 20 EKED N#CCC1(CSc2nnc(-c3ccccc3)c3ccccc23)CC1 594880370 CKVLPGSMIDEBCH-UHFFFAOYSA-N 331.444 5.083 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc2ccccc2o1 682803640 JMIRKUXJZXNXED-UHFFFAOYSA-N 333.431 5.466 30 20 EKED Cc1ccsc1C(=O)/C=C/c1cn(C)nc1-c1cc2ccccc2o1 733748618 FBOZEPXMDJTJEQ-BQYQJAHWSA-N 348.427 5.099 30 20 EKED CCOc1cc(/C=C/C(=O)c2sccc2C)cc(Cl)c1OC 733749640 RDQZIIHAFDLFPW-AATRIKPKSA-N 336.840 5.013 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(F)c(F)c3)s2)cc1 734307086 VDOSNVKATZGOAV-CLFYSBASSA-N 341.382 5.293 30 20 EKED CC(C)Cc1ccc([C@@H](NCc2ccc(OCC#N)cc2)C2CC2)cc1 750877485 AIDVHPHJQXENEI-HSZRJFAPSA-N 348.490 5.028 30 20 EKED N#Cc1c(Cl)cccc1SCc1cc(Cl)nc(Cl)c1 771457627 PBNXCQZMPMMIDY-UHFFFAOYSA-N 329.639 5.206 30 20 EKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(SC(F)F)cc1 782325113 KXKBLBUFJZZJSJ-WAPJZHGLSA-N 341.382 5.446 30 20 EKED COc1c(C)cc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1Cl 796838789 ZLSUVKGIMPTENJ-HNAYVOBHSA-N 342.870 5.353 30 20 EKED C=CC[C@H](OC(=O)CC(C)(C)C#N)c1ccc(Cl)c(Cl)c1 797553776 KQEJPUJKXURFGI-AWEZNQCLSA-N 326.223 5.094 30 20 EKED O=C1/C(=C\c2ccc(Cl)s2)CC/C1=C\c1cccc([N+](=O)[O-])c1 818245911 TVMFINAFVLEQHG-LSCZQMSZSA-N 345.807 5.140 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCc1ccc(C#N)cc1 916410150 SPUHLAUCTNQMBK-UHFFFAOYSA-N 335.451 5.127 30 20 EKED C=CCOc1cccc(NC(=O)C(c2ccccc2)c2ccccc2)c1 8904927 LYSJQZCZFPQWMG-UHFFFAOYSA-N 343.426 5.022 30 20 EKED N#Cc1cccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 14179954 ALMUQSKDMXRTEC-SXGWCWSVSA-N 341.197 5.604 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 90665745 JMGSODLKEOHSLW-KBXCAEBGSA-N 332.369 5.401 30 20 EKED Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 124125785 IEHDRQFTQUXYCU-MAUKXSAKSA-N 346.455 5.099 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)s1 176949379 KMLQDKSHPFQSNP-QGZVFWFLSA-N 344.892 5.214 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1cccc(C#N)c1 177391349 LJENSLQFDXEKJN-AOMKIAJQSA-N 330.406 5.138 30 20 EKED N#CCCSc1ccccc1NCc1ccccc1Br 178386605 CJYHREXKIFNBME-UHFFFAOYSA-N 347.281 5.067 30 20 EKED C/C=C\c1ccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)cc1 497381883 DFGTYFDWJCVXEP-HYXAFXHYSA-N 333.435 5.035 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 524828089 LMTVVRMIACEVTK-UHFFFAOYSA-N 345.270 5.212 30 20 EKED N#CCC[C@H](N[C@@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 527876631 TWHHDIZUXDWNQW-RBUKOAKNSA-N 328.818 5.101 30 20 EKED Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(Cl)c1C 541200509 QALQBDSCTDVTFT-UHFFFAOYSA-N 326.827 5.010 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(C(F)F)c1Cl 541794021 LBDTWVMDCBLZGU-UHFFFAOYSA-N 343.805 5.071 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(F)c(OC)c1)c1ccc(F)c(F)c1 547829947 YFOMACVMWQRKEC-CWTRNNRKSA-N 335.369 5.081 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)sc2cc(F)ccc12 579638675 FTERAMIHMSVZNS-UHFFFAOYSA-N 344.798 5.126 30 20 EKED Cc1oc(-c2cccs2)nc1CSc1cccc(F)c1C#N 580752577 ABJVUEIBSUEUPY-UHFFFAOYSA-N 330.409 5.015 30 20 EKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2ccccc21 603656306 ILLMHEAAPNSJTE-HXUWFJFHSA-N 347.462 5.029 30 20 EKED C=CCCCN(C)C(=O)c1ccc(-c2nc3ccccc3s2)s1 605645315 WZXSJEYGBYYBGS-UHFFFAOYSA-N 342.489 5.063 30 20 EKED C=CCCCCCN(C)C(=S)Nc1ccc(Cl)c(Cl)c1 739457234 JQZKLUFXYJPNSF-UHFFFAOYSA-N 331.312 5.368 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(F)cc2F)c(OC(F)F)cc1C 742431378 JMNLCOCGPCIISU-ZZXKWVIFSA-N 338.300 5.079 30 20 EKED O=C1/C(=C\c2ccc(Cl)nc2)CCSc2ccc(Cl)cc21 749005508 KVXSDCDTBLJMLW-XFFZJAGNSA-N 336.243 5.151 30 20 EKED CC1(C)CCC[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C1 756516235 GEGDEXCHFXTDLB-CVEARBPZSA-N 338.476 5.203 30 20 EKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1c(C)n[nH]c1C 765321483 ZYIITJHOWCOQRO-GOSISDBHSA-N 333.520 5.221 30 20 EKED O=C(/C=C\c1cscc1Cl)c1sccc1Br 771856166 FROGDBVSXPIGIL-UPHRSURJSA-N 333.659 5.122 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2c(F)cccc2Cl)c1 809159421 PIOSZBNVYCYVDJ-KTKRTIGZSA-N 343.785 5.058 30 20 EKED O=C(O)c1cc(NN=C2CCCCCCCCCCC2)ccc1F 1776061337 RDSNMWDDNRSPNP-UHFFFAOYSA-N 334.435 5.597 30 20 EKED CCCc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)s1 1776832221 UZQWEGKIRLETBH-WYMLVPIESA-N 340.444 5.001 30 20 EKED C=CCn1c(SCc2cccc(Cl)c2)nnc1-c1ccccc1 14067665 HCYZSFVJDFXVTN-UHFFFAOYSA-N 341.867 5.077 30 20 EKED CC(C)c1sc(NC(=O)c2ccc(C#N)cc2)nc1-c1ccccc1 32743022 UROSAWSKSONRSX-UHFFFAOYSA-N 347.443 5.057 30 20 EKED CCOc1cc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)ccc1O 97992877 VGIYZNRAKQJAQC-DAXSKMNVSA-N 342.778 5.087 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc3ccccc3c2)c1 113952453 HSJWOPLPHMDWJJ-VGOFRKELSA-N 344.458 5.372 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1 117951266 RXZMAGFJBWDDML-QWHCGFSZSA-N 349.261 5.135 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 166828446 YDJIHSAUYKLCBJ-CEFACKQISA-N 344.867 5.200 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccc(-c2ccncc2)cc1 187438188 RVQOHDYDBSDHTF-OAHLLOKOSA-N 347.849 5.124 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)CC2 187803037 LFTTWLFNTKKHPG-AOMKIAJQSA-N 334.463 5.050 30 20 EKED N#CCCC[C@@H](NC(=O)c1cccc(Cl)c1Cl)c1ccccc1 352168003 UBZZHCWVHBKSKU-MRXNPFEDSA-N 347.245 5.158 30 20 EKED C[C@@H](S[C@H](C)c1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 443142521 PPVHQDISROMLLX-HUUCEWRRSA-N 334.444 5.769 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)C[C@H](CC#N)c1ccccc1 475025157 UOPQZXSDTVZTKX-IBGZPJMESA-N 348.490 5.959 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C[C@H](C)C1 475564970 VATQBBRXVJOGRP-IRXDYDNUSA-N 328.500 5.438 30 20 EKED CCCN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 475904154 XJPGPFWKFMBGNP-KRWDZBQOSA-N 340.854 5.171 30 20 EKED N#CCn1c(/C=C/c2csc(Cl)c2Cl)nc2ccccc21 486106140 YOLPDSNKYCJWMR-AATRIKPKSA-N 334.231 5.099 30 20 EKED C[C@H](Nc1ccc(C#N)c(Cl)c1)c1nc2ccccc2n1C(F)F 486440465 VMWVGHGWDIUEMJ-JTQLQIEISA-N 346.768 5.130 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 500742901 LZLFZVNXCYDLES-UHFFFAOYSA-N 348.427 5.281 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1 532466047 KWBMDCKZUVRDHF-HOTGVXAUSA-N 332.472 5.699 30 20 EKED N#Cc1ccccc1SCc1cccc(C(=O)Nc2ccccc2)c1 610206556 JLVJHVUZMZYTDM-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CC(C)(C#N)c1ccc(CNc2cccc(CC(F)(F)F)c2)cc1 614058718 RQJZBGSDZHZIMJ-UHFFFAOYSA-N 332.369 5.205 30 20 EKED C=CCC[C@H](N[C@H]1CCCn2ccnc21)c1ccc(C(F)(F)F)cc1 655734471 JAUHJQWYDHDOAU-IRXDYDNUSA-N 349.400 5.034 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)C 729887857 DIRZSCGAKYLVOL-RDJZCZTQSA-N 340.492 5.367 30 20 EKED N#CCCCOC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 730334222 QSEXOVJBXVYWQX-QGZVFWFLSA-N 345.851 5.020 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1c[nH]c2cc(Cl)ccc12 740764638 AVYNOYLWERIFFF-BQYQJAHWSA-N 332.790 5.266 30 20 EKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744034606 CSEGNYYBFLFQEL-GXTWGEPZSA-N 348.899 5.732 30 20 EKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccsc1 749104752 NVOKIOSIEWLLBV-FNORWQNLSA-N 341.413 5.281 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](CCC)c2ccccn2)cc1 765734728 CQBYJULYZPDASI-UZLBHIALSA-N 344.886 5.405 30 20 EKED N#CCCCCCC(=O)Nc1cccc(Cl)c1SC(F)F 808345736 KZTZSESKCCTOOG-UHFFFAOYSA-N 332.803 5.067 30 20 EKED CC(=NNc1ccccc1F)c1sc(Cc2ccccc2)nc1C 814790375 SIKVTIJKOAWDFK-UHFFFAOYSA-N 339.439 5.018 30 20 EKED CON=Cc1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 876869096 PYPIWSOQDDRZLK-UHFFFAOYSA-N 338.451 5.166 30 20 EKED CCCCC[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352030 IFTAVJXXLZXAFO-UWJYYQICSA-N 349.478 5.432 30 20 EKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2ccccc2c1 918025225 IYNKYMKGZBSJQY-UHFFFAOYSA-N 346.430 5.069 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)s1 1776339688 MYSUFUKBVBNIDR-ALCCZGGFSA-N 348.851 5.194 30 20 EKED N#CCc1cccc(C(=O)Nc2ccc(SC3CCCC3)cc2)c1 49674663 DIBJCDUVVFGXLP-UHFFFAOYSA-N 336.460 5.040 30 20 EKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1cccc(Cl)c1 59269423 FVBDSBZGDXKTCY-ZHACJKMWSA-N 349.817 5.210 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCc1ccccc1 66802232 JIIZQPSSKSQGSA-INIZCTEOSA-N 338.476 5.042 30 20 EKED COc1ccc(Cl)cc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 90665058 KNAGMYFFAVFPIX-KDOFPFPSSA-N 328.843 5.044 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1OCCc2ccccc21 189901280 JHSDYOSKEDMBDQ-NRFANRHFSA-N 349.474 5.181 30 20 EKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cc2ccccc2s1 475758517 XLKMZHCXXHUMNX-NVXWUHKLSA-N 348.471 5.166 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccccc1 477562374 VWBIQUBVSSIWAM-OAQYLSRUSA-N 342.442 5.355 30 20 EKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 480549892 FRZQZUXSQOXJSA-FOIQADDNSA-N 349.434 5.003 30 20 EKED N#Cc1ccc(Oc2ncnc3scc(-c4ccccc4)c23)c(F)c1 486878172 IDAIRXRIKYVHPA-UHFFFAOYSA-N 347.374 5.161 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 490209488 NPNKCLTVZYPRJL-CQSZACIVSA-N 349.808 5.966 30 20 EKED C[C@@H]1C[C@]1(NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 503441338 ZQEYBSVRCRUDQV-QVKFZJNVSA-N 338.882 5.166 30 20 EKED CCN(C(=O)CC(C)(C)c1ccc(C)cc1)[C@H](C)c1ccc(C#N)cc1 509562460 XBZTUPAFCGFERE-GOSISDBHSA-N 348.490 5.144 30 20 EKED N#CCc1cccc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)c1 517620938 KIIVAMGABYBBJJ-UHFFFAOYSA-N 337.382 5.137 30 20 EKED CCOc1cc(Cl)ccc1NCc1cccc(OCCCC#N)c1 531835760 CARKLUSXEIQZNT-UHFFFAOYSA-N 344.842 5.033 30 20 EKED C[C@H](c1ccc(C#N)cc1)N1CCC[C@H](c2nc3ccccc3s2)C1 533013018 APJPWITWFLNMGH-QAPCUYQASA-N 347.487 5.109 30 20 EKED C=CCC[C@H](NCc1ccnc(OCc2ccccc2)c1)c1ccco1 552050093 PTOOJASZHFAHAH-FQEVSTJZSA-N 348.446 5.051 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)ccc1Cl 565670491 PPJKLVOWFCPHJP-LBPRGKRZSA-N 331.246 5.205 30 20 EKED Cc1cc(Cl)cc(C)c1CN[C@@H](CCCC#N)c1ccccc1 568423578 BVFHYXFGICZHOY-FQEVSTJZSA-N 326.871 5.482 30 20 EKED Cc1cc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)sc1Br 586778354 ZYXVJUWMRMXYQN-NWDGAFQWSA-N 349.297 5.103 30 20 EKED C=CCOc1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)cc1 604892262 NZZRDKXQXFXLRI-NRFANRHFSA-N 349.499 5.387 30 20 EKED C[C@@H](N[C@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 609825276 OUQOQQZCZUMABJ-NTKDMRAZSA-N 340.470 5.583 30 20 EKED Cc1ccc(C(=O)/C=C\c2c(-c3ccccc3)nn(C)c2Cl)s1 734752549 GHELTZBQJXVMIX-KTKRTIGZSA-N 342.851 5.007 30 20 EKED Cc1ccc(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)cc1C 745687615 KTTRLVOKVLMFQU-UHFFFAOYSA-N 337.492 5.035 30 20 EKED N#Cc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)s1 748998871 SWJZGGQNQZDTBD-DHZHZOJOSA-N 347.411 5.147 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C3\CC[C@H](C)C3)n2)cc1 753801719 LFAMEAMZVKYENQ-FPZAFUISSA-N 336.460 5.041 30 20 EKED CC(C)(CCC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 754522758 ADTCITOYJAELKV-MRXNPFEDSA-N 348.471 5.231 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(SC(C)C)cc1)c1ccncc1 766022565 XECVEJWIMBMODN-JXFKEZNVSA-N 326.509 5.550 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)CC(C)(C)C#N 783135631 DOPQOQSRRNUERW-UHFFFAOYSA-N 326.827 5.194 30 20 EKED CC(C)(C#N)[C@H]1CCCC1=NNc1ccnc2cc(Cl)ccc12 814693656 BPEDXLWYEZPPRS-AWEZNQCLSA-N 326.831 5.006 30 20 EKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 836190813 AVWIMWIMEQIRNO-KXBFYZLASA-N 347.422 5.306 30 20 EKED Cc1ccc(-c2ccccc2C=NNc2ccc(C(=O)O)cc2)c(C)c1 1776013900 VTXQYMAXNREOQI-UHFFFAOYSA-N 344.414 5.115 30 20 EKED CC(CCCCCCC(=O)O)=NNc1ccc(Cl)cc1Cl 1776029688 MWUMVBNHVVAAEM-UHFFFAOYSA-N 331.243 5.206 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(F)c(C(=O)O)cc2F)cc1 1776699957 KFYOJMSXPAEQBT-LAUAKBEESA-N 344.357 5.073 30 20 EKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(Br)c1 37284481 CXFQXAJPMXRDTH-ACJLOTCBSA-N 343.268 5.123 30 20 EKED N#CCc1ccc(NCc2cccc(OCc3ccccc3F)c2)cc1 237836260 XBAQOPGQFLUAAD-UHFFFAOYSA-N 346.405 5.083 30 20 EKED N#C[C@@H](NC(=O)CCC1CCCCC1)c1cccc(Cl)c1Cl 303375804 LGTMYPZEHLWIIR-OAHLLOKOSA-N 339.266 5.035 30 20 EKED CC1(C)CC[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340444165 GQASTBBTQVQZJD-YADHBBJMSA-N 332.491 5.824 30 20 EKED Cc1cc2c(cc1C)[C@@H](N[C@@H](CCC#N)c1ccccc1)CCS2 427519359 OSIRJUZODHNWFO-PMACEKPBSA-N 336.504 5.475 30 20 EKED C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc2ccccc2c1 439782779 PVMCXQDGPGBGER-INIZCTEOSA-N 342.442 5.383 30 20 EKED CCN(Cc1ncc(-c2ccc(C)cc2)o1)[C@H](C)c1ccc(C#N)cc1 441241781 ZBYAGASUJRSCJD-QGZVFWFLSA-N 345.446 5.105 30 20 EKED CC(C)(C#N)CCCN1CCC(Sc2ccc(Cl)cc2)CC1 441393819 NEFGYAUSGAJUGZ-UHFFFAOYSA-N 336.932 5.226 30 20 EKED C[C@H](SCc1ncc(-c2ccccc2F)o1)c1cccc(C#N)c1 443161065 RJWHWUNUMVUNIM-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED C=CCC[C@H](N[C@@H](C)c1nccnc1C)c1ccc(C(F)(F)F)cc1 446941617 MBBRWFNSQPPSNI-YOEHRIQHSA-N 349.400 5.162 30 20 EKED CC(C)[C@@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 460169344 KETHWSVLXZQJNC-OAHLLOKOSA-N 340.854 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCCCC(=O)C1 487313480 UIKFKCLIIHQRDA-QGZVFWFLSA-N 327.468 5.017 30 20 EKED CCN(C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 509576180 SYZTVQVOIFROGH-LBPRGKRZSA-N 347.245 5.088 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 520637621 WLLYUUAKZRUKKB-CQSZACIVSA-N 345.826 5.052 30 20 EKED C=CC1CCN(C(=O)Nc2ccccc2Oc2cccc(F)c2)CC1 522095873 YTXIVVMYFWBQMS-UHFFFAOYSA-N 340.398 5.048 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(C)ccc2[nH]1 530458250 BWELICQWQUEATL-UHFFFAOYSA-N 332.447 5.581 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCCC(C)(C)C1 535157963 RICFIUZNOQWHNE-HUUCEWRRSA-N 330.497 5.236 30 20 EKED CCc1c(C)sc(NC(=O)c2cccc(-c3ccoc3)c2)c1C#N 536326684 XXGSLSSSUIPZPI-UHFFFAOYSA-N 336.416 5.003 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(OCc2ccccc2)cc1 558249070 XCLYHQZZOODRCE-GOSISDBHSA-N 336.479 5.246 30 20 EKED Cc1c(C(=O)Nc2ccccc2CC#N)oc2c1ccc1ccccc12 581138587 SSTUIYAKJBAHLN-UHFFFAOYSA-N 340.382 5.213 30 20 EKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)CCCCCC#N)o1 588759943 AHHGBHYFNRJDQW-UHFFFAOYSA-N 330.815 5.321 30 20 EKED C=CCCCCCN(C)C(=O)c1cc2ccccc2c2cccnc12 606814871 VJCWTNSNOHLQPN-UHFFFAOYSA-N 332.447 5.206 30 20 EKED N#Cc1cccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)c1 609544504 WIFGOZUXIXEELI-RUZDIDTESA-N 348.449 5.591 30 20 EKED Cc1ccc(F)c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 609986171 XILNIERFMHHEQA-UHFFFAOYSA-N 345.377 5.002 30 20 EKED C=C[C@@H](CC(=O)N1CC2(CCCC2)[C@H]1c1ccco1)c1ccccc1 617917761 IEUDDSJLAFDYNX-LAUBAEHRSA-N 335.447 5.083 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCCC2)cc1)c1nc(C2CC2)cs1 647379789 NRMJWXBJBSFHKV-KRWDZBQOSA-N 336.460 5.168 30 20 EKED COc1cc(C)ccc1C(=O)/C=C\c1csc(-c2cccs2)n1 728439781 FPCXVCOVYARQNR-VURMDHGXSA-N 341.457 5.085 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cccc(Cl)c1Cl 734979276 AQCPZGHSXXLNNL-CLFYSBASSA-N 328.198 5.438 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3ccc(Cl)s3)c2)s1 740012142 YIHCCVGJALWJAK-UHFFFAOYSA-N 344.892 5.291 30 20 EKED CC(=NNc1nccc2sccc12)c1cccc(-c2ccncc2)c1 741462125 XWIPNJMSCYGVRC-UHFFFAOYSA-N 344.443 5.194 30 20 EKED Fc1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1F 743442573 AQXXJPIHTZTCJZ-UHFFFAOYSA-N 335.568 5.371 30 20 EKED C=CCC[C@@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792099858 ANBOIDDEGGYYOO-RTWAWAEBSA-N 340.426 5.161 30 20 EKED FC(F)c1ccc(C=NOCc2ccc(C(F)(F)F)cc2)cc1 794522883 GQTANOVUNOOUKS-UHFFFAOYSA-N 329.268 5.194 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)OC(=O)CCCC#N 812997811 GTCASRIFMWJNNO-GFCCVEGCSA-N 348.855 5.070 30 20 EKED CCCCCCCC[C@H](C)C(=O)N[C@H](CC(=O)O)c1ccc(C)cc1 1776786167 STLJDEXSKKJQAE-PKOBYXMFSA-N 347.499 5.014 30 20 EKED C=CCn1c(SCc2cccc3cccnc23)nc2ccccc21 29866910 WQNDGFIXORJRPG-UHFFFAOYSA-N 331.444 5.063 30 20 EKED N#CCC[C@@H](Nc1ncc(C(F)(F)F)cc1Cl)c1ccccc1 301764804 CNGCGHGWDLRILX-CQSZACIVSA-N 339.748 5.211 30 20 EKED C[C@@]12CC3CC(C(O)=Nc4ccc5c(c4)C(O)=NC5)(C1)C[C@](C)(C3)C2 328662875 XPKAWBQTMNBPMC-SWOGZVPRSA-N 338.451 5.089 30 20 EKED C=CCC[C@@H](NCc1ccc(-c2csc(C)n2)o1)c1ccco1 353402084 JQKNEZCRKUWBCH-OAHLLOKOSA-N 328.437 5.102 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(-c2ccco2)nc1C 410355354 ZYOZTFLFQDUEFL-UHFFFAOYSA-N 332.403 5.021 30 20 EKED C[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 429755692 HXHUANROCSPLGV-CRAIPNDOSA-N 349.434 5.003 30 20 EKED C=CCC[C@@H](NC(=O)N(C1CC1)[C@H](C)c1ccco1)c1ccccc1 435760197 KGRBUCXUJLGHOR-VQIMIIECSA-N 338.451 5.222 30 20 EKED CCO[C@@H](C)c1nc(CSCCCCC(C)(C)C#N)cs1 435893353 PJEHLZYEWFNHLB-ZDUSSCGKSA-N 326.531 5.194 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 449444532 BNKAALYNLRMOHG-UNQWWWNPSA-N 336.401 5.013 30 20 EKED CC(C)(C#N)CCCN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 472437764 CCRQTMVALKVCTK-MRXNPFEDSA-N 325.283 5.460 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccc(F)cc1 475576941 BPXLKCPYNZTYIQ-UHFFFAOYSA-N 340.442 5.042 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc2cc[nH]c12 475577489 YRFNYPLOFVNCJU-UHFFFAOYSA-N 347.462 5.342 30 20 EKED C=CCC1(C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)CCC1 478332339 AXBXCVGAQBWPSS-UHFFFAOYSA-N 349.927 5.170 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCC[C@@H](C)C1 530402002 JJXSWRVBTKWMPK-AEFFLSMTSA-N 329.484 5.072 30 20 EKED C=CCC[C@H](N[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 537948129 XWPLMZJHRYFPKP-WFASDCNBSA-N 340.414 5.520 30 20 EKED N#CCCSc1ncnc2cc(-c3ccc(Cl)cc3)sc12 549463939 YQLCYJUBQCRLDF-UHFFFAOYSA-N 331.853 5.017 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 552343084 ZKFWDHJQGMOUKR-QRWLVFNGSA-N 338.476 5.418 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc(F)c3ccccc3c2)cc1 559002743 YSONWMFDFLLWSQ-UHFFFAOYSA-N 332.378 5.032 30 20 EKED C/C(=C/c1cccc(C(F)(F)F)c1)CNCC1CCC(C#N)CC1 563747859 QTOVFOVAJAXIEY-ZROIWOOFSA-N 336.401 5.028 30 20 EKED N#CC1(Cc2nc(-c3c(Cl)cccc3Cl)no2)CCCCC1 594729491 LFBLLZUHPZPKKC-UHFFFAOYSA-N 336.222 5.060 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 606934714 JXVVCBDUFQESHS-UHFFFAOYSA-N 346.805 5.152 30 20 EKED C[C@H](NCc1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1F 618305230 KXUUQZWJPCWWGV-AWEZNQCLSA-N 336.435 5.277 30 20 EKED Cc1c(C(=O)/C=C/c2cnc(-c3ccccc3)[nH]2)oc2ccccc12 742431174 DQJJBFQRNZZHNF-VAWYXSNFSA-N 328.371 5.027 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747193623 KVKWLHOIHXZEPX-PBHICJAKSA-N 340.492 5.199 30 20 EKED Cc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1F 760366150 UONAHLOFCLMVNV-HXUWFJFHSA-N 344.389 5.042 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(N2CCCC2=O)cc1)c1ccccc1 773077025 PRMDSWWGINNNQE-AVRDEDQJSA-N 348.490 5.172 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(OCC(F)(F)F)cc2)cc1 774279867 XMPPURRADGDFTL-UHFFFAOYSA-N 348.368 5.041 30 20 EKED N#CC1(CCCC[S@](=O)Cc2c(Cl)cccc2Cl)CCC1 899278475 SXKYZZSYOVTBBQ-NRFANRHFSA-N 344.307 5.106 30 20 EKED N#CC1(CCCC[S@](=O)Cc2cccc(Cl)c2Cl)CCC1 899404841 GNZVVNDIEUCPBI-NRFANRHFSA-N 344.307 5.106 30 20 EKED CCCCC1CCC(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)CC1 916848097 AVHLXDFJIUETJS-KVZIAJEVSA-N 334.463 5.408 30 20 EKED C=CCC[C@H](N[C@H](C)c1cccc(N2CCCC2=O)c1)c1ccccc1 358325563 FIXWYWBUPYCFAR-GCJKJVERSA-N 348.490 5.172 30 20 EKED C[C@H](N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 435664576 MXJZMXDEFYYYRR-IXDGSTSKSA-N 344.380 5.174 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NC(=O)c1cc(C#N)oc1C 436133833 DDGDYMBTDNDSDV-UHFFFAOYSA-N 348.427 5.172 30 20 EKED N#Cc1ccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)cc1 521954215 FVWQODZAHWNOHN-UHFFFAOYSA-N 332.790 5.131 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(-c2ccccc2)o1 536737675 QLBYMASXZJYBCP-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2cc(F)ccc2o1 605079826 RTZVYELLMHKPCQ-UHFFFAOYSA-N 349.814 5.115 30 20 EKED Cc1cccc(COc2ccc([C@H](C)Nc3ncccc3C#N)cc2)c1 609040322 WGFCAZQCGFUMGM-KRWDZBQOSA-N 343.430 5.014 30 20 EKED C[C@H](Nc1cccc(C#N)n1)c1ccc(Oc2ccccc2)c(F)c1 609894754 PIHOFHKFIRXMCP-AWEZNQCLSA-N 333.366 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@]12CCCC[C@@H]1C2(F)F 613902279 ZATIJLYCPOSKOT-PXNSSMCTSA-N 347.449 5.693 30 20 EKED CC(C)(C#N)c1ccc(CNC(C)(C)c2ccc(Cl)cc2)cc1 614173466 XTPZYIOVZQSYJP-UHFFFAOYSA-N 326.871 5.166 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccccc3)s2)cc1 727974082 FMQMRDICWZZWKT-MDWZMJQESA-N 335.428 5.023 30 20 EKED CCN(Cc1ccc(O[C@H](C)C#N)cc1)[C@@H](C)c1cc2ccccc2o1 769081620 LFJKJEAPPKQBQJ-SJORKVTESA-N 348.446 5.307 30 20 EKED Cc1ccc(NC(=O)OC(C)(C)C)cc1OCCCC(C)(C)C#N 769562440 NTUMSNISXPZWPP-UHFFFAOYSA-N 332.444 5.051 30 20 EKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NN[C@H](C)C(C)(C)C 793114430 GUYDCBCJIIQWCM-CQSZACIVSA-N 346.906 5.007 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2c(cc1O)CCCC2 815636349 TTZMKNSKYMVHDD-HTAPYJJXSA-N 348.490 5.357 30 20 EKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)cc1 845553404 RMLCLSUXHCVUAT-RISCZKNCSA-N 346.883 5.074 30 20 EKED CC1(C)CCC/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C1=O 1776550846 KPUKYOJMBUIYDV-MOSHPQCFSA-N 348.442 5.143 30 20 EKED Cc1cccc2c1[C@@H](C)/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1777455844 FTVKNMKQPPPUOO-PFSWGADMSA-N 348.423 5.291 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 108240368 NUZZHSMFPLEXMC-CVEARBPZSA-N 338.476 5.071 30 20 EKED Cc1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)c(C)c1 118176674 RYULOGXJXPYVMR-AWEZNQCLSA-N 335.432 5.078 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c(F)c1 153672246 CLJFVMVTRYKIEE-NSHDSACASA-N 348.830 5.126 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 158606030 BTTWKYJJPGMXEC-UHFFFAOYSA-N 341.455 5.169 30 20 EKED C[C@H](OC1CCCCCC1)/C(O)=N/[C@@H](C)c1ccc2ncsc2c1 330122272 HGZJEBOBFCLXSF-KBPBESRZSA-N 346.496 5.442 30 20 EKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 410011305 RMKLHCWIOGLNAN-NSHDSACASA-N 348.233 5.090 30 20 EKED Cc1ccnc(Oc2cc(NCc3cccc(F)c3C#N)ccc2C)c1 427402688 CRRMFQRNVAMVIX-UHFFFAOYSA-N 347.393 5.114 30 20 EKED CSc1ccccc1NC(=O)c1sc2ccc(C#N)cc2c1C 429929300 VNAWKZUBGRDYRS-UHFFFAOYSA-N 338.457 5.056 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(SCC(F)F)cc1 442871629 XBEHBCYWBSFQMR-WLYUNCDWSA-N 338.467 5.024 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 464447933 UIFQHVKUUOZOBX-SUMWQHHRSA-N 333.884 5.209 30 20 EKED C=CCOc1ccccc1CN[C@@H](C)c1cccc(-c2ccncc2)c1 482867992 JRHVJLUPSJQCDL-SFHVURJKSA-N 344.458 5.164 30 20 EKED N#Cc1cc(C(=O)Nc2ccccc2-c2ccccc2)ccc1Cl 537166809 DAOGKLHXYPVYDH-UHFFFAOYSA-N 332.790 5.131 30 20 EKED N#CCC[C@@H](C#N)CNc1cccc(Sc2ccc(Cl)cc2)c1 581046417 LDSPLPSVODURAW-AWEZNQCLSA-N 341.867 5.347 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCC(C)(C)CCC#N 583650239 PXYJWXCGPVVYFK-ZDUSSCGKSA-N 345.487 5.238 30 20 EKED CC1=CC[C@](C)(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 598810429 GNMJEROGWLYWFB-KXBFYZLASA-N 328.481 5.013 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 606915884 FKUDFBJNKSSXTO-CQSZACIVSA-N 342.405 5.154 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccc(-c2cccs2)cc1 610812849 WTJQTYZHEKXEPE-CQSZACIVSA-N 336.435 5.277 30 20 EKED C[C@@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccc(C#N)cc1 611167000 NQYXGDBCKRNGIV-DIFFPNOSSA-N 331.246 5.203 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)ccc3C)n2)cc1 612894680 HMGPWGYZONTTJK-SFHVURJKSA-N 346.455 5.225 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cccc(O)c2)CC3)cc1 727654111 HOQPMBRKOVAROZ-WJDWOHSUSA-N 347.439 5.037 30 20 EKED COc1ccc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc1 734303445 PTQZPIPXQJKGOQ-VAWYXSNFSA-N 335.428 5.023 30 20 EKED C[C@H]1CC(=NNc2nccc3sccc23)c2ccsc2S1 743438160 KIKXTXGUAJNBET-VIFPVBQESA-N 331.491 5.058 30 20 EKED CC(C)[C@@H]1CCc2ccccc2[C@H]1NCc1ccc(O[C@H](C)C#N)cc1 764977283 NBTNNGIQRZMRRY-FHZYATBESA-N 348.490 5.027 30 20 EKED Cc1ccc(C)c2c1CC/C(=C/c1cnc(-c3ccccn3)s1)C2=O 769746820 QGUXGHKDRZCOBI-PTNGSMBKSA-N 346.455 5.034 30 20 EKED C=CCc1cc(CN[C@H](CCC)c2ccsc2)cc(OC)c1OC 785564254 AEJIYUHPAAVKKN-GOSISDBHSA-N 345.508 5.125 30 20 EKED Cc1c(C(=O)/C=C/c2ccc(C(F)F)cc2)cnn1-c1ccccc1 794939181 UAHXEBQWZDBHQU-FMIVXFBMSA-N 338.357 5.014 30 20 EKED N#CCCC[C@H](NC(=O)OCc1cccc(Cl)c1)c1ccccc1 859168517 KABXVKGXZWMNJU-SFHVURJKSA-N 342.826 5.001 30 20 EKED N#Cc1ccc(N2CCC[C@H]2c2ccccc2C(F)(F)F)c(F)c1 864006696 LWWNEFKIXFAZFG-INIZCTEOSA-N 334.316 5.058 30 20 EKED Cc1c(NCc2cccc(OCCCC#N)c2)cccc1C(F)(F)F 864025054 MGAIENRJQGPSRT-UHFFFAOYSA-N 348.368 5.309 30 20 EKED CCCCC[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352022 IFTAVJXXLZXAFO-LAUBAEHRSA-N 349.478 5.432 30 20 EKED N#CC1(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCCCC1 920020471 XTWDMZBNZLLPAA-UHFFFAOYSA-N 332.407 5.515 30 20 EKED O=C(O)c1ccc(C(=O)/C=C\c2sc3ccccc3c2Cl)s1 1777671628 CFKHMGLFKIQLLR-WAYWQWQTSA-N 348.832 5.211 30 20 EKED CC(C)c1ccc(NCC(=O)Nc2ccc(CC#N)cc2)c(C(C)C)c1 29641916 ZNJYXHCEHQVGFH-UHFFFAOYSA-N 349.478 5.050 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(C)s2)ccc1SC(F)F 63874749 RZBOIQQVKMMQRH-VOTSOKGWSA-N 340.416 5.276 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2occc2-c2ccccc2)n1 80458043 QLAUDCVXBXBFLL-OAHLLOKOSA-N 336.416 5.017 30 20 EKED C#CCCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 120221395 GKLJINMXKQCBNE-UHFFFAOYSA-N 348.471 5.463 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cc(F)cc(F)c1 151242345 KGGSLUOUWNQRNZ-LLVKDONJSA-N 347.390 5.003 30 20 EKED N#Cc1csc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 177682591 ZFTFJAUHTBVXQG-NRFANRHFSA-N 344.439 5.245 30 20 EKED CC/C=C/CCSCC(=O)Nc1ccccc1S[C@H](C)CC#N 185719243 FSMIEOJUMQJJLA-MBVDDHJVSA-N 348.537 5.109 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C2CC2)c1C 188059155 FUUBCIYGYHREPG-UHFFFAOYSA-N 336.479 5.544 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1c[nH]c2ccccc12 189909160 RKMNRGNAEUXOBQ-UHFFFAOYSA-N 346.474 5.591 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(C)s2)ccc1SC(F)F 214923442 RZBOIQQVKMMQRH-SREVYHEPSA-N 340.416 5.276 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@H]3CCC(=O)C[C@H]3C)n2)s1 328909064 DKEQNLBQXWQIKY-MFKMUULPSA-N 348.493 5.027 30 20 EKED CC(C)=CCSc1ccccc1C(=O)Nc1cccc(C#N)c1C 432321532 GJEMIGKRXCVUBG-UHFFFAOYSA-N 336.460 5.177 30 20 EKED N#CC1CCN(Cc2ccccc2Oc2ccc(F)cc2Cl)CC1 461811293 RYLNYTJSZSHUCN-UHFFFAOYSA-N 344.817 5.007 30 20 EKED N#Cc1cccc(SCc2ccc(C(=O)Nc3ccccc3)cc2)c1 468643428 YMNFSTIATYNCAB-UHFFFAOYSA-N 344.439 5.103 30 20 EKED N#CCc1ccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)cc1 521952985 IQUUWUTYAMUFOW-UHFFFAOYSA-N 346.817 5.325 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 556076295 JZGJLJMTEIFIFF-LBPRGKRZSA-N 335.781 5.576 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cncs1)c1ccc(C(F)(F)F)cc1 557274814 ZIWRYSPWQHVJJQ-SWLSCSKDSA-N 340.414 5.520 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1F 559837835 SCWAWMAUVUMOQA-KBPBESRZSA-N 336.385 5.401 30 20 EKED C=CCCCCCN(C)C(=O)c1oc2ccccc2c1CSC 610051355 PNNWAQZUDHJYLY-UHFFFAOYSA-N 331.481 5.114 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)cc1Cl 619746981 XJWYPWGSNXYLKK-JTQLQIEISA-N 339.653 5.369 30 20 EKED Cc1cc(C)cc(C(=O)/C=C\c2csc(-c3cccs3)n2)c1 730438062 YEVOIZBBTQLFCC-WAYWQWQTSA-N 325.458 5.385 30 20 EKED CC(/C=C/C(=O)c1cccc(-c2ccncc2)c1)=C\c1ccccc1 741471181 XCMXHRMGLJPQJF-UKRGKPDNSA-N 325.411 5.591 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 766350652 NKORMMIAIOKRGY-CVEARBPZSA-N 340.854 5.101 30 20 EKED Cc1cccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)C(C)(C)C)c1 776163487 RZTPYDCPSSRVIO-UWJYYQICSA-N 336.479 5.335 30 20 EKED C#CCCCCCC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 780398981 URMWHHVYYVSCOI-GOSISDBHSA-N 334.463 5.382 30 20 EKED Cc1cc(Cl)cc2c1OCC/C(=C/c1scnc1C1CC1)C2=O 782348182 QGESAPNJSJVGBQ-GHXNOFRVSA-N 345.851 5.031 30 20 EKED C[C@H](NCc1ccnc(Cl)c1)c1ccc(-c2cccc(C#N)c2)cc1 782525499 YYTNPSKLOAMAPR-HNNXBMFYSA-N 347.849 5.124 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccnc(Cl)c1 853396984 KJZNKPKBDNZYEC-UHFFFAOYSA-N 347.690 5.188 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)cc(Cl)cc1C 1776783263 LMJBWGOIRQGTCE-QGZVFWFLSA-N 339.907 5.250 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CC1CCCCC1 66954312 AWGFXVMHNZFMRC-OAHLLOKOSA-N 345.512 5.125 30 20 EKED Cc1ccccc1Sc1ccc(C(=O)[C@H](C#N)c2ccccn2)cc1 122397023 XWMTVNFHKKHULV-GOSISDBHSA-N 344.439 5.031 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1cccc(C#N)c1 177391376 LJENSLQFDXEKJN-KSFYIVLOSA-N 330.406 5.138 30 20 EKED N#CCCC[C@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 353894746 ACGGTHMCAZTCCS-HNNXBMFYSA-N 338.398 5.292 30 20 EKED Cc1ccc(-c2nnc([C@H](C)S[C@@H](C)c3ccc(C#N)cc3)o2)cc1 419425796 PSQAGVKDIDDDIF-GJZGRUSLSA-N 349.459 5.472 30 20 EKED CC(C)c1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)nc1 463466862 QJXBXRMHGXBFFO-UHFFFAOYSA-N 347.443 5.057 30 20 EKED CC(C)C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cccs1 475113039 FOXLTTTYPGPLOK-ROUUACIJSA-N 340.492 5.039 30 20 EKED C=C[C@@H](CC(=O)N(CCC)[C@@H]1CCCc2cccnc21)c1ccccc1 475953218 HPDUMYQRQXUZLJ-GHTZIAJQSA-N 348.490 5.058 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2sccc2Cl)cc1 487561311 OXWRDVJIVVTHGI-UHFFFAOYSA-N 338.863 5.230 30 20 EKED CC(C)c1ccc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 504372876 YHKPIUDQOOFRLL-MRXNPFEDSA-N 349.478 5.494 30 20 EKED CCCC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(OC)cc1 512620686 SDAVHVSIDJBYAT-BTYIYWSLSA-N 340.442 5.288 30 20 EKED COc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(C#N)cc1F 512666276 JOQUPJAZEKQMOK-YWZLYKJASA-N 340.442 5.144 30 20 EKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1 561279925 WGOPMVJJSXDDNH-QIJUGHKUSA-N 346.474 5.074 30 20 EKED C[C@H](N[C@@H](C)c1ccc(F)cc1C(F)(F)F)c1ccc(C#N)cc1 599024435 QFKJHIKULGZNIC-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C=CCCCN(C)C(=O)Nc1cc(C)ccc1SCC(F)(F)F 605939446 XQCRQSRWNSNOEM-UHFFFAOYSA-N 346.418 5.079 30 20 EKED CC(C)COc1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619754654 GTAMAFRQRQUMSG-HNNXBMFYSA-N 342.870 5.097 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1 735793276 RRNJGBDSJWDEJP-GOEBONIOSA-N 325.456 5.044 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc2ccccc2n1 756518014 ASLDQBOLMHMBTB-AITUJVMLSA-N 332.447 5.018 30 20 EKED O=[N+]([O-])c1ccccc1NN=Cc1c(Cl)ccc(Cl)c1Cl 818197860 KLCREZYDRPNWJE-UHFFFAOYSA-N 344.585 5.001 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3ccsc3)cc2)cc1 921011598 ZDOISPVSELOCNS-XCVCLJGOSA-N 346.411 5.064 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C\c1c(C)cc(C)cc1C 1776783334 QTBCOPODOMEIDT-ZZLBYYGFSA-N 345.527 5.418 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 43170690 AYNWJAUYGZXWTG-INIZCTEOSA-N 349.478 5.688 30 20 EKED C=CCCC[C@@H](C)NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C 181398431 ANDUMSJYBKCSIP-HIFRSBDPSA-N 337.533 5.022 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1 181886985 CORRUVKUGVDCPC-KSFYIVLOSA-N 330.406 5.138 30 20 EKED Cc1nc(C(C)C)ccc1CNc1ccccc1S[C@H](C)CC#N 453098075 ZBLMDZVYLZYNME-OAHLLOKOSA-N 339.508 5.520 30 20 EKED C[C@@H](NCc1cccc(OCC2CCCCC2)c1)c1ccc(C#N)cc1 477207325 PMIQGLGHSDMFMV-GOSISDBHSA-N 348.490 5.368 30 20 EKED CCN(Cc1nc(-c2ccccc2)oc1C)[C@@H](C)c1ccc(C#N)cc1 497620078 MJVMPKJMTJUUII-INIZCTEOSA-N 345.446 5.105 30 20 EKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(C2CCCCC2)cc1 505726447 LIBSTJSAIBEEMN-DEOSSOPVSA-N 345.552 5.703 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(OC(F)F)cc1F)c1ccccc1 512451496 HZTPWKFTYVVYNC-OAHLLOKOSA-N 349.352 5.116 30 20 EKED N#Cc1ccc(SCc2csc(C3CCCCC3)n2)c(F)c1 525629193 ONJWPXBPQMYEPO-UHFFFAOYSA-N 332.469 5.494 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1)c1ccccc1 536204803 PPDYXXWTABAVBS-POAQFYNOSA-N 337.463 5.248 30 20 EKED COc1ccc(Cl)cc1[C@@H](C)Nc1cccc(OCCCC#N)c1 539627381 UWUNORPDQYLXIT-CQSZACIVSA-N 344.842 5.204 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1c(C)[nH]c2ccccc12 552112631 MXXQGCVNGNSSTC-UHFFFAOYSA-N 344.867 5.020 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccc(SC2CCCC2)cc1 554118318 RQQLPUXJKKJUJS-UHFFFAOYSA-N 345.512 5.173 30 20 EKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc4ccccc4s3)sc12 554770863 FTOHKZIZSUMAMO-ZDUSSCGKSA-N 348.452 5.310 30 20 EKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)cc2c1 562172616 XMNCURAMXSWRCZ-ZDUSSCGKSA-N 340.473 5.280 30 20 EKED C[C@H](NC1(c2ccc(Cl)cc2)CCC1)c1ccc(C#N)c(F)c1 575337588 YEOQPGLGVXBEBY-ZDUSSCGKSA-N 328.818 5.081 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2)cc1 591698481 AWIARPIIIMCGET-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COCc1cccc(C)c1 622851662 GPOXMWJZENOFRJ-UHFFFAOYSA-N 337.463 5.002 30 20 EKED CCC(CC)CN(CCC#N)C(=S)Nc1ccc(C(C)C)cc1 729641977 AOXGWHJNDQKOHX-UHFFFAOYSA-N 331.529 5.159 30 20 EKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1ncc(C(C)(C)C)o1 756844188 CAADPVKGGRGHHV-ZDUSSCGKSA-N 340.423 5.392 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1cc(Cl)ccc1OC)c1ccncc1 766021827 UVVLNHKGDLUTTI-ZWKOTPCHSA-N 330.859 5.102 30 20 EKED CCOc1ccc(O)c(C=Nc2ccc(Oc3cccnc3)c(C)c2)c1 920178378 PHXGOOAJTVHXCM-UHFFFAOYSA-N 348.402 5.037 30 20 EKED Cc1ccc2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)[nH]c2c1 66856340 IBLBVOBBCKEIOB-CQSZACIVSA-N 349.459 5.123 30 20 EKED COc1cc([C@@H](C)N[C@H](CCC#N)c2ccccc2)ccc1SC 90665792 ZLFGUKZXGVYQKY-CRAIPNDOSA-N 340.492 5.113 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccccc1 352179714 AYBGIEDCABGERA-LJQANCHMSA-N 344.414 5.112 30 20 EKED Cc1ccc(-c2ccc(C)c(NC(=O)[C@@H](C)c3cccc(C#N)c3)c2)o1 462323874 AWHNDVPSZQQMNV-INIZCTEOSA-N 344.414 5.177 30 20 EKED C=CCC1(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2C)CCC1 477828515 WYYRZKSOENTGQJ-QGZVFWFLSA-N 326.484 5.059 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Cl)cn1 480149205 OEZOHIDFYBEMNP-OAHLLOKOSA-N 347.849 5.124 30 20 EKED Cc1ccc([C@@H](Nc2c(Cl)cccc2C#N)c2ccccn2)cc1 480579649 LEXAPVUYFXGWFP-HXUWFJFHSA-N 333.822 5.117 30 20 EKED C=CC[C@H](C(=O)Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1 488615440 ASJMBMCIIRFQDR-KRWDZBQOSA-N 332.403 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc(Cl)nc1 492041384 KVSAPHJUOXVYFY-BENRWUELSA-N 340.854 5.239 30 20 EKED CCc1cccc2c(C3CCN(CC(C)(C)CCC#N)CC3)c[nH]c12 511472276 LCSUBWXIOFOANG-UHFFFAOYSA-N 337.511 5.240 30 20 EKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)sc12 515505422 XHLRANHGMBNNNS-ZDUSSCGKSA-N 340.473 5.280 30 20 EKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c2c1 554320415 YQXCPTBTYJHRRO-OAHLLOKOSA-N 344.370 5.187 30 20 EKED C=CCC[C@H](NCc1ccc(Oc2ccccc2)nn1)c1ccccc1 561160521 HPAUUPDVWGIHJU-NRFANRHFSA-N 345.446 5.066 30 20 EKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C2CCC2)cc1 581880945 MVHKAXRSMOKWET-HNNXBMFYSA-N 333.435 5.051 30 20 EKED COc1ccc([C@@H](NCCCCC(C)(C)C#N)c2ccccc2)cc1 595637407 VNZXJGLWZWLUTO-NRFANRHFSA-N 336.479 5.094 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(CSC(C)C)c1C 596765994 PWJJNWROAOLICV-HDICACEKSA-N 344.524 5.352 30 20 EKED C[C@@H](Nc1ccc(Cl)cc1OCC(F)F)c1cccc(C#N)c1 600852982 CILGDSJMHGTDHC-LLVKDONJSA-N 336.769 5.029 30 20 EKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1(C)C 609428695 UXZITXCLZGWVFN-DAYGRLMNSA-N 342.508 5.258 30 20 EKED CC[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(Cl)cc1 609669044 GJIXAHZJIFCOKH-CYBMUJFWSA-N 339.748 5.189 30 20 EKED COc1c(Cl)cc(N=Cc2cc3ccccc3nc2O)cc1Cl 750949338 CXGYQMATYCSTLN-UHFFFAOYSA-N 347.201 5.006 30 20 EKED CCCCCC(C)(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 753221222 MYCWOTDPSOWDIT-OAHLLOKOSA-N 332.513 5.483 30 20 EKED Cc1cc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)cnc1Cl 760261448 CCMDENQCAFITKX-VOTSOKGWSA-N 334.872 5.002 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(Cl)ccc1OCC)c1ccncc1 766019869 NNRXTZDJYWQFRD-RDTXWAMCSA-N 330.859 5.102 30 20 EKED CCCCCCC[C@H](N[C@@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1 773153664 WDNGSXKCEJWSTP-FSSWDIPSSA-N 345.527 5.016 30 20 EKED C=CCCCCC[C@H](C)Nc1ccc(Cl)c(C[S@](C)=O)c1 793586591 JPMCWGAFOPMRIH-QKKBWIMNSA-N 327.921 5.155 30 20 EKED Cc1cccnc1[C@H]1CCCC(=NNc2ccc3ccccc3n2)C1 799104384 PQBMDOFNBXAISA-KRWDZBQOSA-N 330.435 5.064 30 20 EKED CCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 56745113 FIEDGTTZIRCMGO-HNNXBMFYSA-N 337.423 5.003 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 113570617 UKEVJYPQZIJIQD-AWEZNQCLSA-N 339.464 5.342 30 20 EKED CCCCCCCCCN(C)C(=O)Nc1ccc(C)c(NC(C)=O)c1 128403587 SRLSYQAESFJLAG-UHFFFAOYSA-N 347.503 5.168 30 20 EKED CCN(C(=O)[C@@H](C)c1cc2ccccc2o1)[C@H](C)c1ccc(C#N)cc1 176162061 DAOBUAPZXGDFDY-JKSUJKDBSA-N 346.430 5.018 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 185902275 MXNWJJJOPPXFJG-ZDUSSCGKSA-N 344.505 5.376 30 20 EKED C[C@@H](Nc1ccc(OC2CCCC2)cc1)c1ccc(OCC#N)cc1 192993426 YRJKDFMYRPQROZ-MRXNPFEDSA-N 336.435 5.083 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1occc1C 297973883 YZHXUFLXAYWIEX-UHFFFAOYSA-N 326.440 5.104 30 20 EKED OC(C[C@@H]1CCOC1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329808990 BXVGIQUOMDRPBC-ZDUSSCGKSA-N 348.418 5.009 30 20 EKED C=CCCc1ccccc1NCC(=O)Nc1c(C)cc(C)cc1Cl 409865793 FSDWAJKBWFQLOY-UHFFFAOYSA-N 342.870 5.126 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(F)c(Cl)cc1Cl 410359603 MWZVEQJWXHLAHR-UHFFFAOYSA-N 338.209 5.503 30 20 EKED CCC(C)(C)OCc1cccc(NC(=O)C2(C#N)CCCCC2)c1C 488787954 WJDUOUDFZZNABN-UHFFFAOYSA-N 342.483 5.113 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(CC(F)(F)F)cc1)c1ccccc1 489014834 RTDSJXOQQRTURR-QGZVFWFLSA-N 333.353 5.090 30 20 EKED N#CCC[C@@H](N[C@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 527876629 TWHHDIZUXDWNQW-MOPGFXCFSA-N 328.818 5.101 30 20 EKED C[C@@H](NC(=O)Nc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 543861381 LZUPGZGBYLUHAX-MRXNPFEDSA-N 341.414 5.108 30 20 EKED Cc1ccccc1C(NCc1cccc(C#N)c1)c1ccccc1C 546170620 KDCKTTDQTARHFH-UHFFFAOYSA-N 326.443 5.054 30 20 EKED Cc1c(F)cccc1-c1ccc(CNC2(c3cccc(C#N)c3)CC2)o1 551576985 XXQDDEPSXCTAGV-UHFFFAOYSA-N 346.405 5.045 30 20 EKED COc1cccc(CNc2ccccc2SC[C@H](C)C#N)c1Cl 594704749 GCUITYAJSDLZJR-CYBMUJFWSA-N 346.883 5.212 30 20 EKED CC(C)c1ccc(CS(=O)(=O)CCCC(C)(C)C#N)c(C(C)C)c1 610482629 UPRUCEQVKJVWSW-UHFFFAOYSA-N 349.540 5.178 30 20 EKED N#Cc1cccc(CN[C@H](c2ccc3ccccc3c2)C(F)(F)F)c1 611994214 GJTHMXQJCUBWPI-LJQANCHMSA-N 340.348 5.105 30 20 EKED Cc1ccc(NC(=O)C(C)C)cc1NCc1ccc(C(C)(C)C#N)cc1 614055376 HTCAUFVZUZDHIT-UHFFFAOYSA-N 349.478 5.003 30 20 EKED C[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1F 618305231 KXUUQZWJPCWWGV-CQSZACIVSA-N 336.435 5.277 30 20 EKED C=CCC[C@H](N[C@@H](C)c1c[nH]nc1C)c1ccc(C(F)(F)F)cc1 679357087 VMRPKACUUPSAOV-SJCJKPOMSA-N 337.389 5.095 30 20 EKED CCCCCCn1c(SC[C@@H](C#N)CCC#N)nc2ccccc21 726797186 XNHRUNHOHUDXAX-MRXNPFEDSA-N 340.496 5.152 30 20 EKED Cc1ccc(N(CCC#N)C(=O)c2cc3ccc(C(C)C)cc3[nH]2)cc1 726940854 WLORWQFMHIMTSU-UHFFFAOYSA-N 345.446 5.160 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cccnc2C)CC3)cc1 728787862 UXKNZXNKLJUPPJ-ATVHPVEESA-N 346.455 5.034 30 20 EKED C#Cc1cccc(NC(=S)N(C)[C@@H](c2ccccc2C)C(C)C)c1 732722355 AGJSZJONVYDIJM-HXUWFJFHSA-N 336.504 5.002 30 20 EKED COc1ccc(Cl)cc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741473231 ORSYZVBIVOQELK-FNORWQNLSA-N 349.817 5.307 30 20 EKED CC(C)c1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1 753142020 NBSHUYNQTXQLOX-KHPPLWFESA-N 334.444 5.225 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)c(F)c1 781107821 KTYBOZVSSNGXRO-VQHVLOKHSA-N 333.387 5.322 30 20 EKED c1ccc(CSc2cccc(CON=C3CCCOCC3)c2)cc1 808264161 RHVMYNAJIKIJOQ-UHFFFAOYSA-N 341.476 5.052 30 20 EKED CCCCCCCCSc1nnc([C@H]2COc3ccccc3O2)o1 915793853 OOWGTOOYGDUDSI-MRXNPFEDSA-N 348.468 5.035 30 20 EKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 93217922 XXEGQEFFGXRCAQ-NSHDSACASA-N 347.871 5.085 30 20 EKED CCC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccnc1 186224877 ZLXSZNMXEPDILJ-QHCPKHFHSA-N 341.458 5.251 30 20 EKED CC[C@@]1(C)CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 467569508 QOGDYLMDBKMMDI-NRFANRHFSA-N 349.434 5.004 30 20 EKED N#CC1(CCCNc2cc(Cl)c(Cl)c(Cl)c2)CCOCC1 582669874 FQOQTGWQUUJYJO-UHFFFAOYSA-N 347.673 5.159 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1ccc(C#N)cc1 599024436 QFKJHIKULGZNIC-VXGBXAGGSA-N 336.332 5.128 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 604906952 GPILISZQTFCKTO-IRXDYDNUSA-N 338.451 5.221 30 20 EKED C#Cc1cccc(NC(=S)N(CCCC)[C@H](C)c2ccc(C)o2)c1 726484970 HJWVAUYBSGLZNL-MRXNPFEDSA-N 340.492 5.129 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 729892414 YGFQUILHLWXNIH-GDBMZVCRSA-N 326.465 5.059 30 20 EKED CCN(C[C@@H](C)C#N)C(=O)c1sc2cc(C(C)C)ccc2c1Cl 732655312 OUJCFEGMXRRVCX-LBPRGKRZSA-N 348.899 5.300 30 20 EKED C=CC[C@H](NCc1ccc(-c2c(F)cccc2F)o1)c1ccncc1 734508519 ALMFJRNNBPOAFW-SFHVURJKSA-N 340.373 5.027 30 20 EKED C#CCCCC(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 758011521 TYRKEERJUFOKQQ-UHFFFAOYSA-N 346.474 5.072 30 20 EKED CCC(=CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)CC 759537881 KAFAIHSBJGVYSJ-OAHLLOKOSA-N 344.867 5.386 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(C(F)(F)F)cc1 760261693 GSBZZBFZAZMDRF-HJWRWDBZSA-N 337.366 5.326 30 20 EKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccc(C(F)F)cc2)cc1 794940615 BSEOXGVTHMHYQX-WCIBSUBMSA-N 338.357 5.014 30 20 EKED N#CC[C@@H](CC(=O)OCc1csc2ccccc12)c1ccccc1 795981770 DRZKBEUFDWXDOE-INIZCTEOSA-N 335.428 5.032 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccccc1SC(C)(C)C)c1ccncc1 815580187 FCGONVYYZLVPAW-VQIMIIECSA-N 340.536 5.940 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C)[C@H]1CCC[C@@H]1C#N 878545844 OPDKSUIATNKDEX-PBHICJAKSA-N 345.512 5.042 30 20 EKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 151709861 GUDACISLQGKTDJ-DYESRHJHSA-N 347.462 5.066 30 20 EKED C[C@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(C#N)cc1 181901523 IRYNMGVMYGDXCL-BTYIYWSLSA-N 347.849 5.047 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC1CCC(C)(C#N)CC1 449098371 JBUDZIHTMVBUTE-FNMUINPESA-N 339.508 5.242 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1[C@H]2CCCC[C@H]12 468055630 APRKCGMTDPIZLG-OALUTQOASA-N 346.430 5.034 30 20 EKED C[C@@H](SCc1ccc(F)cc1C#N)c1ncc(-c2ccccc2)o1 471418847 LSODGBPJVWWVDU-CYBMUJFWSA-N 338.407 5.347 30 20 EKED CCN(C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)c1ccc(C#N)cc1 509576179 SYZTVQVOIFROGH-GFCCVEGCSA-N 347.245 5.088 30 20 EKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1F 512664582 AIPUHSIEWPAWSI-CWTRNNRKSA-N 328.818 5.153 30 20 EKED CCC(CC)CN(CCC#N)Cc1csc(-c2ccsc2)n1 513736746 KSUZBNNNRQOUPT-UHFFFAOYSA-N 333.526 5.023 30 20 EKED N#Cc1ccc(F)c(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1 516818350 NACOHQOVKKXSCN-GOSISDBHSA-N 349.236 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cn(C)c2ccccc12 530401978 XNIQEHZQSXLILA-UHFFFAOYSA-N 346.474 5.211 30 20 EKED CCC[C@@H]1CCc2ccccc2N1C(=O)c1ccc(C2(C#N)CC2)cc1 539658857 RAVKLCVEYSYIAO-HXUWFJFHSA-N 344.458 5.003 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H](c2ccc3ccccc3c2)C(F)(F)F)C1 599049112 SSQLNFCYJJAQCC-DOPJRALCSA-N 332.369 5.115 30 20 EKED C[C@@H](N[C@H]1CCSc2c(Cl)cccc21)c1cccc(C#N)c1 610830288 KBMYTADKCSGKOL-PXAZEXFGSA-N 328.868 5.099 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619755910 YJOCEKVMFQVBAI-NSHDSACASA-N 347.915 5.125 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C#N)c3ccc(Cl)cc3)o2)cc1 619863707 KNENZZWFIZMEHJ-OAHLLOKOSA-N 341.823 5.055 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(C)cc1 739142833 LGMPBVSFBSQZHD-FXAWDEMLSA-N 342.442 5.303 30 20 EKED Clc1cccc(Cl)c1C=NNc1cccc(Br)c1 745987373 CVAMETWAEVBUOJ-UHFFFAOYSA-N 344.039 5.202 30 20 EKED N#CCC[C@@H](NCc1cc(-c2ccccc2)ccc1O)c1ccccc1 747927768 DGHQESXEONTXMZ-JOCHJYFZSA-N 342.442 5.194 30 20 EKED CC(C)c1nc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cs1 771743330 BRNANWOYNWHVRZ-ONEGZZNKSA-N 346.502 5.348 30 20 EKED N#CCCC[C@@H](NC(=S)Nc1cccc(Cl)c1)c1ccccc1 814210962 XOFAZMUACPGEIV-QGZVFWFLSA-N 343.883 5.062 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCCCCC2)cc1 919910337 OMLBTXMOOBAGLL-UHFFFAOYSA-N 349.434 5.149 30 20 EKED CC(=NNc1ccc(Cl)cc1)c1sc2ccccc2c1C(=O)O 1776033010 ONKCFSCHFHCPOQ-UHFFFAOYSA-N 344.823 5.089 30 20 EKED CCCCCCCOc1cccc(CN[C@H](CC(C)(C)C)C(=O)O)c1 1776787919 FTEITHAVKODRCS-LJQANCHMSA-N 349.515 5.015 30 20 EKED N#C[C@@H](C(=O)c1cccs1)c1nc(-c2ccc(Cl)cc2)cs1 46443607 CMKOIGNFRFGQHE-LBPRGKRZSA-N 344.848 5.015 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(OCCCC)c1 65452882 JBOATMBLHTVASL-UHFFFAOYSA-N 338.451 5.086 30 20 EKED CCC(=CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)CC 122963165 YRNXJJADLKPJNA-UHFFFAOYSA-N 348.446 5.017 30 20 EKED CCc1nc(C)c([C@@H](C)N(C)Cc2ccccc2C(C)(C)C#N)s1 135248449 YYCZOWPRMVDLFM-OAHLLOKOSA-N 341.524 5.008 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C1CCCC1 172294930 WUHYZOXNVBIPTR-UHFFFAOYSA-N 349.434 5.065 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(O)c1 191442447 NRQHLCVAYIHSBT-OAHLLOKOSA-N 338.451 5.127 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\c2nc(-c3ccccc3)cs2)cc1 208261951 NMTUTOMKAJHALP-LMRWQKIVSA-N 332.428 5.271 30 20 EKED CCCCCN(C(=O)c1cccc(SCC#N)c1)[C@H](C)CCC 429828234 FEJBTBCSJKYCIL-MRXNPFEDSA-N 332.513 5.123 30 20 EKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3ccccc3)c3ccccc23)C1 450684250 RGCFGRDQXIJJGG-ZBFHGGJFSA-N 331.444 5.081 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccc(Cl)cc2C#N)cc1 480899803 QEQZAPXOCKAPFU-CYBMUJFWSA-N 330.884 5.174 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCc1ccc(F)c(F)c1 489735953 KSPGOLOJOHAIGV-ZDUSSCGKSA-N 332.419 5.014 30 20 EKED Cc1ccccc1-c1cccc(CN[C@H](C)c2ccc(C#N)cc2)c1 517549797 PGYLWQVAFCNYIJ-GOSISDBHSA-N 326.443 5.385 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1cccc(C#N)c1 517961864 PHWIIENPLZWBPS-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)cc1F 518739235 ULDAEEDSILCWSH-NSHDSACASA-N 348.830 5.126 30 20 EKED C=C[C@@H](CC(=O)N1CCCC[C@H]1c1ccc(F)cc1)c1ccccc1 533927625 GXDNGGVQOSMORR-UWJYYQICSA-N 337.438 5.239 30 20 EKED C=CCCC[C@@H](C)NC(=O)c1occc1CSc1ccccc1 537228649 LHNYJMSQYCXIGG-OAHLLOKOSA-N 329.465 5.047 30 20 EKED C=CCC[C@@H](NCc1nc(-c2ccsc2)oc1C)c1ccccc1 539359322 QXRZURUOGWHKAM-GOSISDBHSA-N 338.476 5.509 30 20 EKED N#CCc1ccc(CSCc2csc(C3CCCC3)n2)cc1 542222776 NSETUNRPCRFTJP-UHFFFAOYSA-N 328.506 5.300 30 20 EKED CC(C)Oc1ccc([C@@H](C)NCC2CCC(C#N)CC2)cc1Cl 560235718 WKVVGZNZAALTAW-QQFBHYJXSA-N 334.891 5.108 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1Cl 572581815 YRSKOEZUVOUUNN-HUUCEWRRSA-N 342.870 5.411 30 20 EKED CC(C)OCc1ccccc1CNc1ccc(C#N)cc1C(F)(F)F 609961486 SWQFYTPLTBSCQI-UHFFFAOYSA-N 348.368 5.114 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(Cl)c1Cl 642397290 UAAJWZRJEVGBTG-UHFFFAOYSA-N 335.234 5.214 30 20 EKED CC(C)c1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726434919 VTYTWEQVRMIQLU-UHFFFAOYSA-N 329.856 5.144 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1c[nH]c2ccccc12 728440680 RJAWRMDGKPDPCU-BQYQJAHWSA-N 336.441 5.249 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3=CCCCC3)n2)cc1 730395143 BVDJUDOGWCSVPA-KRWDZBQOSA-N 336.460 5.185 30 20 EKED Cc1c(C(=O)/C=C\c2cnc(-c3ccccc3)[nH]2)oc2ccccc12 742431167 DQJJBFQRNZZHNF-QXMHVHEDSA-N 328.371 5.027 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3scnc3C)s2)cc1 742434551 KSYRSPMQADXPAI-CMDGGOBGSA-N 340.473 5.088 30 20 EKED C=CCC[C@H](NCc1cc(=O)oc2cc(CC)ccc12)c1ccccc1 775463106 IHHPIUHJOOKQLT-NRFANRHFSA-N 347.458 5.153 30 20 EKED O=C1/C(=C\c2cc(Cl)cs2)CCc2ncc(C(F)(F)F)cc21 782350784 DJRZINRTCFQDMW-BAQGIRSFSA-N 343.757 5.028 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)Cc1ccccc1C(F)(F)F 795811255 SSGGLKNQFVBWAK-KGLIPLIRSA-N 348.368 5.039 30 20 EKED Cc1nn(C(C)C)cc1/C=C1\CCSc2ccc(Cl)cc2C1=O 798370733 WAQLVMHVPDDNJZ-MDWZMJQESA-N 346.883 5.188 30 20 EKED C[C@H](CN(C)C(=S)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1 863230180 FWSZPYIDCOWMLH-CYBMUJFWSA-N 349.931 5.057 30 20 EKED O=C(O)c1cc(NN=C2CCC(C3CCCCC3)CC2)ccc1F 1776062813 LGNHFXAWPCYEFD-UHFFFAOYSA-N 332.419 5.062 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776339856 HONAVJIOKYFXIT-BQYQJAHWSA-N 348.851 5.194 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)Sc3cccc(C#N)c3)o2)cc1C 158762627 IOZDRJWDJUZQKG-CQSZACIVSA-N 335.432 5.078 30 20 EKED CC(C)(C#N)CCC[S@](=O)Cc1ccccc1Oc1ccccc1 177966020 OWFSLRZODKHWDV-DEOSSOPVSA-N 341.476 5.058 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)Nc1ccccc1O[C@@H](C)C#N 183542655 PMMXQBUHSCCCTN-HNNXBMFYSA-N 337.423 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1OC 189880117 NLOTUQAVSOACST-UHFFFAOYSA-N 343.854 5.453 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC1CCOCC1 282119566 FJWFAYAXBXWREM-UHFFFAOYSA-N 329.484 5.074 30 20 EKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/C[C@@H]2C[C@H]2C2CCCCC2)C1 329344496 QMWQXTLAYJHUJK-RRQGHBQHSA-N 344.430 5.074 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2cccc(CSC3CCCC3)c2)CC(O)=N1 329678908 QOJSEZWDCJOOHW-HIFRSBDPSA-N 346.496 5.205 30 20 EKED C[C@@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1 330045495 DITQBWIANMDICC-RFSCMCKOSA-N 348.874 5.283 30 20 EKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1C(C)(C)C 340449681 VSNVNKUWSKSAQW-JXFKEZNVSA-N 338.499 5.032 30 20 EKED CCCc1ccc([C@H](NCCCC2(C#N)CCOCC2)C(C)C)cc1 410418961 OXSIBFXJWLPOIB-OAQYLSRUSA-N 342.527 5.026 30 20 EKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@@H]1c1cccs1 461461783 BGHYNNKFTDFPOQ-MRXNPFEDSA-N 339.851 5.163 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C2CCC2)c1 463826407 YOVMHMHURXPPFE-UHFFFAOYSA-N 347.462 5.268 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 508175840 NRJRRFFZHIVBHQ-UHFFFAOYSA-N 345.402 5.054 30 20 EKED CCC1(C)CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 517529550 DHQMVDMRBNJHKS-OAHLLOKOSA-N 345.512 5.125 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)CCCC(F)(F)F)cc2)c1 536110037 FYFWCTLOELLJEL-UHFFFAOYSA-N 348.324 5.022 30 20 EKED CCCO[C@H]1CCCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1 553023908 ZFNNTWUIOSKSKR-QFIPXVFZSA-N 348.490 5.006 30 20 EKED CC(C)(C)c1ccc(C2CCC(NC[C@H](C#N)CCC#N)CC2)cc1 560446528 QFARHVLUMSKBAL-OCDPCBSRSA-N 337.511 5.043 30 20 EKED C[C@H](NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 567063533 HFMRSDQWVHLICQ-INIZCTEOSA-N 346.405 5.340 30 20 EKED C[C@@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 610323307 JKYGFILIHOEEEJ-CQSZACIVSA-N 347.443 5.169 30 20 EKED O=C1/C(=C\c2nccc3ccccc23)Cc2c1ccc(Cl)c2Cl 740765804 UKHWVKPAMQEGJN-BENRWUELSA-N 340.209 5.364 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)cc1 741470819 WIBQVZNUQAEEDW-SXGWCWSVSA-N 344.410 5.267 30 20 EKED CCCCCCCCCC(=O)Nc1cccc(N2CCOC2=O)c1C 743786999 ZVMAPZOKQLVZDE-UHFFFAOYSA-N 346.471 5.031 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCCC1 757307114 VEJZMFFFBZWIAG-INIZCTEOSA-N 338.476 5.265 30 20 EKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 759187026 IATMVJNRIWTUQY-QIXNEVBVSA-N 346.817 5.168 30 20 EKED C=CC[C@H](OC(=O)c1coc(CC)n1)c1ccc(Cl)c(Cl)c1 797553400 HTTDZYKOMLHJKJ-AWEZNQCLSA-N 340.206 5.018 30 20 EKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(C)cc3)cs2)c1 916134539 VWBMQJCKUHFPTQ-KHPPLWFESA-N 335.428 5.023 30 20 EKED CC(C)(C#N)CCSc1nnc(-c2ccc(C(C)(C)C)cc2)o1 123843871 MCXTVJNWSZRWBP-UHFFFAOYSA-N 329.469 5.066 30 20 EKED CC(C)(CCC#N)CNc1cccc(C[S@@](=O)C2CCCCC2)c1 133275622 ZGTCBGDSONKMAH-DEOSSOPVSA-N 346.540 5.010 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1Cl 183798800 XZFPEWVZBFAONF-ZDUSSCGKSA-N 330.834 5.131 30 20 EKED C[C@H](/N=C(/O)C1CCCCC1)C(O)=Nc1ccc(F)c(C2CC2)c1 329840357 OCWXKGZZCTYQMA-LBPRGKRZSA-N 332.419 5.216 30 20 EKED CC(C)c1cc(/C(O)=N/C2CCC(C(=N)O)CC2)c(O)c(C(C)C)c1 330604935 LVIKBZJZTNGYBL-UHFFFAOYSA-N 346.471 5.038 30 20 EKED Cc1ccc2ncc(CN[C@@H](CCCC#N)c3ccccc3)cc2c1 411760317 RUNORJKNSQDWOB-NRFANRHFSA-N 329.447 5.068 30 20 EKED C[C@H](N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1(C)CC1 438653849 GFSVFCUMEGPQJF-HNNXBMFYSA-N 349.434 5.003 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1 474428478 UDJCKCAPCHBJTF-UHFFFAOYSA-N 340.426 5.407 30 20 EKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1CC1CCCCC1)c1ccccc1 475394318 XKKXANZJNKIANX-LEWJYISDSA-N 338.495 5.035 30 20 EKED CCCCCN(CCCCC)C(=O)N[C@H](C)c1ccc(C#N)cc1 505324108 CTTBIRHVRRCBFL-QGZVFWFLSA-N 329.488 5.011 30 20 EKED C[C@H]1CC[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc21 507434537 MYZVPPMRHVPMCX-YWZLYKJASA-N 347.462 5.248 30 20 EKED C[C@@H]1CCC[C@@H](CC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 520187305 HUDWNCPOWIRHPU-BZUAXINKSA-N 330.497 5.236 30 20 EKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@H](c2nc3ccccc3s2)C1 527482132 PYKFHXDXHNGVDW-YJBOKZPZSA-N 347.487 5.109 30 20 EKED CCc1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 541066786 NYNIAKCIKZVYHP-HNNXBMFYSA-N 347.487 5.095 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4cccc(F)c4)s3)CC2)c1 560069898 ITVRQNGYBXZXJE-UHFFFAOYSA-N 348.446 5.205 30 20 EKED CC12CC3(C)CC(C)(C1)CC(C(=O)Nc1ccccc1CC#N)(C2)C3 581035383 OWQSIPLMMJJYFZ-UHFFFAOYSA-N 336.479 5.078 30 20 EKED N#C[C@@H](N[C@H](COCc1ccccc1)c1ccccc1)C1CCCCC1 583328795 DBIAIOWEGPWIDH-DHIUTWEWSA-N 348.490 5.007 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2ncc(-c3ccc(F)cc3)o2)cc1 590666129 QPMWUYPNKSTAID-QGZVFWFLSA-N 338.407 5.016 30 20 EKED N#CCc1ccc(NCc2ccc(OCc3cccc(F)c3)cc2)cc1 603835204 QMJSOIGGWABRFM-UHFFFAOYSA-N 346.405 5.083 30 20 EKED CC(C)(C#N)c1ccc(CNC(c2ccccc2)c2ccccc2)cc1 614052880 RTUYSVJSIIMQRQ-UHFFFAOYSA-N 340.470 5.367 30 20 EKED COc1ccc(C)cc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 727264816 WZAAWPWKVDDITQ-KTKRTIGZSA-N 335.428 5.023 30 20 EKED FC(F)(F)c1ccc2sc(NN=C/C=C\c3ccco3)nc2c1 743445409 SUNYCDITQJNKQT-BLWNCRQMSA-N 337.326 5.019 30 20 EKED C=C(C)[C@@H](NC(=S)Nc1cccc(C)c1C)c1ccc(F)c(F)c1 774203459 CILVKDLCYUFIEA-GOSISDBHSA-N 346.446 5.185 30 20 EKED CC(C)[C@H]1/C(=C/c2ncc(C(F)(F)F)s2)C(=O)c2ccccc21 788356227 UEPBYQRXXNBGBE-WASHYIJTSA-N 337.366 5.181 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(Oc3cccnc3)cc2)cc1 809199994 KHQCOVDOBFMGDN-UHFFFAOYSA-N 343.430 5.287 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CC2(CCOCC2)[C@@H]1C1CC1 818796552 WVCPFXCOBBOMCH-RXVVDRJESA-N 349.559 5.181 30 20 EKED Cc1csc([C@@H](C#N)C(=O)[C@H](CC(C)C)c2ccc(Cl)cc2)n1 850736416 JTBVTUHYRUUBLX-CVEARBPZSA-N 346.883 5.111 30 20 EKED CCOc1c(Cl)cc(NCc2cccc(F)c2C#N)cc1Cl 864025069 MVBPIGMWFGKEQO-UHFFFAOYSA-N 339.197 5.015 30 20 EKED CCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915086463 LBNUCEOHMYBECL-JOCHJYFZSA-N 340.426 5.157 30 20 EKED C=C1CCN(C(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 111034785 WBSIKEQHXOSKNT-UHFFFAOYSA-N 345.364 5.165 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)C(=O)N[C@H](CCC#N)c1ccccc1 160598792 ZRSXKEJDBJLHIN-WIYYLYMNSA-N 349.478 5.042 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1Cl 177760735 WOPFCWUEKMUGGB-BCNIOPEESA-N 344.867 5.200 30 20 EKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 179635839 MKKLYVUBWLEEFF-IBGZPJMESA-N 328.406 5.007 30 20 EKED N#CCC[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 301789445 NFQQBHDMTDBIQN-AWEZNQCLSA-N 349.312 5.071 30 20 EKED Cc1[nH]c(S[C@@H](C)c2ccc(C#N)cc2)nc1Cc1ccccc1 303734817 WOCMSTMFLNOKCK-HNNXBMFYSA-N 333.460 5.034 30 20 EKED C[C@H](/N=C(/O)[C@@]1(C)CCc2ccccc2C1)c1ccc2c(c1)CC(O)=N2 329046745 VDNGRIUABVNNTL-FPTDNZKUSA-N 348.446 5.043 30 20 EKED C[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)c(F)c1 427884503 IQEUSFHHEWFAJC-WDEREUQCSA-N 337.225 5.416 30 20 EKED N#CCCC[C@H](NCCOc1ccc2ccccc2c1)c1ccccc1 433017727 CZNOJYUKDQIGLB-QHCPKHFHSA-N 344.458 5.243 30 20 EKED Cc1oc(C#N)cc1C(=O)Nc1cc(-c2ccccc2)ccc1Cl 437195158 CWDPLRKANZUGSK-UHFFFAOYSA-N 336.778 5.032 30 20 EKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCCC(C)(C)C#N)C1 483640978 JAOVBTAEMGZDSD-PBHICJAKSA-N 338.417 5.418 30 20 EKED N#CC1(CCCS[C@@H]2CCc3ccc(Cl)cc32)CCOCC1 512378412 PKUWEZOTXFXERG-QGZVFWFLSA-N 335.900 5.161 30 20 EKED Cc1ccnc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 519559021 KVBUQAFNMXLTIH-MSOLQXFVSA-N 341.458 5.341 30 20 EKED Cc1cc([C@H](Nc2cccc(OCCCC#N)c2)C2CC2)ccc1F 537425195 JCAOHBJGICCZAK-OAQYLSRUSA-N 338.426 5.380 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C1CCOCC1 543034302 IAWXYBDMXKTZFS-GAJHUEQPSA-N 348.490 5.081 30 20 EKED Cc1c([C@H](NCc2ccc(CC#N)cc2)C(C)C)oc2ccccc12 544124011 RUPZOOOARNDKDP-OAQYLSRUSA-N 332.447 5.294 30 20 EKED Cc1c(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)oc2ccccc12 557644878 SETRRCODWLQXGF-SFHVURJKSA-N 346.430 5.033 30 20 EKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 559865528 RNGRZZZGKWSXCU-FXAWDEMLSA-N 332.447 5.827 30 20 EKED Cc1csc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)c1C#N 568559073 RQUVROSHUFTQLM-UHFFFAOYSA-N 342.420 5.048 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1Cl 572581814 YRSKOEZUVOUUNN-GJZGRUSLSA-N 342.870 5.411 30 20 EKED CC[C@@H](C)n1c(S[C@H](C#N)c2ccccc2)nnc1-c1ccccc1 581201783 GRBIPMAASZIEHZ-CRAIPNDOSA-N 348.475 5.273 30 20 EKED CC1(C)CCC[C@@H]1N(Cc1ccccc1)C(=O)CCCCCC#N 588755592 RJJKGDFKDFAUBO-IBGZPJMESA-N 326.484 5.068 30 20 EKED Cc1nc(-c2ccc(NCc3ccc(C4(C#N)CC4)cc3)cc2)oc1C 594933484 GSEUTPPXNPPYAS-UHFFFAOYSA-N 343.430 5.126 30 20 EKED N#Cc1cc(Cl)ccc1SCc1csc(-c2ccccn2)n1 610654978 LSMNYBBBCCNEGL-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)[C@@H]1C[C@H]1c1ccc(Cl)s1 618988273 HOGVWWZPWREMBP-GLZXHMCRSA-N 342.895 5.042 30 20 EKED CC(C)Sc1ccc([C@H](C)Nc2snc(Cl)c2C#N)cc1 728908840 DZSNBWSWWHBYHS-JTQLQIEISA-N 337.901 5.342 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 729068177 XIDCFZKZQQLSAT-GOEBONIOSA-N 334.444 5.056 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3cccs3)cc2)c1 731331506 HOGWNGQQUHLKFP-KHPPLWFESA-N 346.411 5.064 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1Cl 739421385 JNYLVUGGYMUVSB-UHFFFAOYSA-N 348.155 5.243 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cnn(C(C)C)c2)cc1 741466825 AGFPGRWVBADCNL-RAXLEYEMSA-N 346.430 5.036 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](CC2CCCC2)c2ccccc2)cc1 752103170 OMEIZXYKPGZBMK-FDDCHVKYSA-N 348.490 5.389 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCCC3(C)C)n2)cc1 773982088 DGXGQEHYHPKQRL-CVEARBPZSA-N 338.476 5.121 30 20 EKED CCCC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 800387063 PWPVGLJLLXQWDV-GOEBONIOSA-N 326.465 5.121 30 20 EKED N#C[C@H](C(=O)[C@H]1CCC[C@H]1c1ccccc1)c1nc2ccccc2s1 835039993 MKAOETYEDVQSKB-YESZJQIVSA-N 346.455 5.056 30 20 EKED N#C[C@@H](C(=O)[C@@H]1CCCC2(CC2)C1)c1nc2cc(Cl)ccc2s1 850770974 GVAFVESUOQATNJ-YPMHNXCESA-N 344.867 5.096 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cc(C(F)(F)F)co1 871827162 SYCKWTSLXGWXNY-LLVKDONJSA-N 340.370 5.162 30 20 EKED CC(C)c1ccc([C@H](C)NN=Cc2c(C(C)C)nn(C)c2Cl)cc1 917550567 AZBYSHONBYOPPA-AWEZNQCLSA-N 346.906 5.005 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(F)c(C(=O)O)cc2F)cc1 1776699955 KFYOJMSXPAEQBT-IDVQTMNDSA-N 344.357 5.073 30 20 EKED CC(C)[C@@H](NC[C@@H](C#N)CCC#N)c1ccc(C2CCCCC2)cc1 23678019 WEVZYRSPUVNCNN-XMSQKQJNSA-N 337.511 5.465 30 20 EKED CCN(CCC#N)C(=O)Nc1cccc(CSC2CCCCC2)c1 78592808 ZNOZTZFMCCZVHT-UHFFFAOYSA-N 345.512 5.020 30 20 EKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc2ccccc2c1 98008540 REXINDONNDGYDN-KHPPLWFESA-N 342.423 5.254 30 20 EKED N#Cc1csc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 177681315 ADNIYEBOFBLMAF-LJQANCHMSA-N 338.863 5.152 30 20 EKED Cc1ccc(C)c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 191949327 FSBAGTWZSJKCPL-HNNXBMFYSA-N 339.464 5.342 30 20 EKED CC(C)[C@@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 236734784 BMNRLYAFEBIKMP-GOSISDBHSA-N 332.369 5.064 30 20 EKED C[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)c(F)c1 426305822 DRYCDNFCBDYANR-MEBBXXQBSA-N 334.847 5.140 30 20 EKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)c2ccccc2n1 433021069 PSPTZXMMTNNFEX-NRFANRHFSA-N 329.447 5.068 30 20 EKED CC(C)(C#N)CCCCSCc1noc(-c2ccc(Cl)cc2)n1 435891012 YMACGZGLDGCFSS-UHFFFAOYSA-N 349.887 5.343 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 445990807 CQAZGKFZODTGBM-NVXWUHKLSA-N 338.417 5.261 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCCOc1ccc(F)cc1 462228708 DLPVHZVBZMLROD-HNNXBMFYSA-N 344.455 5.101 30 20 EKED CCc1ccc(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)o2)cc1 465017510 TXBUBSLARYMTPD-MRXNPFEDSA-N 330.431 5.231 30 20 EKED Cc1ccnc(Oc2cc(NCc3ccc(C#N)c(F)c3)ccc2C)c1 479474215 ICCFNQLFGLHDFF-UHFFFAOYSA-N 347.393 5.114 30 20 EKED C=C(C)[C@H](NCc1csc(C2CCCC2)n1)c1ccc(F)c(F)c1 481569303 KPIVDFWURDWJDE-SFHVURJKSA-N 348.462 5.486 30 20 EKED COc1cc(-c2ccccc2)ccc1CN[C@H](C)c1ccc(C#N)cc1 512401061 JFQUCEPEVKXHHB-QGZVFWFLSA-N 342.442 5.085 30 20 EKED C=C[C@H](CC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 533901679 ONIVVIDXORNCEI-HXUWFJFHSA-N 349.449 5.191 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 538394664 JONPKPBHCXSPFF-XOBRGWDASA-N 336.435 5.199 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2cc(Cl)ccc2o1 540607342 PTTXCOZRECHLGW-RDTXWAMCSA-N 338.838 5.782 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc2ncccc2c1 546728767 DKCKPXOOLXVENC-OAHLLOKOSA-N 333.460 5.099 30 20 EKED N#CCC[C@@H](C#N)CNc1cccc(CSC2CCCCC2)c1 554727620 XGZTYJKVCYDFFC-KRWDZBQOSA-N 327.497 5.108 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccc3ccccc3c2)C(F)(F)F)c1 611994212 GJTHMXQJCUBWPI-IBGZPJMESA-N 340.348 5.105 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@H](OC(C)(C)C)C1 654047258 MYLHQZSEGPVCJB-QAQDUYKDSA-N 344.499 5.006 30 20 EKED C[C@H](CC1CCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733921920 YXYVEEILCIQOID-VGSWGCGISA-N 346.474 5.497 30 20 EKED Clc1ccc(-c2ccc(C=NOCc3cccnc3)s2)cc1 746578259 ZTPVFPFMIKRYKU-UHFFFAOYSA-N 328.824 5.014 30 20 EKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2ccc(C)s2)ccc1OC 749450987 DGOLRXTZZQKYEG-JWJUJFCLSA-N 330.449 5.139 30 20 EKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 759188182 SUEZGUGOOSDSLU-BJRSVTDJSA-N 346.817 5.168 30 20 EKED CCCCCCCC[S@](=O)Cc1nc(-c2ccsc2)oc1C 790140905 ZGBHSJKHTQUKKS-QFIPXVFZSA-N 339.526 5.321 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(C)cc1 792092555 CXJIBRVYXYPLNL-UWJYYQICSA-N 342.442 5.303 30 20 EKED O=C(/C=C\c1ccc(C(F)F)cc1)c1sccc1Br 794936849 FZMRWUOCOHGUQE-UTCJRWHESA-N 343.192 5.344 30 20 EKED CC(C)CC(=NNc1ncccc1C(F)(F)F)c1cccs1 917548832 ZMZDDGWNVYBJHE-UHFFFAOYSA-N 327.375 5.024 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](CC)c2ccncc2)cc1 163810439 GNOYJAGQGHZHBR-HNAYVOBHSA-N 330.859 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC[C@H](C)C(C)=O 276567630 IFHLKYZZWUZIHA-INIZCTEOSA-N 329.484 5.263 30 20 EKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccc(-c2cccnc2)cc1 301451300 ABBMMQVJBYEDLR-CYBMUJFWSA-N 335.357 5.072 30 20 EKED CC1(C)CCCC[C@@H]1CC(O)=Nc1cccc([C@@H]2CN=C(O)C2)c1 328643406 FHXXVSFFMCZPAM-JKSUJKDBSA-N 328.456 5.325 30 20 EKED N#CCCC[C@@H](NC(=O)c1cc(Cl)ccc1Cl)c1ccccc1 352224827 CVJSPSMSKXSYKP-QGZVFWFLSA-N 347.245 5.158 30 20 EKED Cc1cc2c(cc1C)[C@H](N[C@H](CCC#N)c1ccccc1)CCS2 427519362 OSIRJUZODHNWFO-WOJBJXKFSA-N 336.504 5.475 30 20 EKED C[C@@H](Sc1nc2ccccc2n1C(F)F)c1cccc(C#N)c1 442911099 HBDNDEZBAZOSST-LLVKDONJSA-N 329.375 5.156 30 20 EKED CC(C)[C@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 460169343 KETHWSVLXZQJNC-HNNXBMFYSA-N 340.854 5.037 30 20 EKED CC(C)(CCC#N)CN[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 466472201 GHVPZHGFTRFCPW-HDJSIYSDSA-N 325.283 5.159 30 20 EKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 467610640 LVQITKFVGCZZDF-YJBOKZPZSA-N 349.434 5.003 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 467737632 MFZCXLRPOXEOGJ-GXTWGEPZSA-N 340.414 5.520 30 20 EKED CC[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)s1 476052322 OUAMGCLLITWABX-GJZGRUSLSA-N 346.883 5.056 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1c(C)cc2ccccc21 476168206 WTELCSWNZGSOJB-UHFFFAOYSA-N 346.474 5.440 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)S[C@H](C)c2ccc(C#N)cc2)n1 476171425 XXLBINGBWDLQDX-HUUCEWRRSA-N 349.459 5.472 30 20 EKED N#Cc1ccc(CSCc2csc(-c3ccccc3F)n2)cc1 477206694 OMKYDYKOQGDNOM-UHFFFAOYSA-N 340.448 5.254 30 20 EKED Cc1cc(CN[C@H](Cc2ccccc2)c2cccs2)ccc1C#N 488331633 RVFLISHNQOFVDR-HXUWFJFHSA-N 332.472 5.002 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(CC(F)(F)F)cc1)c1ccccc1 489014831 RTDSJXOQQRTURR-KRWDZBQOSA-N 333.353 5.090 30 20 EKED N#Cc1cnc(N[C@H]2CCc3c2ccc(Cl)c3Cl)c(Cl)c1 500415055 OEUUJIJANSAXNH-ZDUSSCGKSA-N 338.625 5.013 30 20 EKED CCN(Cc1cccc(-c2cccnc2)c1)[C@H](C)c1ccc(C#N)cc1 508603764 KVSXUPXLWCQFSD-GOSISDBHSA-N 341.458 5.203 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2cccc(-c3cnco3)c2)CC1 535831773 NTNCLDDPJXARAW-UHFFFAOYSA-N 343.430 5.158 30 20 EKED N#Cc1ccccc1CN[C@H](c1c(Cl)cccc1Cl)C1CC1 576387676 QLNXFQFNKFHPFF-SFHVURJKSA-N 331.246 5.106 30 20 EKED CC[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1nc(C)cs1 729641793 XSYOFSLHTYZXSV-XVRVVCMKSA-N 329.252 5.034 30 20 EKED Cc1cc(/C=C2\Cc3c(F)cccc3C2=O)ccc1Oc1cccnc1 732714904 ZVHNMMFUKYGARI-LFIBNONCSA-N 345.373 5.144 30 20 EKED C#CC[C@H](OC(=O)C[C@H](C)c1ccc(C(C)C)cc1)c1ccccn1 739171249 YVUBFGUBIBKYGI-UWJYYQICSA-N 335.447 5.006 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3c[nH]c4ccccc34)co2)cc1 749892186 SCNVPIMOBZVLTB-ZHACJKMWSA-N 328.371 5.027 30 20 EKED CC(C)[C@@H]1/C(=C/c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 766501469 GPUPDSQIHBAGID-XGHXRCDJSA-N 346.455 5.225 30 20 EKED COc1ccccc1-c1ccc(C(C)=NOCCC(F)(F)F)cc1 777461157 VHQQMWYSTDBYCO-UHFFFAOYSA-N 337.341 5.055 30 20 EKED CCCOc1cc(/C=C\C(=O)c2ccc(Cl)s2)ccc1OC 916135808 UXGNSAPLGGFXSU-XQRVVYSFSA-N 336.840 5.095 30 20 EKED C(=N/c1cccc2c(/N=C/c3ccncc3)cccc12)\c1ccncc1 4699149 FJXHPRVSTIXUPE-RYQLWAFASA-N 336.398 5.131 30 20 EKED C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1CCC#N 11408058 CYJWJBRQDICSNH-YOEHRIQHSA-N 349.865 5.243 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc3cc(F)ccc3s2)cc1 25839836 REBDAROSRMMGIT-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1C(C)C 56539697 NDKGRJCHXJAIQJ-UHFFFAOYSA-N 326.415 5.169 30 20 EKED CC(C)c1ccc(NC(=O)NCc2cccc(C#N)c2)c(C(C)C)c1 58052404 RZDPMIGOROQIGH-UHFFFAOYSA-N 335.451 5.127 30 20 EKED Cc1cscc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 120785990 QFCKNNRZTUHPNR-GFCCVEGCSA-N 331.466 5.095 30 20 EKED COc1ccccc1[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 181942797 CWYQARTYCUJUNK-SBUREZEXSA-N 342.442 5.007 30 20 EKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2o1 189748860 AFSOUWVUUPOOQR-CQSZACIVSA-N 347.418 5.117 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H](SC)C1 191421805 QIOQVJCAEFGKDC-KRWDZBQOSA-N 346.540 5.288 30 20 EKED O/C(=N/Cc1ncoc1-c1ccccc1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329161052 FMYGTHLLEXAQRG-CGTJXYLNSA-N 338.451 5.405 30 20 EKED N#CCCC[C@H](NC/C=C\c1ccc(F)cc1F)c1ccccc1 353914681 KZKHJACGLNQDRC-NSDNCLLMSA-N 326.390 5.003 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3c(Cl)sc(Cl)c32)s1 421895084 YKGVOFZGPQALHZ-LLVKDONJSA-N 343.304 5.155 30 20 EKED C=CCC[C@H](C(=O)N(C)Cc1ccc(Cl)s1)c1ccccc1 487762806 RMCOPKRBGRYLEJ-INIZCTEOSA-N 333.884 5.110 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 488846857 VRQKWSOXKUULRR-OAQYLSRUSA-N 344.414 5.172 30 20 EKED CCC(CC)[C@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1 503348272 SRILSBCIFIRABN-KKSFZXQISA-N 349.478 5.096 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C(CC)CC)[C@@H]1CCCc2cccnc21 511301938 BZITUJGIARTOTQ-VQIMIIECSA-N 328.500 5.079 30 20 EKED C[C@@H](SCc1ncc(-c2ccc(F)cc2)o1)c1cccc(C#N)c1 527197230 HIESTFHCGSOIGU-CYBMUJFWSA-N 338.407 5.347 30 20 EKED C[C@H](N[C@@H](C)c1cscn1)c1ccc(-c2cccc(C#N)c2)cc1 543961457 KGPGDZXNLFKCCX-GJZGRUSLSA-N 333.460 5.094 30 20 EKED N#CCc1ccccc1NC(=O)CC1(CCc2ccccc2)CCCC1 554750517 NHOHICGDURTIOS-UHFFFAOYSA-N 346.474 5.274 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(-c2nccs2)c1 554973025 XUEFZXSSFQDTGR-UHFFFAOYSA-N 329.469 5.020 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1Cl 582994806 UGFSGVXXQZQVJB-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED N#CCCCCCC(=O)N[C@H]1CCCCC[C@H]1c1ccc(Cl)cc1 588166427 WATPWBOZPUCAEP-OALUTQOASA-N 346.902 5.347 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NCc1ccnc(C#N)c1 610956251 TVGXBSQPNBOKGQ-UHFFFAOYSA-N 331.444 5.025 30 20 EKED C=CCC[C@H](NCc1cc(C)ccn1)c1ccc(C(F)(F)F)cc1 683020734 VWYIIWBYDSSFKJ-SFHVURJKSA-N 334.385 5.206 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@@H]1c1ccccn1 726884914 RVOWKTRANDNYMR-NXZBIGBUSA-N 328.500 5.442 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C\C(=O)c2ccsc2)c1 731319384 PGIJLMUDFWGVKI-HJWRWDBZSA-N 345.423 5.095 30 20 EKED O=C(/C=C/c1cccc(OCC(F)(F)F)c1)c1ccccc1Cl 733081334 VMCYLWGAAKYPRE-CMDGGOBGSA-N 340.728 5.177 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@H]1c1cc(C)on1 737790415 NCIWQJFFKXDIFC-RNUYOQPASA-N 332.488 5.343 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1nc(Cl)cs1 759083752 KWFFZXADLRSJOF-BQYQJAHWSA-N 346.864 5.125 30 20 EKED C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772960040 QEVLLJBXWGFOFR-KBPBESRZSA-N 348.368 5.020 30 20 EKED CCc1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)C(C)C)cc1 776154019 KRRLLUJJBRGSKZ-JTSKRJEESA-N 336.479 5.199 30 20 EKED C#CCN(Cc1ccccc1)C(=O)Nc1c(C(C)C)cccc1C(C)C 806097087 KIEARPKCGAHLBF-UHFFFAOYSA-N 348.490 5.601 30 20 EKED CCCCCCCOc1cccc(/C=C/C(=O)c2ccnc(O)c2)c1 806556225 QJPBMDRCWWIOPT-ZHACJKMWSA-N 339.435 5.033 30 20 EKED C[C@H](NN=Cc1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 920381882 BERYREHSQNHCMG-AWEZNQCLSA-N 347.443 5.241 30 20 EKED CC[C@H](C)c1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776034037 ILVMTDHFRLVEKK-LBPRGKRZSA-N 344.842 5.388 30 20 EKED Cc1cc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c(C)s1 1776133378 VJWXXRCJJSCTRO-HWKANZROSA-N 342.441 5.174 30 20 EKED C=CCc1ccccc1/C=C(/CC(=O)O)c1nc2ccccc2s1 1776187746 PKMRFTKRYHUUOG-VBKFSLOCSA-N 335.428 5.040 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66907373 ILMNRZUJWWPAMA-CQSZACIVSA-N 325.437 5.033 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171244909 XWEWCMWZDDVMKB-UHFFFAOYSA-N 347.462 5.052 30 20 EKED C[C@H](ON=Cc1cccs1)c1ncc(-c2ccc(Cl)cc2)o1 255061434 BROQLANUUHAEFA-NSHDSACASA-N 332.812 5.168 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cccc2ccsc12)c1ccccc1 337339159 GHWKNARVNAQELH-MRXNPFEDSA-N 335.432 5.068 30 20 EKED CC1(C)C[C@H](c2ccccc2)N(C(=O)C[C@H](CC#N)c2ccccc2)C1 425124261 UJCFTBIURQTZCW-LEWJYISDSA-N 346.474 5.074 30 20 EKED N#CCCSc1ccccc1NC(=O)c1ccc2sccc2c1 471265648 RGRDKPGYEHCFSA-UHFFFAOYSA-N 338.457 5.159 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1-c1c(F)cccc1F 494527678 CPOWWIGRPIMHTI-UHFFFAOYSA-N 348.352 5.064 30 20 EKED CCCCN(C(=O)c1cccc(CC#N)c1)[C@H](CC)c1ccccc1 513284467 NPNZMCAZONTTOR-OAQYLSRUSA-N 334.463 5.146 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(OC(F)(F)F)cc1 513647226 GWNZCRTVWUXVKX-SCLBCKFNSA-N 348.368 5.259 30 20 EKED CCOCc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 538821201 XZAFDKSCOBKABL-UHFFFAOYSA-N 334.463 5.039 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(Oc2cccnc2)cc1 583405694 WRJNWEYGIRXQOU-UHFFFAOYSA-N 339.439 5.084 30 20 EKED CC(C)Oc1cccc([C@@H](C)N[C@H](C#N)c2ccc(Cl)cc2)c1 595415296 LNIOHEUVWFTGBA-AUUYWEPGSA-N 328.843 5.043 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 642440909 CKRBPVBFCUDDTP-UHFFFAOYSA-N 349.459 5.169 30 20 EKED CC(C)CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)C1CCCC1 726484042 BAOLZQPCVGCSCB-UHFFFAOYSA-N 349.931 5.199 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(SC(C)(C)C)cc2)c1 726746494 GDZYGMQJHQVIIT-UHFFFAOYSA-N 340.517 5.367 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1cccc(C#N)c1 727267629 MKOGTJQJWLHUMK-YHYXMXQVSA-N 348.402 5.025 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\C2CCCCC2)cc1 735427627 DOTOPVDIERLWFV-KLZTUXMASA-N 344.458 5.417 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cccc(C#N)c2)cc1 741468332 FEKVXZBKBARDQO-NTEUORMPSA-N 339.394 5.130 30 20 EKED CC(=NNc1nccc2sccc12)c1ccc(-c2ccncc2)cc1 745194770 CYDUTNVBLAQZOC-UHFFFAOYSA-N 344.443 5.194 30 20 EKED C=CCCCC(=O)O[C@H](c1cccnc1)c1cccc(C(F)(F)F)c1 759600634 XIKCWEKGLQBASF-SFHVURJKSA-N 349.352 5.089 30 20 EKED CC(/C=C\C(=O)c1cncc(F)c1)=C/c1cccc(C(F)(F)F)c1 806573862 UTZCBYIYWLSMHC-VZVVJSHISA-N 335.300 5.082 30 20 EKED Cc1nc(C)c2c(C)c(C=NNc3cccc(Cl)c3C)sc2n1 915051488 WSWHIFJOUUFEEZ-UHFFFAOYSA-N 344.871 5.024 30 20 EKED Cc1cc(C)c(/C=C\C=NNc2ccc(Cl)c(C(=O)O)c2)cc1C 1776034771 XZWPBIQRVVZEHV-XCZIAOCSSA-N 342.826 5.075 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(OC(C)(C)C)c1 1776784048 UVHUFKZHWXFZBT-GOSISDBHSA-N 349.515 5.157 30 20 EKED CC(C)(C#N)CCC[S@@](=O)[C@H]1CCc2c(Cl)cc(Cl)cc21 153768888 NBEMHKCNYUTKHV-BTYIYWSLSA-N 344.307 5.059 30 20 EKED N#CCCCCSCc1coc(-c2ccc(C(F)(F)F)cc2)n1 160207574 QVLBTVWBTNCEEX-UHFFFAOYSA-N 340.370 5.287 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 192755481 ZDEIEXXGHSFAKS-KSFYIVLOSA-N 330.406 5.138 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(OCC#N)cc1 193002376 UPCBFZVKQNRZTM-ZIAGYGMSSA-N 348.368 5.020 30 20 EKED COc1cc(/C=C\C(=O)c2ccc3ccccc3c2)ccc1SC 214926588 ROHUKCYIAHXMPY-XFFZJAGNSA-N 334.440 5.466 30 20 EKED CC(C)/N=C(/O)[C@@H]1CCC[C@H](/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)C1 329156690 CTQWBPJNNVFGCP-XCDZQEORSA-N 348.531 5.473 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2cccs2)cc1)c1ccccc1 433025056 GZQIZTRUERFOPG-NRFANRHFSA-N 346.499 5.940 30 20 EKED Cc1nnc(SCCCCC(C)(C)C#N)n1[C@@H]1CCC[C@@H](C)C1 436194617 PKDYXTLROKANFV-GDBMZVCRSA-N 334.533 5.150 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2C)c(C)c1 438912054 MLALIYAKBXFBKF-OAHLLOKOSA-N 338.476 5.318 30 20 EKED CC[C@H](C)c1ccc([C@@H](NC(=O)CCCC#N)c2cccs2)cc1 461757937 UCMHOJPWPPPBET-MGPUTAFESA-N 340.492 5.161 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 467822674 BXGDYNSQGFXWIO-KRWDZBQOSA-N 334.463 5.567 30 20 EKED C[C@H](Nc1c(Cl)cccc1C#N)c1nc2ccccc2n1C(F)F 486445099 AWSDPISNMAKYJG-JTQLQIEISA-N 346.768 5.130 30 20 EKED C=CC[C@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)c1ccccc1 488678894 WKWWZZFGFGMRHI-SFHVURJKSA-N 347.380 5.024 30 20 EKED C[C@H](SCCCC1(C#N)CCOCC1)c1ccc2ccccc2c1 507692539 BSLQZYHPJFTSLW-KRWDZBQOSA-N 339.504 5.735 30 20 EKED CCC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512642498 QFTXHBKZEJCNGI-CWTRNNRKSA-N 332.369 5.168 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(-c2ccncc2)cc1 512668608 VYKZHQPHEHMNIP-HZPDHXFCSA-N 345.421 5.171 30 20 EKED C=CC[C@H](C)NC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 523960891 MNQUDZIZDQAVJJ-KSSFIOAISA-N 345.895 5.254 30 20 EKED C[C@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)c(F)c1 540711023 RXOVQOHFIYWRIG-NWDGAFQWSA-N 336.332 5.128 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 553398217 PPTJOSPZVLJVJD-ZHRRBRCNSA-N 346.861 5.652 30 20 EKED Cc1ccc(-c2nc(CSCc3cc(C#N)ccc3F)cs2)o1 573588584 KJCJOHBGJSSGJW-UHFFFAOYSA-N 344.436 5.156 30 20 EKED C=C[C@@](C)(CC)c1nc([C@@H](CCCOC)c2ccc(Cl)cc2)no1 583050684 CPRWPWIKKLAODZ-LPHOPBHVSA-N 348.874 5.135 30 20 EKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nc(C)cs3)sc2c1 591019499 XWTNVOLVIMQGBQ-LLVKDONJSA-N 346.864 5.118 30 20 EKED CCCc1sc(C(=O)Nc2sc(CC)cc2C#N)cc1CC 604027792 WPBXLMAQZGVJJU-UHFFFAOYSA-N 332.494 5.011 30 20 EKED CCCN(C(=O)c1ccc2ccccc2c1)c1cc(Cl)ccc1C#N 609286323 UMDZUZOHOWYTMN-UHFFFAOYSA-N 348.833 5.422 30 20 EKED C=CCC[C@@H](NCc1ccc(O)cc1)c1ccc(C(F)(F)F)cc1 682407533 UVXTZLWGXMJFPZ-GOSISDBHSA-N 335.369 5.208 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)C 729887858 DIRZSCGAKYLVOL-WBVHZDCISA-N 340.492 5.367 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1nccs1 735232890 WBDZNFYOEGMMDQ-VOTSOKGWSA-N 346.864 5.125 30 20 EKED N#Cc1csc(/C=C2/CCSc3ccc(Cl)cc3C2=O)c1 748441502 KQSKNKHTNDQONY-WDZFZDKYSA-N 331.849 5.035 30 20 EKED CSc1ccc(C(=O)/C=C\c2nc3ccc(F)cc3s2)cc1 761475414 CGDFKDCCTPSYIL-HJWRWDBZSA-N 329.421 5.053 30 20 EKED CC(C)(C#N)CCCCOC(=O)CC1CCC(C(F)(F)F)CC1 768850942 KKJGZUQPYWHPGF-UHFFFAOYSA-N 333.394 5.008 30 20 EKED CSc1ccc(Cl)cc1NCc1ccc(N(C)CCC#N)cc1 770542272 MKSOCZAQXBVVTL-UHFFFAOYSA-N 345.899 5.024 30 20 EKED CC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccc1OC 795782678 OIIVGQDIEAJJNY-SFTDATJTSA-N 334.463 5.075 30 20 EKED COc1ccccc1CON=C(C)[C@@H](C)c1nc2ccccc2s1 799118265 XFBCSOHRXVNBKL-CYBMUJFWSA-N 340.448 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(CC2CC2)s1 890165684 KDYLDNHSTNAMEX-UHFFFAOYSA-N 340.492 5.200 30 20 EKED Cc1cn2c(/C=C/C(=O)c3ccc4ccccc4c3)c(C)nc2s1 58452757 DUKAXSJMAUBNLK-MDZDMXLPSA-N 332.428 5.062 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)c(Cl)c2)c1 113952468 VBEHJFCJNTYGBF-CJNGLKHVSA-N 346.833 5.011 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(F)F)c1 171819480 URQPDCSDXKSLHX-LBPRGKRZSA-N 346.402 5.271 30 20 EKED C[C@H](Nc1ccc(COCc2ccccc2)cc1)c1ccc(C#N)cc1 174179594 IGFQQZDHBSYPRP-SFHVURJKSA-N 342.442 5.448 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 176097562 OBKNICLVPBASQL-CQSZACIVSA-N 344.867 5.220 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C(F)(F)F)c1 181609707 QTPKNHSSIGKCDI-CQSZACIVSA-N 346.396 5.357 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1sc(-c2ccccc2)nc1C 185845367 RWCDAZSFXSDGOP-GDBMZVCRSA-N 342.508 5.240 30 20 EKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)cc1 207186260 HKQYQSLDDIPJJQ-WDZFZDKYSA-N 335.384 5.219 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCC(C)(C)CCC#N 348155597 NENARGQAKARRCP-UHFFFAOYSA-N 329.488 5.385 30 20 EKED CC(C)(C)c1ccc(C(=O)Nc2ccc(Cl)cc2CC#N)s1 410968699 OBMBSUIUHGYTFG-UHFFFAOYSA-N 332.856 5.017 30 20 EKED C[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 429760972 AAEDZOCVJMUKAQ-QAPCUYQASA-N 349.434 5.003 30 20 EKED C=CCC(C)(C)C(=O)N1CCC(c2c[nH]c3c(CC)cccc23)CC1 431393532 ROOBUGVZYQNPCP-UHFFFAOYSA-N 338.495 5.039 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 466667867 XPNFITRCBSSXRB-KEYYUXOJSA-N 339.401 5.217 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCC[C@H]1C 475552541 WILLPOSRFONLCH-APWZRJJASA-N 328.500 5.581 30 20 EKED Cc1c(C#N)cccc1C(=O)Nc1cc(Cl)c(Cl)cc1Cl 509126116 UYPSZKHYKUBIHI-UHFFFAOYSA-N 339.609 5.079 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1 534474158 YHAQUAKMFOIVQJ-IXDOHACOSA-N 342.508 5.237 30 20 EKED Cc1csc(NC(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)c1C#N 554774494 NBDDSUJENRKZMH-ZBFHGGJFSA-N 348.512 5.022 30 20 EKED Cc1csc(NC(=O)CC(c2ccccc2)c2ccccc2)c1C#N 568440651 JHYCLCKCRMUARK-UHFFFAOYSA-N 346.455 5.089 30 20 EKED CCSc1ccccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 584387546 NAQMUNYYXFRCHD-ZDUSSCGKSA-N 344.505 5.043 30 20 EKED N#CCCn1cc(/C=C\c2nc(C3CCCCC3)no2)c2ccccc21 609474770 PJBZRSGPSOEKDW-QXMHVHEDSA-N 346.434 5.156 30 20 EKED COc1ccc(CN[C@H](c2oc3ccccc3c2C)C(C)C)cc1C#N 742370649 GWFDXDWBNGZHCN-NRFANRHFSA-N 348.446 5.108 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1Cl 745990592 VNGPNRUTQXEXAL-WAPJZHGLSA-N 349.817 5.307 30 20 EKED FC(F)(F)c1cnc(NN=Cc2ccccc2C2CC2)c(Cl)c1 751131045 JZJHXPJDZMAPMP-UHFFFAOYSA-N 339.748 5.077 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3cnc(-c4ccccc4)nc3)oc2c1 754831162 XELQYVVOZIVGTD-NTMALXAHSA-N 340.382 5.094 30 20 EKED C#CC[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 773117329 VJKXBJYYAQRRLA-QZTJIDSGSA-N 327.880 5.231 30 20 EKED Cc1c([C@H](NCc2ccc(OCC#N)cc2)C(C)C)oc2ccccc12 775411944 YQYBBZZQTNIGNE-OAQYLSRUSA-N 348.446 5.131 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100189 KRHVSZJSIIITSC-LUQQZNFBSA-N 346.817 5.168 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C[C@H]1CCC(F)(F)C1 798212427 FVHZDIWJHFMIQU-GFCCVEGCSA-N 346.402 5.051 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(OC)c(Cl)c1 799901533 GULSKWIIYNLZEX-UHFFFAOYSA-N 346.883 5.276 30 20 EKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1nc(C)sc1C 916544219 TXAIWMQKCJSZNP-UHFFFAOYSA-N 344.871 5.106 30 20 EKED C=CCN(C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)C(C)C 918062206 NVJQTAYBIGMADO-OAQYLSRUSA-N 348.446 5.128 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776339838 WDEQVACJGYMODV-KTKRTIGZSA-N 342.822 5.133 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCCC1(C)C 467492049 KQISTZJVILDTIS-RHSMWYFYSA-N 345.512 5.171 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(OCc2ccccc2C)c1 485388168 SWROHOVGORBNEU-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCCC1 487387196 INYMMXOKPTVIBV-PXNSSMCTSA-N 326.484 5.144 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)s2)c(C)c1 487738598 KPHIRPLSMKDTTF-GFCCVEGCSA-N 330.478 5.071 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1ccc(C#N)cc1F 506337356 JQWVLXAZCARUMS-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CCN(C(=O)[C@@H](C)CC1CCCCC1)[C@H](C)c1ccc(C#N)cc1 510303930 AXHHCHRIUZDCNF-DLBZAZTESA-N 326.484 5.074 30 20 EKED CC[C@@H](Nc1cc(Cc2ccccn2)ccc1C)c1ccc(C#N)cc1 511031768 NHBBUUWXAQYOQH-JOCHJYFZSA-N 341.458 5.416 30 20 EKED COc1cc(CN[C@H](C)c2ccc(-c3cccs3)cc2)ccc1C#N 516516487 FIGMEZHFMYWADU-OAHLLOKOSA-N 348.471 5.146 30 20 EKED CCSc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 551211855 YJWVUDDGYLERRZ-LAUBAEHRSA-N 338.520 5.884 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 559859146 BNVMHPDBYLDIAF-KDOFPFPSSA-N 347.289 6.079 30 20 EKED N#CCCCCCC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 588308195 IFUHZCJLCQIKJO-GOSISDBHSA-N 346.883 5.081 30 20 EKED Cc1cccc(C)c1Oc1ccccc1NC(=O)CCCCCC#N 588892260 NAHODHNEXWEPBN-UHFFFAOYSA-N 336.435 5.508 30 20 EKED Cc1ccc(CN(C(=O)CCCCC#N)[C@@H]2CCc3ccccc32)cc1 593964979 PSYPNRDDFLNAJM-JOCHJYFZSA-N 346.474 5.095 30 20 EKED C=CCOc1ccc(CN[C@H](CC)c2cccc(Cl)c2)cc1OC 618466384 JLXOZYODIXUUDI-GOSISDBHSA-N 345.870 5.154 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC(C)C)cc1 682803823 SFYOUIRGVFMXPB-UHFFFAOYSA-N 337.463 5.578 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1ccc2ccccc2n1 685782538 IENYPSMOLDQHTI-HXUWFJFHSA-N 338.410 5.292 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cccnc2Cl)cc1 741467907 AZUYWSRSFXCVOV-OUKQBFOZSA-N 349.817 5.307 30 20 EKED COc1ccccc1/C=C/C=C/C(=O)c1ccc(SC)c(F)c1 741848122 WGQKERVAQFWOLQ-DLYLGUBQSA-N 328.408 5.009 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc3c(c2)CCCC3)c1 772982153 FTONXEDSLZAIPS-VGOFRKELSA-N 348.490 5.097 30 20 EKED C=CC[C@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1ccncc1 776158478 UGLCCMPPOJTRGK-DYVFJYSZSA-N 326.827 5.449 30 20 EKED CC(C)N(C(=O)CCCCCC#N)c1ccc(Nc2ccccc2)cc1 808292649 YRFCWLFHIVUSSP-UHFFFAOYSA-N 349.478 5.646 30 20 EKED COc1c(O)cccc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 810231789 NQWFLDLOGMUTDV-LUAWRHEFSA-N 344.366 5.196 30 20 EKED C=CCN(Cc1cc(Cl)nc(Cl)c1)Cc1ccc(Cl)s1 918756620 NHBAKYWMTQIEKZ-UHFFFAOYSA-N 347.698 5.292 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2ccccc2c1 66801501 ZYJDCFOIAZEDHA-OAHLLOKOSA-N 346.455 5.486 30 20 EKED CC(C)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1Cl 115619939 IKSKMNNUWRSADF-YWZLYKJASA-N 342.870 5.118 30 20 EKED N#Cc1ccc(Oc2cccc(NCc3csc(C4CC4)n3)c2)cc1 134849509 YFYDFPRAJPIPDL-UHFFFAOYSA-N 347.443 5.297 30 20 EKED C[C@@H](Nc1cccc(COCc2ccco2)c1)c1cccc(C#N)c1 179732728 KPACFQNQQUUAQZ-MRXNPFEDSA-N 332.403 5.041 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1ccc(Cl)s1 303128263 HNDJSPHUWKAQFC-VOTSOKGWSA-N 331.849 5.421 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 410360951 CJWOCIPNMWHSJI-UHFFFAOYSA-N 338.838 5.121 30 20 EKED Cc1c(C(=O)Nc2cccc(Cl)c2F)sc2ccc(C#N)cc12 431036095 VCUJYUQEXLZGIU-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C[C@@H](SCc1ncc(-c2ccccc2F)o1)c1ccc(C#N)cc1 437277293 QBKKFHDGGIBUGF-CYBMUJFWSA-N 338.407 5.347 30 20 EKED C[C@@H](N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1(C)CC1 438653851 GFSVFCUMEGPQJF-OAHLLOKOSA-N 349.434 5.003 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1cccnc1)c1cc(C)ccc1Cl 466607105 CNLRXTAZEPHOLV-MRXNPFEDSA-N 342.870 5.179 30 20 EKED C[C@@H](CCc1ccc(Cl)s1)N[C@@H](CCCC#N)c1ccccc1 522018820 GEXJIGUJRJNJFR-YJBOKZPZSA-N 346.927 5.747 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 536835225 WJYVEMKDDABNFW-FXAWDEMLSA-N 330.431 5.642 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2cccnc2)cc1 539609762 LVEIDEAZTTVSBH-HOTGVXAUSA-N 345.421 5.171 30 20 EKED COc1ccc(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)cc2)cc1 540609611 UXEYEYJWXIGMGM-QGZVFWFLSA-N 342.442 5.085 30 20 EKED N#Cc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)cc1 580980885 GHRFCHUBNCHBOE-GOSISDBHSA-N 331.246 5.106 30 20 EKED CCC(C)(C)[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 596732804 OMBYRHCYUAVOPN-KBPBESRZSA-N 333.501 5.027 30 20 EKED CC(C)c1cc(Cl)ccc1NC(=O)N(CCC#N)Cc1ccco1 599884638 XGWWOWFIXALKMJ-UHFFFAOYSA-N 345.830 5.004 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1c[nH]c2cc(F)ccc12 727975630 VDTUWIUCOJHFPQ-HJWRWDBZSA-N 348.402 5.327 30 20 EKED N#C[C@H](C(=O)/C=C/C1CCCCC1)c1nc(-c2ccccc2)cs1 735594072 UIBBCBGMJKUGCU-FMQWLBJXSA-N 336.460 5.123 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3ccc(C(C)C)cc3)o2)cc1 748097953 UJORFBDYIVRXIP-MRXNPFEDSA-N 349.434 5.280 30 20 EKED CCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749050114 ZXFPUCCVEGHVTP-GOEBONIOSA-N 326.465 5.121 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 766022463 VZQTVBQHIMPGET-PIGZYNQJSA-N 339.241 5.496 30 20 EKED C#CC[C@@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1ccccc1 773113300 CZXIFYIZLGQUIL-VQIMIIECSA-N 332.472 5.225 30 20 EKED O=C1/C(=C\c2scnc2C2CC2)CSc2c(Cl)cccc21 782326249 NVYLHBNZYMDFBL-POHAHGRESA-N 333.865 5.046 30 20 EKED C[C@@H](NCc1ccc(CF)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782525551 ZHNJNADMRHBNQX-QGZVFWFLSA-N 344.433 5.546 30 20 EKED C=CCC[C@@H](NCc1cnc(CC(F)(F)F)s1)c1ccccc1 893191960 QWBPCHKSRPDMTC-OAHLLOKOSA-N 340.414 5.045 30 20 EKED N#C[C@H](C(=O)CCCC1CCCCC1)c1nc2ccccc2s1 916627162 BKCBAHRAXLRAAB-OAHLLOKOSA-N 326.465 5.223 30 20 EKED N#C[C@H](C(=O)c1cc2ccccc2s1)c1nc2ccccc2s1 41502791 BVKMFIKPWBTLOZ-GFCCVEGCSA-N 334.425 5.001 30 20 EKED Cc1nc(N[C@H](CCCC#N)c2ccccc2)c2c(C)csc2n1 431498920 ZCOTUKDHUXJFEE-MRXNPFEDSA-N 336.464 5.155 30 20 EKED C=CCCCCCN(C)C(=O)c1cc(C2CC2)nc2ccc(F)cc12 464084094 XTNPKILBINVBAQ-UHFFFAOYSA-N 340.442 5.070 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 466873488 QFGYZNSINGNSMF-RHSMWYFYSA-N 339.401 5.361 30 20 EKED C=CCC(CC=C)C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 467328290 UWEGUENNFCDYSO-CQSZACIVSA-N 340.492 5.064 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(C)cccc1C(C)C 471136719 LOHZCPVEICZXBM-UHFFFAOYSA-N 336.479 5.729 30 20 EKED Cc1ccc(-c2nc(CSCc3ccccc3C#N)cs2)o1 498119995 WHLWTZUSYDNHHB-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCC[C@H](C)C1 530402005 JJXSWRVBTKWMPK-WMZOPIPTSA-N 329.484 5.072 30 20 EKED C[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1Cl 584201805 LVCGMYFBVIASKX-YMTOWFKASA-N 337.275 5.265 30 20 EKED C[C@H]1C[C@H](NC2(c3ccc(C#N)cc3)CCC2)c2ccsc2S1 594514695 KYNPRACERDSDOL-GUYCJALGSA-N 340.517 5.214 30 20 EKED COc1ccc(-c2ccc(C)c(N[C@@H](C)c3cccc(C#N)c3)c2)cn1 600853616 LQCCZEABVYVFSJ-INIZCTEOSA-N 343.430 5.110 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc(Cl)c(Cl)c1 731835412 CHDSKLDIAYKKMI-CLFYSBASSA-N 344.197 5.545 30 20 EKED CC[C@@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 732915850 JFBBHXGZJJXCBQ-XZOQPEGZSA-N 326.443 5.905 30 20 EKED N#Cc1cccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741845182 YLTRGEBVGCVOLP-WTKPLQERSA-N 347.361 5.109 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744034611 CSEGNYYBFLFQEL-TZMCWYRMSA-N 348.899 5.732 30 20 EKED CSc1ccc(C(=O)/C=C/c2scnc2C2CC2)c(Cl)c1 782352958 XWHRTFQSWGMDEN-VOTSOKGWSA-N 335.881 5.292 30 20 EKED CC(C)(CCC#N)COC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 798877310 WQJVGTYLKDBVAN-UHFFFAOYSA-N 341.373 5.013 30 20 EKED C=CCC(C)(C)c1noc(-c2ccc(C3SCCS3)cc2)n1 815708327 PRIKEPOTRZCHLJ-UHFFFAOYSA-N 332.494 5.069 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(F)=C3CCCC3)n2)cc1 815910854 JTDOUNCREYMURK-OAHLLOKOSA-N 340.423 5.092 30 20 EKED C=CC[C@@H](N[C@@H](c1cccc(OC(C)C)c1)C(F)F)c1ccncc1 848531966 YJYZAZHAVZKESE-MOPGFXCFSA-N 346.421 5.082 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2cc(OC)ccc21 861269185 NWBDRRUSMYPJJG-NRFANRHFSA-N 349.474 5.216 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)CC(C)(C)C 917046977 NYQZSKHQEFLNOS-WCQYABFASA-N 348.899 5.588 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(OCC(C)C)c1 1776783830 OYXPBHSJYGJHHU-IBGZPJMESA-N 349.515 5.015 30 20 EKED N#Cc1ccc(CCC(=O)Nc2ccc3oc4ccccc4c3c2)cc1 10753674 ZSDLUNIVXUVKCU-UHFFFAOYSA-N 340.382 5.029 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)s1 176955130 VJKNHLCSOWXVSM-QGZVFWFLSA-N 344.892 5.214 30 20 EKED Cc1ccccc1[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)C(C)(C)C 181866585 BVDNQLRCAOEMLI-UWJYYQICSA-N 336.479 5.335 30 20 EKED CCC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccnc1 186224895 ZLXSZNMXEPDILJ-HSZRJFAPSA-N 341.458 5.251 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)C(c1ccccc1)c1ccccc1 277794469 HLZYBSFAJSYMLO-XMMPIXPASA-N 339.504 5.245 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@H]3CCC(=O)[C@H](C)C3)n2)s1 328920602 LWNAGNCERXASIV-MNOVXSKESA-N 348.493 5.027 30 20 EKED O/C(C/N=C(/O)C1CCCCC1)=N/C1CCC(c2ccccc2)CC1 329307390 ZCBVGXCTAAETOL-UHFFFAOYSA-N 342.483 5.206 30 20 EKED N#CCCC[C@H](NCc1ccccc1C(F)(F)F)c1ccccc1 353916224 PATSAGSRMUYMHK-SFHVURJKSA-N 332.369 5.230 30 20 EKED C[C@H](N[C@@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 442875946 UQFKMCWUWAATOI-IRXDYDNUSA-N 342.442 5.343 30 20 EKED Cc1nc(S[C@H](C)c2cccc(C#N)c2)[nH]c1Cc1ccccc1 442912109 IOKQVHUYJMEDLW-OAHLLOKOSA-N 333.460 5.034 30 20 EKED Cc1nc(-c2ccc([C@H](C)NC3CCC(C)(C#N)CC3)cc2)cs1 449071691 OCDABKYXNDHYKN-KLOIUYPJSA-N 339.508 5.242 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(OCC)c1 476091271 QUEVJCSOTBMWKR-UHFFFAOYSA-N 337.463 5.498 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H](C)c1ccccc1 476122316 JZBUMYMQDWXRDA-GOSISDBHSA-N 335.491 6.061 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1cnc(-c2ccsc2)s1 484343274 QTHJGHLEEVGISI-UHFFFAOYSA-N 346.521 5.080 30 20 EKED CCC(CC)[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccs1 512662420 XCKIRJBGDAVTQL-YJYMSZOUSA-N 330.472 5.587 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2cccc(F)c2)n1 519003332 XFEPQSLBLVCJAV-JTQLQIEISA-N 340.345 5.273 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(F)C[C@@H]1C 529084070 WDLPXYXWNYXISL-AWEZNQCLSA-N 336.426 5.190 30 20 EKED CSc1ccc(C)c(NCc2cccc(OCCCC#N)c2)c1 539401142 ASAMJVUDOBGTEO-UHFFFAOYSA-N 326.465 5.012 30 20 EKED CN(Cc1ccccc1NCc1ccc(CC#N)cc1)C1CCCCC1 542236410 ZEAQBXQOIBXOJS-UHFFFAOYSA-N 347.506 5.129 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1Cl 548606888 UBSDKDNXFRJCJW-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCCCC1(C)C 574873021 RWIQVAWNLSFRCE-LSDHHAIUSA-N 330.497 5.236 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc3nc(C4CC4)oc3c2)cc1 594505195 PZEJNVDLKCUHGO-UHFFFAOYSA-N 331.419 5.118 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1cc2c(Cl)cccc2s1 615925425 SBSSXBUFKOZUQZ-UHFFFAOYSA-N 334.872 5.099 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1Cl 618808036 YRPIXYZIMGNJJR-APPDUMDISA-N 331.246 5.203 30 20 EKED Cc1ccsc1C(=O)/C=C\c1ccc(OC(F)F)c(Cl)c1 733748555 CCEWRVVTSIVIBU-RQOWECAXSA-N 328.767 5.207 30 20 EKED Cc1ccnc(-c2ccc(N=Cc3c(O)ccc4ccccc34)cc2)n1 734303448 QBACQIFMFVJMPL-UHFFFAOYSA-N 339.398 5.061 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)Cc2cc(Cl)ccc21 742436346 APJHCTFHAJYIOX-KPKJPENVSA-N 343.860 5.347 30 20 EKED C=CCc1cc(/C=C(/Cl)c2nc3ccccc3o2)cc(OC)c1O 747064447 WFWAAEWZJLSIBP-GXDHUFHOSA-N 341.794 5.007 30 20 EKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)CCC2 776168231 ACNOLEMOVYQWFQ-UZUQRXQVSA-N 348.490 5.441 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3C=CCCC3)n2)cc1 778607171 SHEQHZSGFXXCDP-RDJZCZTQSA-N 336.460 5.041 30 20 EKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1cccc(Cl)c1 795980198 CFBHUSMNGNJUDU-YOEHRIQHSA-N 327.811 5.032 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC(C)(C)C3CC3)n2)cc1 815911130 RYVQRFKGNXQFLT-MRXNPFEDSA-N 338.476 5.121 30 20 EKED CCCCCCCCC(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1 839856788 KLASEICNDVASMV-NRFANRHFSA-N 343.511 5.117 30 20 EKED CCCC[C@@](C)(F)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 850762862 PRHFJDOFPUTXNH-DNVCBOLYSA-N 344.455 5.213 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(Cl)c(Cl)c1 916137183 UYCUGVLTPJMXEC-XBXARRHUSA-N 328.198 5.438 30 20 EKED COc1cccc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)c1 918713094 KIISHDBTTBLESB-KHPPLWFESA-N 335.428 5.023 30 20 EKED C=C(C)c1cccc(NC(=O)N2[C@H]3CC[C@H]2CC(CC(F)F)C3)c1 934885975 BFEZXRRLIOUFFD-IRXDYDNUSA-N 334.410 5.150 30 20 EKED CCCCCCCC(=NNc1ccccc1C(=O)O)c1ccccc1 1776029922 OUKYZTSGPCDMJW-UHFFFAOYSA-N 338.451 5.562 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)c1ccccc1 108240372 NUZZHSMFPLEXMC-HZPDHXFCSA-N 338.476 5.071 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(C(C)(C)C)cs1 121811369 UHJMLCYTPSBBPY-ZDUSSCGKSA-N 345.537 5.447 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)o1 206383993 NQWVUJLJHMAJHI-CLFYSBASSA-N 335.384 5.354 30 20 EKED CCc1ccc(Cl)c(CC)c1N/C(O)=N/CC1CCC(C#N)CC1 331268666 KXQKQPFDRPXTOK-UHFFFAOYSA-N 347.890 5.121 30 20 EKED C[C@@H](C(=O)Nc1ccc(C#N)cc1Cl)c1ccc2ccccc2c1 430357272 RQPLGRYOMGBOMG-CYBMUJFWSA-N 334.806 5.107 30 20 EKED C[C@H](Sc1nnc(-c2cccc(Cl)c2)o1)c1cccc(C#N)c1 442915138 VVXDIAMWIYHQHI-NSHDSACASA-N 341.823 5.115 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@@H](C)CC1 443608787 XOLQXDYOFSWAQS-BZUAXINKSA-N 345.512 5.029 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCC#Cc1cccc(Cl)c1 448066312 DEIQKTGGTMSJDW-OAHLLOKOSA-N 340.879 5.198 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1ccc(F)cc1C#N 462386623 GHYJSSPITAMQBL-LBPRGKRZSA-N 337.423 5.302 30 20 EKED Cc1cccc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 474817475 ZYIKFTRWATUEBH-UHFFFAOYSA-N 342.398 5.220 30 20 EKED Cc1ccc([C@H]2CCCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1 476120966 MXOWWLZEJWAZJA-FCHUYYIVSA-N 346.474 5.136 30 20 EKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCCC(C)(C)C#N)C1 483641252 JAOVBTAEMGZDSD-WMLDXEAASA-N 338.417 5.418 30 20 EKED N#Cc1cccc(SCc2nc3cc(C(F)(F)F)ccc3o2)c1 489685047 KZKUVLSWKHTBTN-UHFFFAOYSA-N 334.322 5.011 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(F)c1 505029653 OYSQPGBDDTUWBR-FQEVSTJZSA-N 338.426 5.313 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)c(F)c1 540709266 JVCUMSNDSHMPBH-YJYMSZOUSA-N 328.406 5.274 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 592975713 LRZFNRHVDRZVJN-HNNXBMFYSA-N 338.407 5.049 30 20 EKED Cc1oc(-c2ccccc2)nc1CS[C@@H](C)c1ccc(C#N)cc1 609825086 FVSGSPRGHNCNPG-HNNXBMFYSA-N 334.444 5.516 30 20 EKED CCCC(=O)Nc1cccc(N[C@@H]2CCCc3cc(C#N)ccc32)c1C 611469061 LXFUGCRTWAMVAF-OAQYLSRUSA-N 347.462 5.095 30 20 EKED C[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 611773869 CBEDNBLZJLLQJM-QGZVFWFLSA-N 341.414 5.167 30 20 EKED N#C[C@H](C(=O)C1CCCCCC1)c1nc2cc(Cl)ccc2s1 726321939 CISWZRMRPIPVAM-CYBMUJFWSA-N 332.856 5.096 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccc(SC(F)F)cc1 734980345 RBOFTYFGZYBWCK-UHFFFAOYSA-N 343.402 5.386 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)s1 736433226 OVYGOFAKAVUCJL-FPLPWBNLSA-N 339.382 5.356 30 20 EKED CC(/C=C\C(=O)c1ccc(OCC#N)cc1)=C\c1ccc(Cl)cc1 753714779 POTIPAUFODGPJH-JROIXGAWSA-N 337.806 5.085 30 20 EKED C#CC[C@@H](N[C@H](C)c1sc(C(C)(C)C)nc1C)c1ccccc1 773116223 QWDUDKNNOQXCGD-RHSMWYFYSA-N 326.509 5.164 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1cnc(-c2ccco2)s1 789141103 AFTCDEQOCPQMOI-PPLKPFPSSA-N 345.470 5.225 30 20 EKED CCCCCCCC[S@](=O)[C@H](C)c1nccn1-c1ccccc1 806641343 DHEVECMLLKIRAS-HXOBKFHXSA-N 332.513 5.043 30 20 EKED CC(C)(CC(F)(F)F)C(=O)Nc1ccc([C@H](F)C(F)(F)F)cc1 893911442 UYBLPZGGLAOGEP-JTQLQIEISA-N 345.258 5.177 30 20 EKED Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)c1cc2ccccc2o1 916138231 BOCKKKFCROCJAM-OUKQBFOZSA-N 342.398 5.131 30 20 EKED CCCCC/C(C=NNc1ccccc1C(=O)O)=C/c1ccccc1 1776029969 WDRFCLXWBVQQPI-IMKIVOICSA-N 336.435 5.446 30 20 EKED C=C(C)[C@H](NC(=O)Nc1c(C)cccc1C)c1ccc(F)c(F)c1 185726324 JUHKZTUJAPKQCB-KRWDZBQOSA-N 330.378 5.021 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1OC(F)F 193905616 ODYPOLDAZGZYAZ-AWEZNQCLSA-N 346.377 5.144 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NCc1ccc(O[C@@H](C)C#N)cc1 236622474 XDTYWBCJCCGFON-PGRDOPGGSA-N 336.479 5.163 30 20 EKED C=CCC1(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C)CCOCC1 425478507 PFPMZYOKPIMZCQ-INIZCTEOSA-N 347.524 5.197 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(Cl)c1SC(C)C 438251733 NPUPCNNQBRFBAY-UHFFFAOYSA-N 326.893 5.270 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc(Cl)c1Cl 439462253 OPFNGFSEWHNJDU-SNVBAGLBSA-N 339.653 5.369 30 20 EKED N#CCC[C@@H](NC(=O)C1CCC(c2ccccc2)CC1)c1ccccc1 439671038 GMRSACBEDNWNHE-KITAHSCOSA-N 346.474 5.122 30 20 EKED C[C@H](S[C@H](C)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 443144522 QAPROSWKONJUIF-UONOGXRCSA-N 335.432 5.164 30 20 EKED CC#CCCCC(=O)Nc1ccccc1NCc1ccc(Cl)cc1 468282120 QIWRKJPRHUIPSG-UHFFFAOYSA-N 340.854 5.084 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Cl 468823274 DROISVXFRISLOS-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(OC2CCCC2)cc1)c1ccccc1 474698824 QLODKPXBVLJVHP-SFHVURJKSA-N 348.446 5.034 30 20 EKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 480584551 JKJLZTWXCLZALI-FOIQADDNSA-N 349.434 5.003 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(F)c3ccccc23)n1 483708981 IKGCNIDLKGRQTI-OAHLLOKOSA-N 338.407 5.049 30 20 EKED COc1cc(-c2ccccc2)ccc1CNc1ccc(CC#N)cc1 544730157 BBZDKIBKVSATJS-UHFFFAOYSA-N 328.415 5.040 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2ccccc2)o1 551805936 ZYGVOJFWHNMKMD-MRXNPFEDSA-N 328.415 5.158 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)ccc1Cl 555995440 JNPWHLNBDGKERO-LLVKDONJSA-N 348.830 5.126 30 20 EKED C=CCC[C@@H](NCCc1coc(-c2ccc(C)cc2)n1)c1ccco1 556869340 GVFJDBJVYGAHLO-LJQANCHMSA-N 336.435 5.083 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nccc(C)c2c1 582317154 DZISEASJPMJMDQ-UHFFFAOYSA-N 344.458 5.647 30 20 EKED C=C(C)[C@H](NCc1ccc(C(C)C)nc1C)c1ccc(F)c(F)c1 584733892 YGZPHSOWIFZXBD-FQEVSTJZSA-N 330.422 5.199 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F 588673644 WYOYVMBNRZAWKO-SFHVURJKSA-N 348.368 5.033 30 20 EKED Cc1cccc(-c2nnc(SCCC#N)n2[C@H]2CCCC[C@H]2C)c1 593578002 IGOUPMPHGPDQFJ-WBVHZDCISA-N 340.496 5.011 30 20 EKED Cc1cc(C)cc(Oc2ccc(NC(=O)C3(C#N)CCCC3)cc2)c1 604016174 HDQVAEZALMXESH-UHFFFAOYSA-N 334.419 5.118 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCC1CCCC1 609398271 PQKBFFMAHWSMNB-HNNXBMFYSA-N 345.512 5.030 30 20 EKED C=CCC[C@H](N[C@H](C)c1cnc(OC)c(Cl)c1)c1ccccc1 671298258 LMLNIIMMVASBLU-KDOFPFPSSA-N 330.859 5.102 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(Cl)c2SC(F)F)CC1 732430738 KOFAYTILEADBFM-UHFFFAOYSA-N 346.830 5.085 30 20 EKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2sccc2C)ccc1OC 733749666 SNRAZHMQCCSVRI-IZPAUZPXSA-N 330.449 5.139 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCCC[C@H]1c1noc(C)n1 737617306 YRSGJUFVFGHLGY-RXBGNRNISA-N 347.503 5.129 30 20 EKED CSc1ccc(C(=O)/C=C\c2nccc3ccccc23)c(Cl)c1 765613189 HWIQZTSCNKQPSH-HJWRWDBZSA-N 339.847 5.506 30 20 EKED Cc1nc(-c2ccc(N[C@H](C)c3ccc(OCC#N)cc3)cc2)oc1C 777653126 RREFVOSLRYIWKV-OAHLLOKOSA-N 347.418 5.034 30 20 EKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2ccc3cnccc3c2)c1 782302742 IHWSHNKBUVKWMP-XQRVVYSFSA-N 339.341 5.041 30 20 EKED CC(C)c1ccc(-c2nc(CSCCO[C@H](C)C#N)cs2)cc1 802749718 LDGJCNYSYWROBC-CQSZACIVSA-N 346.521 5.095 30 20 EKED N#CCCC[C@H](NCc1cc2c(Cl)nccc2o1)c1ccccc1 877550604 ZIBNVZMPLCPAFT-KRWDZBQOSA-N 339.826 5.006 30 20 EKED Cc1ncsc1C(=O)/C=C\c1csc(-c2ccc(Cl)cc2)n1 915987518 GCXSPYOFXRJSKX-SREVYHEPSA-N 346.864 5.125 30 20 EKED C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932567023 JURSJAYGAPGDKV-DYESRHJHSA-N 347.462 5.148 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCC1CCC(CCC)CC1 1776783375 WTBDJCSEOWNHKZ-ACBHZAAOSA-N 325.537 5.386 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc2ccccc2c1C 1776784758 RPTNGMVMMUBCQL-FQEVSTJZSA-N 341.495 5.442 30 20 EKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)OCCCCC#N)c2c1 26459798 GCPWFMMNNKDLAO-UHFFFAOYSA-N 344.414 5.061 30 20 EKED C=C(C)CN(CC)C(=O)c1ccccc1SCc1cccs1 52819302 WLJXYEVSPCEDHH-UHFFFAOYSA-N 331.506 5.079 30 20 EKED N#C[C@@H](C(=O)C1=CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 123094101 MUGZSADKGTVREB-HNNXBMFYSA-N 342.851 5.140 30 20 EKED C[C@@H](SCC(=O)Nc1ccc(C#N)cc1)c1ccc2ccccc2c1 195541798 ACZFGLKVFGOSQK-OAHLLOKOSA-N 346.455 5.144 30 20 EKED C[C@@H](OC1CCCCCC1)C(O)=Nc1cc2c(cc1F)CCC(O)=N2 329930685 ZUNQDIYEELUXCW-GFCCVEGCSA-N 348.418 5.076 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CC(c2ccccc2)C1 466340132 OZZLUTGNBYJNES-UHFFFAOYSA-N 347.502 6.061 30 20 EKED C[C@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccc(C#N)cc1 474478452 LQNYFACSYFDPTD-SHUKQUCYSA-N 330.884 5.116 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Oc2cccnc2)cc1 487994642 QBYXEEMWPFYNIY-DLBZAZTESA-N 343.430 5.157 30 20 EKED Cc1cc([C@H](NCCCCC#N)c2ccccc2Cl)ccc1F 491062811 XFDLEUOWZPRWQC-IBGZPJMESA-N 330.834 5.160 30 20 EKED C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1F 512286700 DIXYYWSCUCJDEL-CYBMUJFWSA-N 347.393 5.403 30 20 EKED Cc1nc(-c2ccc(CNc3cc(Cl)ccc3C#N)s2)cs1 522935773 KZRMCBUOBDCAQC-UHFFFAOYSA-N 345.880 5.317 30 20 EKED C[C@@H]1CCC[C@@H](OCc2cccc(NCc3cc(C#N)cs3)c2)C1 532728369 OMXCLQWGUNKQOU-DNVCBOLYSA-N 340.492 5.327 30 20 EKED C[C@H](Sc1cccc(Cl)c1C#N)c1nc(-c2cccs2)no1 543958898 KNAQXQXOXQLJNA-VIFPVBQESA-N 347.852 5.176 30 20 EKED Cc1csc(NC(=O)c2oc3c(ccc4ccccc43)c2C)c1C#N 570883725 WCXWPSJNOQLTQV-UHFFFAOYSA-N 346.411 5.388 30 20 EKED C[C@@H](NCc1sc2ccccc2c1Cl)c1cccc(C#N)c1 610344669 DGMKLRFPQIOWHQ-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C=CCOc1cccc(CN[C@@H](C)c2ccccc2C(F)(F)F)c1 619775719 MKAFWXBYASWALE-AWEZNQCLSA-N 335.369 5.121 30 20 EKED C#Cc1cccc(N(C)C(=O)c2cc(C)c(-c3ccc(F)cc3)s2)c1 728481582 MQZHYBNVDWXAFJ-UHFFFAOYSA-N 349.430 5.121 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C/c3ccsc3)c2)cc1 729375314 DNWHWIUGNNQXOU-RMKNXTFCSA-N 346.411 5.064 30 20 EKED C=CCCCN(C)Cn1c(=S)sc2ccc(C(F)(F)F)cc21 736590367 UGOCYKRBLSERCA-UHFFFAOYSA-N 346.443 5.307 30 20 EKED FC(F)(F)c1nc(NN=C2CCC[C@H](C3CC3)C2)c2ccccc2n1 737427265 KERZBHFEYLHMFY-LBPRGKRZSA-N 348.372 5.017 30 20 EKED Cc1cc2cc(C(=O)/C=C/c3ccc(O[C@@H](C)C#N)cc3)oc2cc1C 749132650 PUIXFUFOPWAGRK-FSNWXROXSA-N 345.398 5.237 30 20 EKED CC[C@H](C)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 755308183 JYCNAJABTKWQBJ-HNNXBMFYSA-N 338.476 5.458 30 20 EKED CCCCCCC=Nn1cnnc1SCc1ccc(Cl)cc1 755594719 VQIYDDJICYQFCC-UHFFFAOYSA-N 336.892 5.028 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2csc(-c3cccs3)n2)c1 763291603 BQJCLFGJYIFKFL-ALCCZGGFSA-N 329.421 5.215 30 20 EKED Cc1cc(/C=C/C(=O)c2c(F)cccc2Cl)cc2cccnc12 809159423 PIYCZJFMHBSZTH-BQYQJAHWSA-N 325.770 5.232 30 20 EKED CCCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916650289 AGBYHYZVFOSWIU-QGZVFWFLSA-N 340.492 5.655 30 20 EKED O=C(/C=C/c1cc(C(=O)O)c(Cl)s1)c1ccc2ccccc2c1 1776131701 ZMYJGTJMFRXRHE-BQYQJAHWSA-N 342.803 5.149 30 20 EKED Cc1ccc(-c2cccc(/C=C/C(=O)c3ccc(C(=O)O)s3)c2)cc1 1777429665 DSNKYDYGFUOYDP-JXMROGBWSA-N 348.423 5.318 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1 89763748 BUBCCKQASHSPGD-GFCCVEGCSA-N 337.316 5.143 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1c(Cl)ccc(Cl)c1Cl 90467759 PIMBHKYCJAOGNL-UHFFFAOYSA-N 339.609 5.079 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 163750826 YTRUCUOHYRBHOS-VQHVLOKHSA-N 339.372 5.121 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1 173990881 XROZWPNIHDXZGE-GJZGRUSLSA-N 347.487 5.402 30 20 EKED C[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(OCC#N)cc1 180541241 BRPHLNDZOLVUFW-QWHCGFSZSA-N 349.261 5.308 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1scnc1C1CC1 189873199 FRJXJIPOQVCSMH-UHFFFAOYSA-N 326.465 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCO[C@@H](C)CC(C)C 189895648 MFJQYOUKMXGIIW-KRWDZBQOSA-N 331.500 5.318 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)CCCC#N)c(C(F)(F)F)c1 291439714 YOVBJWITFDRVCX-NSHDSACASA-N 344.402 5.228 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(F)c1 322410388 WRXDUYCREQNDHF-ZDUSSCGKSA-N 332.806 5.335 30 20 EKED C=CCC[C@H](NCc1ncc(C)s1)c1ccc(C(F)(F)F)cc1 342197211 TUWKTYBTGQEMCO-HNNXBMFYSA-N 340.414 5.267 30 20 EKED CC[C@@H](N[C@H](CCCCOC)c1ccccc1)c1ccc(C#N)cc1 359018367 MRPUJKVLTQXBBO-FGZHOGPDSA-N 336.479 5.157 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(CSCC)c1 438362803 DYKNGOXUVLWJOD-UHFFFAOYSA-N 340.492 5.160 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC(C)(C)C1 443606425 XPJVWDODMCPUHS-LSDHHAIUSA-N 345.512 5.029 30 20 EKED N#CCCSc1ccccc1NCC1CCC(C(F)(F)F)CC1 471974509 ZNPCGUNZNROJFF-UHFFFAOYSA-N 342.430 5.473 30 20 EKED CCSc1cccc(CNc2cccc(OCCCC#N)c2)c1 472042928 NEOQFUJWKSOSFQ-UHFFFAOYSA-N 326.465 5.093 30 20 EKED CCCCN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](C)c1ccccc1 476816831 OFQWMJQQNZAPMK-KRWDZBQOSA-N 335.451 5.262 30 20 EKED CC(C)(C#N)c1ccccc1CSCc1cc(-c2ccco2)on1 486757395 WHURVRYGLOUOCX-UHFFFAOYSA-N 338.432 5.169 30 20 EKED C[C@@H](C(=O)Nc1ccccc1Nc1ccccc1)c1cccc(C#N)c1 486990548 XMGBDRLEKKARLD-MRXNPFEDSA-N 341.414 5.044 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC)c1cccc(Cl)c1 500423407 SUXUFLOKGVEWHT-IBGZPJMESA-N 342.870 5.189 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc(C#N)cc1 511417235 ZYDCAABTUPGOAN-GFCCVEGCSA-N 337.423 5.302 30 20 EKED N#Cc1cccc(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)c1 516357184 JEACZPFVGZMILA-UHFFFAOYSA-N 348.789 5.256 30 20 EKED Cc1ccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)co2)cc1 522841926 XOHGNJMJHBFYEH-HNNXBMFYSA-N 334.444 5.516 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(Cl)c1Cl 547607805 STIKYPYWNPGKHS-UHFFFAOYSA-N 338.259 5.524 30 20 EKED C[C@@H](NC(=O)CCCCCC#N)c1ccc(-c2ccc(F)cc2)cc1 588162922 SLEWKXPZYKLLIK-MRXNPFEDSA-N 338.426 5.144 30 20 EKED CC(C)Sc1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 591861705 CJCQLAISWLFPIL-QGZVFWFLSA-N 346.455 5.225 30 20 EKED Cc1cc(C(=O)N(CCC#N)C(C)C)sc1-c1cccc(Cl)c1 608814587 LEBOPHXOSSBUSP-UHFFFAOYSA-N 346.883 5.141 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 619513903 AIVNDWWHUMFTMX-CYBMUJFWSA-N 333.218 5.019 30 20 EKED CC(F)(F)CCC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 642652242 LZDWSFXMJAMCKN-UHFFFAOYSA-N 349.221 5.098 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1ccc(Cl)cc1Cl 726742519 ROSDBULZVMEDCS-YVMONPNESA-N 331.198 5.208 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 727952109 AOZGWUYQDGKZML-HUUCEWRRSA-N 328.481 5.469 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@](C)(C#N)C(C)C)sc2c1 732658535 QDFWRFSDZJNSRO-GOSISDBHSA-N 348.899 5.346 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cccc(OC2CCCC2)c1 754712228 HBGFVKFFPBHOGX-UHFFFAOYSA-N 349.352 5.440 30 20 EKED O=C(/C=C/c1ccc(SC(F)F)cc1)c1cccc(F)c1F 781550454 XDVBRGRSCANQRF-RMKNXTFCSA-N 326.314 5.176 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)c1ccc(F)cc1 789719016 MWUPHUJLUXRELT-UHFFFAOYSA-N 347.380 5.408 30 20 EKED C#CC[C@@H](N[C@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccccc1 796844554 DQQLMDWLTNEMEE-DNVCBOLYSA-N 327.855 5.072 30 20 EKED CCCCCCCCCCCN(C)CCOc1cccc(C(=O)O)c1 1776784572 IBBDMDIQUKWLKY-UHFFFAOYSA-N 349.515 5.226 30 20 EKED O=C1/C(=C/c2ccc(O)c(Cl)c2)CSc2ccc(Cl)cc21 60132713 JPQSGMJDXMYXSP-BJMVGYQFSA-N 337.227 5.071 30 20 EKED C[C@H](Sc1c(C#N)nnc2ccccc12)c1ccc(Cl)cc1 77213645 IPOLOOLTIIEABB-NSHDSACASA-N 325.824 5.008 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccccc1[N+](=O)[O-] 80468080 GUNFOFQPPFBFDH-KGLIPLIRSA-N 341.436 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1Cl 189891902 GPTLUCKIWWBOMC-UHFFFAOYSA-N 348.273 6.098 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 192755495 ZDEIEXXGHSFAKS-OPAMFIHVSA-N 330.406 5.138 30 20 EKED COc1ccc(C)cc1C(=O)/C=C/c1csc(-c2cccs2)n1 303231128 YMZWVWATAFOBPD-VOTSOKGWSA-N 341.457 5.085 30 20 EKED Cc1nc2cc(Cl)c(N=C(O)c3oc(C4CC4)nc3C)cc2s1 330132206 QEQZQPXJWVWPFQ-UHFFFAOYSA-N 347.827 5.068 30 20 EKED C[C@H](CCC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 352173788 GIAREYFKLDMNMU-NQIIRXRSSA-N 334.463 5.122 30 20 EKED N#CCC1(CN[C@@H](c2ccccc2)c2cccc3ccccc23)CC1 430750197 MUUCOWITVGLYMY-QFIPXVFZSA-N 326.443 5.213 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cccc2ccccc12)c1ccccc1 431716285 SCEDNAYBOPQPBL-HXUWFJFHSA-N 343.430 5.396 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 437657768 MOCJPBSVFRYHLB-LEWJYISDSA-N 347.462 5.114 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 464447932 UIFQHVKUUOZOBX-GUYCJALGSA-N 333.884 5.209 30 20 EKED C=CCC[C@@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1 467373147 JTGGKWAJFOGXFJ-UXHICEINSA-N 325.427 5.119 30 20 EKED Cc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)oc2c(C)cccc12 483200758 LZJHGWSTTUXDRE-SFHVURJKSA-N 340.382 5.088 30 20 EKED N#CC1(C(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)CCCC1 489651496 TUSMHHMKQLDHKU-UHFFFAOYSA-N 340.810 5.155 30 20 EKED C/C(=C/c1ccccc1C(F)(F)F)CNCC1CCC(C#N)CC1 500371548 RRJOMVBXHMIIIN-UVTDQMKNSA-N 336.401 5.028 30 20 EKED C=CCC[C@H](NCc1nc2cc(Cl)ccc2s1)c1ccco1 577131458 OEYAVUWKURYOHG-ZDUSSCGKSA-N 332.856 5.340 30 20 EKED N#CCC1(CSc2nnc(-c3ccc(F)cc3)c3ccccc23)CC1 594880003 FPYXGZJPJKZALS-UHFFFAOYSA-N 349.434 5.222 30 20 EKED C[C@@H]1C[C@H](CC(=O)[C@H](C#N)c2nc3ccccc3s2)CC(C)(C)C1 727629851 WURUOUPPRMTDRU-KFWWJZLASA-N 340.492 5.325 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1nc(-c2ccccc2)cs1 727974328 JTJCFVQAJHZSRL-VAWYXSNFSA-N 344.439 5.496 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cc1 728694918 NEVKGCFTPWAVDW-KFRNIWOLSA-N 346.213 5.180 30 20 EKED CCCCCOc1ccc(C(=O)/C=C\c2cccc(OCC#N)c2)cc1 730151306 JZUFQQNLWJTJIP-JYRVWZFOSA-N 349.430 5.054 30 20 EKED Cc1ccc(NC(=O)C(C)(C)C)cc1N=Cc1cc(Cl)ccc1O 732528865 BTXZROGXYUHOEG-UHFFFAOYSA-N 344.842 5.089 30 20 EKED O=C(/C=C/c1cccc(F)c1F)c1ccc(SC(F)F)cc1 734980007 GLWOADFVOOPQTJ-RMKNXTFCSA-N 326.314 5.176 30 20 EKED N#CCCc1ccc(N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 903293540 KUVCNDAXRBWRIK-GOSISDBHSA-N 345.368 5.046 30 20 EKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2ccncc2)cc1 916136163 IFMPTEFLIMPNDK-JLHYYAGUSA-N 342.442 5.004 30 20 EKED O=C(/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1OC(F)F 916140447 UWFVPJWTXMERJR-KPKJPENVSA-N 340.325 5.043 30 20 EKED CCOc1cc(/C=C/C(=O)c2cc(C)sc2C)cc(Cl)c1O 916155902 LNPVLBWHWQOGHR-AATRIKPKSA-N 336.840 5.019 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(C(F)F)cc1 185620957 OEZQPPUOTYSLJL-ZDUSSCGKSA-N 332.419 5.631 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc2ccccc2c1O 193906345 COCTXOBCQOSPHZ-INIZCTEOSA-N 346.430 5.401 30 20 EKED C[C@H](NCc1ccc(-c2cccc(F)c2)s1)c1cccc(C#N)c1 237573720 FKQSFHXVKYFVHQ-AWEZNQCLSA-N 336.435 5.277 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 358329207 OVOOUKZDLLJECQ-PGRDOPGGSA-N 331.463 5.230 30 20 EKED N#Cc1ccccc1SCc1csc(-c2ccc(Cl)cc2)n1 439694149 OBAOIESNIXKHQG-UHFFFAOYSA-N 342.876 5.627 30 20 EKED CC[C@@H](F)CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 440493815 YDBKTNFBBULBBS-VXGBXAGGSA-N 331.275 5.037 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1Cl 447324798 NTBULDVRRGPCJD-CYBMUJFWSA-N 347.289 5.645 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(Cl)c1C 457748761 MZXQQFKTARFQCG-UHFFFAOYSA-N 328.843 5.148 30 20 EKED C=CCC[C@@H](NCc1ccc(F)cn1)c1ccc(C(F)(F)F)cc1 469769082 NJACJTLAPUKZIX-QGZVFWFLSA-N 338.348 5.037 30 20 EKED CC[C@H](CC#N)NC(=O)Nc1cccc(CSC2CCCCC2)c1 475012874 KNSQREGKLLAMEJ-MRXNPFEDSA-N 345.512 5.066 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(-c2cnco2)c1)c1ccccc1 488662154 OXJSXFIMVZVHMK-IBGZPJMESA-N 332.403 5.030 30 20 EKED C=CC[C@H]1N(C(=O)Nc2c(C)cc(OC)c(C)c2C)CCCC1(C)C 495005092 BGCPVLMVSSSRIR-GOSISDBHSA-N 344.499 5.219 30 20 EKED CCCN(CCC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520599067 BWVQOVOMAFZICH-UHFFFAOYSA-N 337.423 5.004 30 20 EKED C[C@@H](NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccc(C#N)cc1 538553432 FEAXBDJMOONAOO-CQSZACIVSA-N 344.380 5.307 30 20 EKED C=C(CC)CS[C@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 540194491 LWOQVGQSZKMOHJ-LLVKDONJSA-N 346.477 5.417 30 20 EKED CCOc1ccccc1[C@H](CC(C)C)NCc1ccc(CC#N)cc1 542252141 BMMHSNJCWHJLMZ-NRFANRHFSA-N 336.479 5.028 30 20 EKED N#CCCC[C@H](NC/C=C\c1ccc(F)c(F)c1)c1ccccc1 560561516 JJRPXPWXZKICMX-HCZHMGAMSA-N 326.390 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)[C@H]1C1CC1 574799093 LWSYIKVFBCZFDX-LJQANCHMSA-N 326.484 5.191 30 20 EKED CCN(C(=O)CCCCCC#N)C(c1ccccc1)c1ccccc1 588855564 WIBVPDPPHVGTMX-UHFFFAOYSA-N 334.463 5.099 30 20 EKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2sccc2C)ccc1OC 733749665 SNRAZHMQCCSVRI-IQCBXXCUSA-N 330.449 5.139 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1 743057592 UZCQLZJYVGUDKO-LFYBBSHMSA-N 344.414 5.288 30 20 EKED CC(C)[C@H]1/C(=C/c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 766501465 GPUPDSQIHBAGID-DPWKNNTCSA-N 346.455 5.225 30 20 EKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 772161264 GSJFYNZPDQPWGB-HTAPYJJXSA-N 340.426 5.084 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(F)cc1Br)c1ccccc1 773113883 GNSWZUQKWTUROJ-FZKQIMNGSA-N 346.243 5.003 30 20 EKED C=C[C@@H](CC(=O)O[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803064934 VZUIYMRRGQFYOD-KGLIPLIRSA-N 349.352 5.065 30 20 EKED C=CC[C@@H](C(=O)O[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803066367 CTHIXLVMKLDGQI-CZUORRHYSA-N 349.352 5.065 30 20 EKED CCOc1ccc(C=Nc2ccc(Oc3cccnc3)c(C)c2)c(O)c1 920178515 SQMNMWFAHYHGNJ-UHFFFAOYSA-N 348.402 5.037 30 20 EKED CC(=O)/C=C/c1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1 2048529160 LOZYPWWHPSTMCQ-AWNIVKPZSA-N 331.390 5.521 30 20 EKED N#CCCn1cc(-c2csc(-c3ccc(F)cc3)n2)c2ccccc21 7845414 MFBUKMCYHSMESU-UHFFFAOYSA-N 347.418 5.485 30 20 EKED N#Cc1ccc(-c2ccc(OCc3cc(-c4ccco4)on3)cc2)cc1 15551405 VPUKVFKQELEAPT-UHFFFAOYSA-N 342.354 5.052 30 20 EKED Cc1sc(NC(=O)c2sc3ccc(F)cc3c2C)c(C#N)c1C 64680314 DOWIBIXTIXLPCG-UHFFFAOYSA-N 344.436 5.151 30 20 EKED CC(C)(C)c1csc(CNc2ccccc2SCCC#N)n1 121801195 QTCXPFYWTGJZCY-UHFFFAOYSA-N 331.510 5.058 30 20 EKED CC(C)(C#N)c1ccc(Nc2nc(C(F)F)nc3ccccc23)cc1 301215917 YOESSZCZCYPHFL-UHFFFAOYSA-N 338.361 5.112 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)ccc2CC1 329191913 RROKIGFIZNGZLP-IAOVAPTHSA-N 326.440 5.415 30 20 EKED Cc1ccc(OC(F)F)c(CN[C@@H](CCCC#N)c2ccccc2)c1 433014265 DGFMRSHVOOPYBS-SFHVURJKSA-N 344.405 5.121 30 20 EKED C[C@H](SCc1ncc(-c2cccs2)o1)c1cccc(C#N)c1 443156491 VNDVNNMRFFLBBG-LBPRGKRZSA-N 326.446 5.269 30 20 EKED CC[C@H](NCc1ccc(-c2ccco2)cc1F)c1ccc(C#N)cc1 448024419 YHLKYCWDBDGNQE-FQEVSTJZSA-N 334.394 5.198 30 20 EKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccc(C#N)cc3Cl)oc12 494638289 PWBGZZJESVMENB-UHFFFAOYSA-N 338.794 5.135 30 20 EKED C[C@@H](CCCC(F)(F)F)NCc1ccc(F)c(C(F)(F)F)c1 494849887 ZOCNLPWCNLFHCQ-VIFPVBQESA-N 331.275 5.055 30 20 EKED Cc1nc(-c2ccccc2)sc1CNc1ccc(Cl)cc1C#N 511367581 QZEQSUZNODJSCA-UHFFFAOYSA-N 339.851 5.256 30 20 EKED C=CCN(Cc1ccccc1)C(=O)c1ccccc1CCC(F)(F)F 534024043 HLRCEEZNRCSUEB-UHFFFAOYSA-N 347.380 5.010 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H](c2ccccc2)CC1)c1ccccc1 535340024 MAHHRHRGWNNLDI-SIKLNZKXSA-N 333.475 5.143 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(OC(C)(C)C)cc1 551817583 PSNKHNTVQZXICI-MRXNPFEDSA-N 334.463 5.075 30 20 EKED C=C(C)[C@H](NCc1ccc(SC)s1)c1ccc(F)c(F)c1 567431613 SOURTZJWUKLQPH-INIZCTEOSA-N 325.449 5.155 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)sc1Cl 618807393 UHVOCYPIEHRRFQ-OTYXRUKQSA-N 337.275 5.265 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1nc2ccccc2s1 727974520 LVPMSXQKERYTGR-KHPPLWFESA-N 348.452 5.316 30 20 EKED C=CC[C@@H](NCc1ccc(-c2cc(C)cc(C)c2)cc1)c1ccncc1 742370930 BAVKGCDQGJAEBF-XMMPIXPASA-N 342.486 5.772 30 20 EKED O=C(/C=C/c1cc2ccccc2o1)c1ccc(Br)s1 750901554 UHJBEHJJZCKQNH-AATRIKPKSA-N 333.206 5.153 30 20 EKED C#CCCCCC(=O)N(Cc1ccco1)Cc1cc2cc(C)ccc2o1 773400927 LGXIQECEIXLVSK-UHFFFAOYSA-N 349.430 5.057 30 20 EKED C#CCC1(C(=O)N(C)[C@H](C)c2sc(C(C)C)nc2C)CCCCC1 789664161 QEUBVHHRHWCHIL-MRXNPFEDSA-N 346.540 5.068 30 20 EKED CC[C@@H](Cc1ccccc1C)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 820183681 DCTHMDMTVIXPTB-RDJZCZTQSA-N 340.492 5.020 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1F 915087455 UNXJSUAIWKDWPK-FQEVSTJZSA-N 344.389 5.042 30 20 EKED O=C(O)c1ccc(NN=Cc2c3ccccc3cc3ccccc23)cc1 1776011998 MJLNKNUGSFLSOG-UHFFFAOYSA-N 340.382 5.137 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)c1 1776341449 NWCSNMWAZIFQRZ-SREVYHEPSA-N 348.851 5.194 30 20 EKED O=C(/C=C\c1ccc(Br)s1)c1cc2ccccc2o1 96767014 FDZFHCUHQNIXDU-ALCCZGGFSA-N 333.206 5.153 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C 246207059 AEGXNIRHAVQKHB-INMHGKMJSA-N 345.512 5.123 30 20 EKED CC[C@H](C)c1ccc([C@@H](Nc2ccc(C#N)nn2)c2cccs2)cc1 301931042 OORPVSAIARSOKE-VBKZILBWSA-N 348.475 5.125 30 20 EKED OC1=N[C@H](C/C(O)=N/[C@H](c2ccc(Cl)cc2)C2CCC2)CCC1 329319546 GCFWGJFWCFXXKS-YJBOKZPZSA-N 334.847 5.037 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@@H](N[C@@H](CCCC#N)c2ccccc2)C1 340439003 BFBGEINYRUACAC-VSKRKVRLSA-N 347.506 5.441 30 20 EKED C[C@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)c2ccccc12 462471970 FHWRTBGKAZCWSF-HNNXBMFYSA-N 334.850 5.410 30 20 EKED CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1S[C@H](C)CC#N 475773875 NCPWCNBQTNDXIU-OAGGEKHMSA-N 330.497 5.236 30 20 EKED Cc1ccc(C)c(N(C(=O)C[C@H](CC#N)c2ccccc2)C(C)C)c1 483460475 ICLCCMCKIKVBOC-FQEVSTJZSA-N 334.463 5.132 30 20 EKED Cc1ccccc1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C 483565320 TVFPEESRBZJTHC-HXUWFJFHSA-N 349.478 5.315 30 20 EKED Cc1sc(NC(=O)c2sc3cccc(F)c3c2C)c(C#N)c1C 499102786 UDSZGGROLNGJDF-UHFFFAOYSA-N 344.436 5.151 30 20 EKED Cc1sc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)c(C#N)c1C 503132315 CAAGYWRVORNVIR-QZTJIDSGSA-N 346.455 5.132 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(Br)cn1)c1ccccc1 568702102 PWJYYPHPOBORKP-RDTXWAMCSA-N 345.284 5.202 30 20 EKED N#Cc1ccc(SCc2cccc(C(=O)Nc3ccccc3)c2)cc1 603937928 ASGIOEMZQRUOCC-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CC[C@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccccc1 609237152 AUASIUQLYFIWQU-KRWDZBQOSA-N 344.867 5.035 30 20 EKED Cc1nc(NN=C[C@H](C)CCC#N)c2cc(-c3ccccc3)sc2n1 765994386 FIIQLHUPJLJRMQ-CYBMUJFWSA-N 349.463 5.004 30 20 EKED CCc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccn2)s1 25198840 ZOQOTOZEQCRUSB-ZRDIBKRKSA-N 349.455 5.181 30 20 EKED N#CCCSc1ccccc1NCc1csc(C2CCCC2)n1 86207184 XSUDTLKQWKMRCR-UHFFFAOYSA-N 343.521 5.419 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 90665366 GMQPQDZGKCGLHW-RDTXWAMCSA-N 343.268 5.145 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cnn(C(C)(C)C)c1C)c1ccccc1 191386129 YSJYTUGTSCIMFT-JXFKEZNVSA-N 325.500 5.305 30 20 EKED C[C@@H](NCc1ccc(-c2ccc(F)cc2)s1)c1cccc(C#N)c1 237417117 KYDPMGAHFNYVAU-CQSZACIVSA-N 336.435 5.277 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2cc3ccccc3o2)c1 255889245 VMKZBXDZTAYQBE-KHPPLWFESA-N 331.371 5.011 30 20 EKED CCCCCCCC(=O)Nc1ccccc1NC(=O)C[C@@H]1C=CCC1 303282426 IZDJZDCWZXDDMI-QGZVFWFLSA-N 342.483 5.280 30 20 EKED CC[C@@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(C)cc1 303839306 LTANKAXGMVGBKE-KRWDZBQOSA-N 334.463 5.319 30 20 EKED CCCOc1ccccc1[C@H](CC(C)C)NCc1ccc(C#N)cc1 467771366 MULVQDWMFPXFHU-NRFANRHFSA-N 336.479 5.224 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cccc(C)c2o1 476106237 DOXCYBKVKYIBQO-UHFFFAOYSA-N 333.431 5.845 30 20 EKED CC(C)c1ccc([C@H]2CCCN2CCCC2(C#N)CCOCC2)cc1 499581958 JOWRIZKGENCOCF-OAQYLSRUSA-N 340.511 5.047 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 512530180 YLDJWYXILMWTRH-MRXNPFEDSA-N 349.434 5.147 30 20 EKED C=C[C@@H](CC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccccc1 534982961 XNODCQQWERVNKN-CVEARBPZSA-N 337.467 5.030 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1cccc(C#N)c1F 537047582 YFNMDSVXLYIXCB-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CC(C)(CCC#N)CNCC(Cc1ccccc1)Cc1ccccc1 600875990 DBVAEVMQVQCISE-UHFFFAOYSA-N 334.507 5.008 30 20 EKED C=CCCCCCN(C)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 606816648 HWAAGLPEQBXWMR-SJORKVTESA-N 339.401 5.014 30 20 EKED CCSc1ccccc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619754475 AIJHHQFJUYJSKD-CYBMUJFWSA-N 330.884 5.174 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1c[nH]nc1C)c1ccc(C(F)(F)F)cc1 679357089 VMRPKACUUPSAOV-YVEFUNNKSA-N 337.389 5.095 30 20 EKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(Cl)cc1 730092635 NLWNOPAUHQSMTH-FQEVSTJZSA-N 346.817 5.002 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(Cl)cc2)o1)c1cncc(F)c1 737445074 VTKMGGIELBSBIS-ALCCZGGFSA-N 327.742 5.030 30 20 EKED C=CCC[C@@H](NCc1cc(=O)oc2cc(C)c(C)cc12)c1ccccc1 775465327 WUJHWRZIGJRMHE-OAQYLSRUSA-N 347.458 5.207 30 20 EKED O=C(/C=C/c1sccc1Cl)c1ccc(-c2ccncc2)cc1 782341440 JTSWRFOTHXSGDS-AATRIKPKSA-N 325.820 5.360 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(-c2c(F)cccc2F)cc1 811699195 YHYFCKSHSHNELQ-KHPPLWFESA-N 339.341 5.133 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(SC(F)F)cc1 915300232 JWBKMOYVMKNSQZ-UHFFFAOYSA-N 348.418 5.221 30 20 EKED Cc1ccsc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777477288 WPQXXNUFURFXGO-WCIBSUBMSA-N 348.423 5.318 30 20 EKED Cc1ccc(OC(F)F)c([C@@H](C)N[C@H](CCC#N)c2ccccc2)c1 90664540 MKYBJKMHNGMKAS-CRAIPNDOSA-N 344.405 5.292 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1occc1CSc1ccccc1 178631226 HRBRETXCDZHJAH-UHFFFAOYSA-N 348.427 5.004 30 20 EKED C[C@H](CCCC(F)(F)F)NC1CCC(C#N)(c2ccccc2)CC1 426054127 FWBMELPLYUFKLA-FAEJEUNOSA-N 338.417 5.101 30 20 EKED C[C@H](C(=O)N(CC1CCC1)[C@H](C)c1ccccc1)c1cccc(C#N)c1 462152227 ARMUCCJGCRFXTC-ZWKOTPCHSA-N 346.474 5.052 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCC2)cc1 476120257 KESJRLFRSQXVRS-UHFFFAOYSA-N 349.474 5.722 30 20 EKED C=CCOc1cccc(NC(=O)N(C)Cc2ccc3ccccc3c2)c1 510999990 HRZSYDAMKBSVAR-UHFFFAOYSA-N 346.430 5.069 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)SCc2ccc(CC#N)cc2)n1 543149816 JKEWIEKDOZLMTO-OAHLLOKOSA-N 349.459 5.106 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCCC2 550829463 HUHVRJKXMQZLKZ-APWZRJJASA-N 338.520 5.713 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2s1 553294864 STKNXKALFFMABD-LIRRHRJNSA-N 332.472 5.501 30 20 EKED C[C@@H](CCC#N)Sc1ncnc2sc(-c3ccccc3)cc12 559965532 ZUGQNLDADRJSDM-LBPRGKRZSA-N 325.462 5.143 30 20 EKED COCc1cccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c1 742434312 GZCCKBVWVJAAIB-BJMVGYQFSA-N 334.387 5.044 30 20 EKED N#C[C@@H](C(=O)c1cc(Cl)cs1)c1nc(-c2ccccc2)cs1 759436897 NHBCBYGCSIZNEH-LBPRGKRZSA-N 344.848 5.015 30 20 EKED C=CC[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccncc1 780528451 XGDKDSVWRRJJTF-INIZCTEOSA-N 340.776 5.161 30 20 EKED C=CCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCC1 791772290 AUEDGCVNYBVQGH-INIZCTEOSA-N 336.460 5.041 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(C(C)C)c1 794994322 GHQSJBLIJYFLRN-UHFFFAOYSA-N 338.520 5.585 30 20 EKED C[C@@H](C#N)Oc1ccccc1NC[C@H](C)c1ccc(C(F)(F)F)cc1 809636601 CPORABCZYYEQQJ-KBPBESRZSA-N 348.368 5.212 30 20 EKED O=C(/C=C/c1c(Cl)nc(Cl)n1-c1ccccc1)c1cccs1 920063061 WXEBTOUTHYICLG-CMDGGOBGSA-N 349.242 5.137 30 20 EKED C[C@@H](OC(=O)C1(C#N)CCCCC1)c1ccc(Cl)c(Cl)c1 920159063 QMJVGCCNPKMDPT-LLVKDONJSA-N 326.223 5.072 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3cccs3)cc2)cc1 921010050 DZBXKHHUICMTON-VAWYXSNFSA-N 346.411 5.064 30 20 EKED C[C@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932567024 JURSJAYGAPGDKV-LAUBAEHRSA-N 347.462 5.148 30 20 EKED CCCCCCCOc1cccc(CNCCCC(C)(C)C(=O)O)c1 1776788667 JRMZMJXPDWCOHU-UHFFFAOYSA-N 349.515 5.016 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/[C@@H](CC2CCCC2)c2ccccc2)CC(O)=N1 329749305 HIHVQUFCWBIPTF-OTWHNJEPSA-N 342.483 5.410 30 20 EKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426136433 AQHXCPPALOENLK-LLVKDONJSA-N 348.233 5.090 30 20 EKED N#CCCCOc1cccc(NCc2ccc(C(F)(F)F)s2)c1 428870767 YWOXZNRZGKCCDG-UHFFFAOYSA-N 340.370 5.062 30 20 EKED CC[C@@H](C(=O)Nc1cccc(C#N)c1C)c1cccc(C(F)(F)F)c1 432340728 OQSFGIVPWSSLDW-MRXNPFEDSA-N 346.352 5.018 30 20 EKED C[C@H](NC1CCC(C)(C#N)CC1)c1ccc(-c2cccc(C#N)c2)cc1 449231075 CHBOPRMGMSDQJI-YTZBPGPESA-N 343.474 5.348 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC2(CCCCC2)C1 460639845 IYMYPVYJQQMNNJ-UHFFFAOYSA-N 344.458 5.022 30 20 EKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CC(C)(C)C#N 497067507 VPULLKSVQCNWED-MRXNPFEDSA-N 336.435 5.013 30 20 EKED Cc1cccc([C@@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 523509703 QWRWZOZVCGINSN-OAHLLOKOSA-N 346.455 5.337 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C)c(C)o1 531766787 AIGGLCKCCKNIAB-UHFFFAOYSA-N 346.386 5.121 30 20 EKED C[C@@H](NCCCC#N)c1ccc(-c2ccc(Br)cc2)s1 544385318 KGABBAAODDWJSM-GFCCVEGCSA-N 349.297 5.132 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(Oc2nc(C)cs2)c(F)c1 548714244 OBBMNOUKBRZVSB-UHFFFAOYSA-N 346.427 5.090 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccc3cnccc3c2)cc1 618728668 VZRYJKUWZUPSTO-UHFFFAOYSA-N 349.437 5.063 30 20 EKED CC[C@@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 738415477 DYVOOTNVZMEOFW-DHIUTWEWSA-N 344.433 6.044 30 20 EKED C[C@H](CCC(F)(F)F)NCc1cccc(-c2ccc(C#N)s2)c1 753566546 ROJFNJAERZDHFN-GFCCVEGCSA-N 338.398 5.107 30 20 EKED Cc1ccc(C)c2c1CC/C(=C\c1cnc(-c3ccncc3)s1)C2=O 769746945 SYFAMODOBKCMAF-LFIBNONCSA-N 346.455 5.034 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(C(F)(F)F)cc1 782331734 XLMSDLDZZLPHGV-KRXBUXKQSA-N 327.305 5.150 30 20 EKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C\c1scnc1C1CC1)CCO2 782349505 ZAFSVSVJNPKYGV-WQLSENKSSA-N 345.851 5.031 30 20 EKED Clc1ccc(C=NOCc2cc(-c3ccc(Cl)cc3)no2)cc1 913029534 WLMKHBLNDYHLMR-UHFFFAOYSA-N 347.201 5.199 30 20 EKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(C)s3)cs2)c1 917045319 XUMOBNYQOVFHRH-BQYQJAHWSA-N 341.457 5.085 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](CC)c1ccccc1 60459738 UOOFYGXFWZHPEK-INIZCTEOSA-N 333.884 5.110 30 20 EKED CCC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 90664435 KBGLZDLJWOCPDN-UXHICEINSA-N 337.423 5.071 30 20 EKED N#Cc1csc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 177690189 LRXGQDAJLMWAAN-KRWDZBQOSA-N 344.892 5.214 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cccc(F)c1F 182722440 XOGURXYFSQDJAY-SNAWJCMRSA-N 333.384 5.046 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1c(CC)cccc1CC 192573015 GNKMBLSZZNLXFX-UHFFFAOYSA-N 328.481 5.093 30 20 EKED C[C@@H](N[C@H](C)c1nccs1)c1ccc(-c2cccc(C#N)c2)cc1 367805495 XFBYVZFXGNXIIH-HUUCEWRRSA-N 333.460 5.094 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2c1O[C@@H](C)C2 451328736 IRCDHCTXXXYZLK-HNNXBMFYSA-N 335.447 5.114 30 20 EKED Cc1ccc2c(C(=O)Nc3sc(C)c(C)c3C#N)csc2c1 483071576 QGJWPJZTUWJFDF-UHFFFAOYSA-N 326.446 5.012 30 20 EKED CC[C@H](c1ccccc1)N(CC(C)C)C(=O)CCc1ccc(C#N)cc1 518922547 VYDMTFSOFZGKDE-JOCHJYFZSA-N 348.490 5.127 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](OC)c1ccc(F)cc1 529137680 RPBPUPSTGIJRQX-HXUWFJFHSA-N 341.426 5.004 30 20 EKED Cc1ccccc1-c1cnc(CS[C@H](C)c2ccc(C#N)cc2)o1 534527759 VDXFDSUOBUUGFH-OAHLLOKOSA-N 334.444 5.516 30 20 EKED Cc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 540313314 GSMHKSDFKCNXFR-MRXNPFEDSA-N 332.472 5.446 30 20 EKED C=CCC(C)(C)C(=O)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1 551093342 KVYYOCXKPNHSJV-INIZCTEOSA-N 337.463 5.142 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccccc1Cl 609387306 WPPKSTNJACGOHC-KGLIPLIRSA-N 330.884 5.765 30 20 EKED C[C@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1cccc(C#N)c1 611166829 AEIJOGHAOHPFNF-APPDUMDISA-N 331.246 5.203 30 20 EKED O=C(/C=C/c1cc(F)c(F)c(F)c1)c1cc(Cl)sc1Cl 727975230 VEFULSXFRDUJQV-OWOJBTEDSA-N 337.149 5.368 30 20 EKED Cc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc(C)c1O 744869290 VWLPDDBLINBIBX-ARJAWSKDSA-N 327.232 5.273 30 20 EKED CCOc1cccc(C=Nc2ccc(CCC(F)(F)F)cc2)c1O 753139577 WBMMXRVORATUPN-UHFFFAOYSA-N 337.341 5.036 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](CC2CCC2)c2ccccc2)c1 776165065 NVCGIJBALRLOKZ-GGAORHGYSA-N 348.490 5.389 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)CCC2 776168229 ACNOLEMOVYQWFQ-HXOBKFHXSA-N 348.490 5.441 30 20 EKED C[C@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(OCC#N)cc1 777143644 LDYRVTVUTOBLPJ-INIZCTEOSA-N 338.451 5.077 30 20 EKED CCCCCCCCC[C@@H](C)CCN1C[C@@H](C(=O)O)[C@H](C2CC2)C1 1776785329 WMZSULDVDLSBPJ-YZGWKJHDSA-N 337.548 5.196 30 20 EKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccccc3)s2)c1 1777686208 XDUZMLBUJNOVSF-PKNBQFBNSA-N 334.396 5.009 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(CC)cc1 189880930 KWHVEQSIJKMTTR-UHFFFAOYSA-N 337.463 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(F)cc1 191436793 UVGKMUJBEJYLGD-UHFFFAOYSA-N 340.442 5.342 30 20 EKED C=CCC[C@@H](NCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 342228562 TUZCDFCMNDKKHN-MRXNPFEDSA-N 340.414 5.267 30 20 EKED C[C@H](NC1CC(F)(F)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 429455088 OYMKRVLCLQKITQ-ZETCQYMHSA-N 347.249 5.173 30 20 EKED CCN(CC1CCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 431974675 SKCUOJOHQLMKAE-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 436464732 QVRUFLJDOOJWCQ-LJQANCHMSA-N 349.902 5.157 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N[C@@H]2CCC[C@@H](C#N)C2)cc1 447525976 AJOKCUYDCVBXDY-SQGPQFPESA-N 334.463 5.095 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2cccnc12 464471127 LUTHBSZCCHKWKU-UHFFFAOYSA-N 330.431 5.339 30 20 EKED N#CC[C@H](CC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 474425049 ICCYYYONIWTMJQ-HXUWFJFHSA-N 340.426 5.380 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3c(s2)CCCCC3)n1 474433931 KTGMNGVWMHZOGB-CYBMUJFWSA-N 344.505 5.087 30 20 EKED C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 538502923 QEYXPTGVKONCRZ-MRXNPFEDSA-N 330.406 5.138 30 20 EKED C[C@@H](NC(=O)CCCCC#N)c1ccccc1-c1ccc(Cl)cc1 593981981 AGUDUWYBSPEQCN-OAHLLOKOSA-N 340.854 5.268 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cccc2ccccc12 609431807 UGRDGDBNGXNGJK-MRXNPFEDSA-N 332.472 5.846 30 20 EKED COc1ccc(-c2cc(CSCCCCC(C)(C)C#N)on2)cc1 618108916 MTXUMZVEQHCJPB-UHFFFAOYSA-N 344.480 5.303 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccsc1 670017925 YBVKWRFYHGCFAR-CQSZACIVSA-N 328.481 5.483 30 20 EKED N#CCOc1ccc(CSCc2c(Cl)cccc2Cl)cc1 731158265 AGUAMQYIOCCEKN-UHFFFAOYSA-N 338.259 5.329 30 20 EKED Cc1ccc(-c2ncc(/C=C3\CCc4cc(O)ccc4C3=O)s2)cc1 734304273 GPDOEDWWWMYCHL-LFIBNONCSA-N 347.439 5.037 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 768388064 DTUMNRWLXUHTOU-ZWKOTPCHSA-N 337.463 5.084 30 20 EKED C=C(C)[C@H](NC(=S)Nc1ccccc1CC)c1ccc(F)c(F)c1 774205575 LCOPAMPJKBFCGS-SFHVURJKSA-N 346.446 5.131 30 20 EKED O=C(/C=C/c1cc(F)ncc1F)c1ccc(Cl)c(Cl)c1Cl 806565203 JWPLASQIBMEARF-DAFODLJHSA-N 348.563 5.216 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(OCC#N)cc1 806664102 ZWCCRMNUTOAVGZ-HZPDHXFCSA-N 348.421 5.293 30 20 EKED CC(C)(C)c1csc(NC(=O)c2cscc2C(F)F)c1C#N 891143992 BOLZCNHOBDPOEZ-UHFFFAOYSA-N 340.420 5.169 30 20 EKED COc1ccccc1[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1 181942854 CWYQARTYCUJUNK-UZUQRXQVSA-N 342.442 5.007 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2ccc(C#N)cc2)n1 303715530 QSIUDVOQCJVSSM-LLVKDONJSA-N 347.365 5.005 30 20 EKED CC1(C)CCC(CC(=O)N[C@H](CCCC#N)c2ccccc2)CC1 352198379 LGNVRIMJKIDQIV-LJQANCHMSA-N 326.484 5.144 30 20 EKED CC[C@@H](N[C@@H](CCCCOC)c1ccccc1)c1ccc(C#N)cc1 359018369 MRPUJKVLTQXBBO-YADHBBJMSA-N 336.479 5.157 30 20 EKED CCN(Cc1ccc2nc(C)sc2c1)[C@H](C)c1ccc(C#N)cc1 426028466 LTACWHDKLNTTPT-CQSZACIVSA-N 335.476 5.060 30 20 EKED Cc1ccc(-c2cnc(CN[C@@H](CCCC#N)c3ccccc3)o2)cc1 433032889 NMNJOFMNAIYOOW-FQEVSTJZSA-N 345.446 5.175 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(Cl)c1 464974561 RPHFQXCXJHFOEW-NSHDSACASA-N 348.830 5.126 30 20 EKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cccc2ccccc12 474206953 QIWODGKAGBRMEK-MRXNPFEDSA-N 342.442 5.132 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnn1C(CC)CC 476124749 XFFFPMVQJBYLNU-UHFFFAOYSA-N 339.483 5.348 30 20 EKED C=CCCCC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1 479832725 VBTDGJDWTIZRLN-KRWDZBQOSA-N 337.463 5.238 30 20 EKED C=CCCCC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 480868705 WSDPFYHCLOGQIS-UHFFFAOYSA-N 340.423 5.397 30 20 EKED C[C@@H](CCCC(F)(F)F)NCc1cc(F)cc(C(F)(F)F)c1 494840977 WZELXDNUYLTSCQ-VIFPVBQESA-N 331.275 5.055 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 524567222 KDESFBAFBRQVKC-LEWJYISDSA-N 347.483 5.220 30 20 EKED Cc1sc(NC(=O)[C@@H](CC(C)C)c2ccccc2)c(C#N)c1C 524818397 TUFWFMBINLOOSN-INIZCTEOSA-N 326.465 5.005 30 20 EKED CC1CC(C#N)(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)C1 531808672 WYVIXHLIQKKIAL-UHFFFAOYSA-N 340.810 5.011 30 20 EKED C[C@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)c(F)c1 539607227 DIZXJSUWPLDNMR-DYZYQPBXSA-N 349.236 5.342 30 20 EKED Cc1cc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)c(C)s1 571575380 GNHPBXIYHFSJGF-NSHDSACASA-N 338.398 5.106 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cc3ccccc3s2)cc1 588535135 LFZDMNBMPYGLBD-MSKHEQNASA-N 333.412 5.088 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCCc2sc(Cl)cc21 589949254 BVBAQMNAVPWLKH-IAGOWNOFSA-N 342.895 5.318 30 20 EKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccccc1CC 606758241 VWHCVESUZLPVJH-UHFFFAOYSA-N 349.352 5.085 30 20 EKED CC[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(Cl)cc1 609669048 GJIXAHZJIFCOKH-ZDUSSCGKSA-N 339.748 5.189 30 20 EKED CC[C@@H]1CCCCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610051655 QMTUHWKOTVOQOR-LJQANCHMSA-N 348.446 5.145 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1Cl 619755366 FYPIFBJHRJUYRB-SFHVURJKSA-N 331.246 5.032 30 20 EKED C=CC[C@H]1CCN(C(=O)Nc2cccc(COC(C)(C)CC)c2C)C1 626424717 TYWCDZMLMWVTMR-KRWDZBQOSA-N 344.499 5.130 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccccc2Cl)c1 727282623 CMTYUBFWNGULLR-UHFFFAOYSA-N 332.856 5.104 30 20 EKED COc1ccc(C)cc1C(=O)/C=C\c1csc(-c2cccs2)n1 728440545 YMZWVWATAFOBPD-SREVYHEPSA-N 341.457 5.085 30 20 EKED CC(=NNc1ccccc1F)c1csc(-c2csc(C)n2)c1 729143274 LSXQNRNVODXEJF-UHFFFAOYSA-N 331.441 5.155 30 20 EKED CCCCCCCCCN(C)C(=S)N[C@H]1CCOc2ccccc21 741487523 GJVHZVGPZQDOGO-SFHVURJKSA-N 348.556 5.067 30 20 EKED CCCCCCCC(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 744722690 OZDAWICQZXDICO-LLVKDONJSA-N 336.423 5.090 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1ccc(N2CCCCC2)cc1 772798264 UGEVNJWPRBGCER-JLHYYAGUSA-N 342.442 5.121 30 20 EKED CC1(C)C/C(=C\c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 794970216 WZKFONKYELWWCG-RVDMUPIBSA-N 346.455 5.153 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCC(C)(C)c3ccccc32)c1 795804455 WEJPXOGRNZXDGL-GCJKJVERSA-N 348.490 5.270 30 20 EKED CCC[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797570780 KKIVYXSMSVQREY-HOTGVXAUSA-N 340.492 5.201 30 20 EKED CC(=NNc1ccccc1C(=O)O)[C@H](C)c1ccc(CC(C)C)cc1 1776031089 LWDLHQWADUANIT-HNNXBMFYSA-N 338.451 5.175 30 20 EKED N#Cc1ccc(NC(=O)c2ccc(CSc3ccccc3)cc2)cc1 23680368 KRWXTJNKNLPZHP-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CCC(CC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443724 YHRIJTZNEYDRHP-CQSZACIVSA-N 332.856 5.076 30 20 EKED C=CCCC(=O)Nc1nc(-c2cc(Cl)ccc2Cl)cs1 60364767 RVJJRSISOIMDOT-UHFFFAOYSA-N 327.236 5.022 30 20 EKED CC(C)c1nccn1Cc1cccc(N[C@H](C)c2ccc(C#N)cc2)c1 179926143 PKCUTRQFOSKTGC-QGZVFWFLSA-N 344.462 5.100 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CSc2ccccc21 189871308 GWXCMZBWTPNKGC-SFHVURJKSA-N 337.488 5.367 30 20 EKED C[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 237566017 LJQFRSHOHWGFBU-AWEZNQCLSA-N 336.822 5.322 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(C)ccc1OC 340449174 LDOGILNZKIDBQL-SFTDATJTSA-N 336.479 5.480 30 20 EKED N#CCCC[C@H](NCc1ncc(-c2ccccc2)s1)c1ccccc1 353913206 HPCYCYJKQFLMMN-IBGZPJMESA-N 347.487 5.335 30 20 EKED C[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 429760970 AAEDZOCVJMUKAQ-CRAIPNDOSA-N 349.434 5.003 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2ccccc2OCc2cccc(Cl)c2)C1 442857958 HDOPMOMWGHPSNC-RHSMWYFYSA-N 326.827 5.023 30 20 EKED C=CCCN(C)C(=O)N[C@@H](c1ccc(C(C)C)cc1)c1cccs1 466979964 CTXVHYVGOKDYDN-IBGZPJMESA-N 342.508 5.178 30 20 EKED CC(C)c1occc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 479801925 HXKLYKBVRFWZOM-UHFFFAOYSA-N 346.386 5.319 30 20 EKED CC1(C)CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 497503494 VXQHPPZNIXWYRE-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=C(C)CCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510759805 BLSOTVUAPXHVDZ-ZDUSSCGKSA-N 325.296 5.255 30 20 EKED CCOc1ccc(C(C)=O)cc1CS[C@@H](C)c1ccc(C#N)cc1 522840365 HJIOFZICYRUKMC-HNNXBMFYSA-N 339.460 5.154 30 20 EKED CC[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 523703157 IVBFBQDTXOFDME-MRXNPFEDSA-N 348.899 5.325 30 20 EKED COc1cccc(-c2ccc(CN[C@@H](C)c3cccc(C#N)c3)cc2)c1 537293779 GBIZKNUUKXGWJU-KRWDZBQOSA-N 342.442 5.085 30 20 EKED N#CCCCCN[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 539970506 VLHKACQGIFEFMQ-FUHWJXTLSA-N 338.417 5.405 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCCCC(C)(C)C#N 542523473 XBCRPSGFSGUXJQ-SFHVURJKSA-N 326.509 5.260 30 20 EKED CC(C)(CCC#N)CN(Cc1cccs1)C1Cc2ccccc2C1 560267011 SLAYBKINJKGHEI-UHFFFAOYSA-N 338.520 5.047 30 20 EKED CCCCCCCCCN(C)C(=O)c1cnc(-c2ccccn2)s1 727666905 ALUZEKLLDWIIIJ-UHFFFAOYSA-N 345.512 5.028 30 20 EKED Cc1cccc(C(=O)/C=C\c2csc(-c3cccs3)n2)c1C 734305124 IZXWYQJYJBLDCC-HJWRWDBZSA-N 325.458 5.385 30 20 EKED CC(C)C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 741110485 DLXLWYYBMAJJMX-DLBZAZTESA-N 348.471 5.302 30 20 EKED CO[C@@H](C/N=C/c1c(O)ccc2ccccc12)c1ccc(Cl)cc1 741755257 AKKYBWAIMLDRPH-CNSRZQHFSA-N 339.822 5.005 30 20 EKED N#Cc1ccccc1-c1ccc(COC(=O)CCCC(F)(F)F)cc1 771132409 RRNQILQIAAHIGS-UHFFFAOYSA-N 347.336 5.001 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(OC)c2ccccc12)c1ccccc1 773114813 KCADLMYQHPLIHD-HTAPYJJXSA-N 329.443 5.264 30 20 EKED CC(=NNc1ccc(C#N)cc1C(F)(F)F)C1CCC(F)(F)CC1 799491392 CXLWIZYWGJUUNG-UHFFFAOYSA-N 345.315 5.190 30 20 EKED C=CC[C@H](NC[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 809621196 WVWFUDCPSWIMEZ-KDOFPFPSSA-N 334.385 5.111 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccccc1C#N 811690355 BHSGYVKRLNOOLX-SEBJLUHNSA-N 339.341 5.002 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccccc2-c2ccccc2)c1 917517114 ITZNNGDXYVPLRO-CCEZHUSRSA-N 341.410 5.208 30 20 EKED O=C(/C=C\c1ccnc2ccccc12)c1ccc(Cl)c(Cl)c1 27553213 QOOUKPFYIIBAAD-VURMDHGXSA-N 328.198 5.438 30 20 EKED N#C[C@H](C(=O)C1CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 46443495 JVUUMVYJFZIOGH-OAHLLOKOSA-N 344.867 5.220 30 20 EKED CCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 58989286 OCORCUSQTAGRPV-QGZVFWFLSA-N 326.827 5.124 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 90666015 OMRHZGZUDAXABV-GUYCJALGSA-N 348.368 5.123 30 20 EKED COc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1Cl 112532364 YEUAQSXYGFYTGA-CQSZACIVSA-N 344.842 5.204 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C/c1cccc(F)c1 189912357 QABBOYCKMVZONM-UXBLZVDNSA-N 337.438 5.720 30 20 EKED N#Cc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)cc1 237843781 XQNUNGDTUUNSGD-HSZRJFAPSA-N 326.443 5.022 30 20 EKED CC[C@@H]1C[C@@H](/C(O)=N/C2(Cc3ccccc3)CCCCC2)CC(O)=N1 329819134 XQKNTDPFUBTPAH-QZTJIDSGSA-N 342.483 5.034 30 20 EKED N#CC[C@H](CC(=O)N[C@@H](CC1CCC1)c1ccccc1)c1ccccc1 356650083 HPWJIMDUYBXYCL-YADHBBJMSA-N 346.474 5.122 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cccc(C3CCC3)c2)s1 467231360 SGSVRVRXHBYDLW-MRXNPFEDSA-N 338.476 5.198 30 20 EKED CC(C)(C#N)c1ccc(C(=O)N2CCCC3(CCCCC3)CC2)cc1 476942698 SFJIDHFYOFOVDW-UHFFFAOYSA-N 338.495 5.064 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CCCc2ccccc21 497488596 BMLGUTMDNVGLHF-KRWDZBQOSA-N 345.895 5.036 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3cccc(Cl)c3)s2)CC1 507694701 MUMPIGWIMLVVBL-UHFFFAOYSA-N 330.884 5.194 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 515384847 KVJVPCHWPJDDIP-UHFFFAOYSA-N 349.459 5.169 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(CC#N)CC2)c(C)c1 543830099 RLDVTRWUUBLSGR-OAHLLOKOSA-N 345.512 5.043 30 20 EKED C=CCCO[C@@H](C)c1nc(-c2ccc(C)cc2OC2CCCC2)no1 545759049 YRMKZIYGLCSKMM-HNNXBMFYSA-N 342.439 5.020 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 559860055 PTOLLAUCTQYFHJ-BEFAXECRSA-N 346.396 5.791 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 559860056 PTOLLAUCTQYFHJ-DNVCBOLYSA-N 346.396 5.791 30 20 EKED Cc1ccc(F)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 609427226 XCOLAAMTZRQPCE-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=C(C)[C@H]1CC=C(C)C(=NNc2ncnc3sc(C)c(C)c23)C1 725789086 ZRQHILDIZZZBIB-AWEZNQCLSA-N 326.469 5.008 30 20 EKED CCc1oc2ccccc2c1C=NOCc1ncc(-c2ccccc2)o1 727490830 SLLJXXSJYZIUSJ-UHFFFAOYSA-N 346.386 5.201 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)/N=C/c1ccccc1O 729150141 UBECOUHYVMIZCH-KIHMUJGBSA-N 340.423 5.143 30 20 EKED O=C(/C=C\c1cnn2ccccc12)c1ccc(-c2ccccc2F)s1 729644496 WGHRPVMWDXTZLI-HJWRWDBZSA-N 348.402 5.098 30 20 EKED N#CCOc1cccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)c1 730150174 PHPXOJAVRGCDHM-WDZFZDKYSA-N 345.423 5.214 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1cc2ccccc2c(Cl)n1 732644208 NXWRISAJRZVTIV-UHFFFAOYSA-N 342.870 5.097 30 20 EKED Cc1ccc(-c2ncc(/C=C3/CCOc4ccccc4C3=O)s2)cc1 734304384 IFGUSJRYBWUDAQ-VBKFSLOCSA-N 347.439 5.167 30 20 EKED CCCCCCCCC(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1 742957849 AMBQBTASKCUCFH-IFMALSPDSA-N 345.527 5.330 30 20 EKED CC(=NNc1cccc(F)c1F)c1csc(-c2csc(C)n2)c1 743443542 YVJVOGSICYAVEX-UHFFFAOYSA-N 349.431 5.294 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(CC#N)cc1 758968386 WYQLORVNBCSRMH-UHFFFAOYSA-N 338.476 5.204 30 20 EKED N#Cc1cc(NCc2cnc(Cl)s2)ccc1Oc1ccccc1 777616367 GCLDIHOAYGWRGJ-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CC(C)(C#N)CC(=O)O[C@H](c1cccc(F)c1)c1cccc(Cl)c1 786456476 ZLEGMVIVZNJMLZ-SFHVURJKSA-N 345.801 5.052 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1ccc(C#N)o1 794279328 QMQLNCRYARJERR-UHFFFAOYSA-N 336.778 5.032 30 20 EKED CCCCCCC[C@@H](C)CNC(=O)Nc1cccc(NC(C)=O)c1C 918031001 MNSZWEKBWNQKEY-OAHLLOKOSA-N 347.503 5.072 30 20 EKED CCCCCCCOc1ccc(CNC(C)(C)C[C@H](C)C(=O)O)cc1 1776787837 AKPUWQUEAXZXNY-KRWDZBQOSA-N 349.515 5.015 30 20 EKED CCc1ccc(-c2ccc(/C=C\C(=O)c3cccc(C(=O)O)c3)o2)cc1 1776964168 OJKQMLQLUJSYBR-BENRWUELSA-N 346.382 5.103 30 20 EKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccccc3)s2)c1 1777686207 XDUZMLBUJNOVSF-LUAWRHEFSA-N 334.396 5.009 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3)o2)cn1 58465458 QHGHXODGPVBZLC-VQHVLOKHSA-N 340.810 5.274 30 20 EKED CCC(CC)CN(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955719 PFTFTPMGCYALOQ-HNNXBMFYSA-N 347.528 5.371 30 20 EKED N#CCCCOc1cccc(NCc2csc(C3CCCC3)n2)c1 86201807 WCPYSLOJBNHLKN-UHFFFAOYSA-N 341.480 5.095 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 177764696 JECWQHKVXNATNN-ZBFHGGJFSA-N 326.465 5.027 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(OC3CCCC3)c2)cc1 303349459 DUKPMGCEROQAQL-UHFFFAOYSA-N 348.446 5.061 30 20 EKED N=C(O)[C@H]1CCC[C@@H](C(O)=Nc2ncc(C3CCCCC3)s2)C1 329971552 XSFQDAGUYHOMLD-QWHCGFSZSA-N 335.473 5.120 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1nccc2ccccc12 340429714 CYITULBYJAWFLQ-LAUBAEHRSA-N 329.447 5.321 30 20 EKED Cc1cc(C(=O)N(CCC#N)CCC(C)C)c(C)n1C1CCCCC1 349386821 PQUJCQNWDKOQHV-UHFFFAOYSA-N 343.515 5.012 30 20 EKED C[C@H](C#N)CSc1ccccc1NC[C@H]1CCC2(CCCCC2)O1 466847466 SMVSAHKULRURRR-IAGOWNOFSA-N 344.524 5.232 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC)CC1 475568578 NYLRTFDGEKZZNN-KRWDZBQOSA-N 328.500 5.583 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CC)c1CC 487607340 QWRXTADYVSMBRL-UHFFFAOYSA-N 349.478 5.127 30 20 EKED CC(C)CN(C(=O)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1 499318604 IHTVWSDLNFNDIW-UHFFFAOYSA-N 347.245 5.168 30 20 EKED CC(C)COc1cccc(CNc2cccc(OCCCC#N)c2)c1 510831558 UCBBFOFLJNVIEY-UHFFFAOYSA-N 338.451 5.016 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1F 512631795 SWQDSMJJRUECER-INIZCTEOSA-N 330.406 5.215 30 20 EKED C[C@@H](c1noc(-c2cn(CCCC#N)c3ccccc23)n1)C(C)(C)C 519565565 GHMJNOSSWBPFLZ-AWEZNQCLSA-N 336.439 5.145 30 20 EKED COc1ccc(C)cc1CNc1ccccc1S[C@@H](C)CC#N 531391287 KIMAPXYOQQQHAF-HNNXBMFYSA-N 326.465 5.010 30 20 EKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(CCC#N)CC1 592135569 LJFMAHMPMSPOAS-CQSZACIVSA-N 343.858 5.072 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610317131 NCUKAUWKMQUECC-INIZCTEOSA-N 349.478 5.688 30 20 EKED N#Cc1cnccc1SC(c1ccc(F)cc1)c1ccc(F)cc1 614116456 UWAYHKSOSPLOSA-UHFFFAOYSA-N 338.382 5.113 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCCC2)cc1)c1nc(C2CC2)cs1 647379790 NRMJWXBJBSFHKV-QGZVFWFLSA-N 336.460 5.168 30 20 EKED CN(CCC#N)c1ccc(CN[C@H](CC(C)(C)C)c2ccccc2)cc1 731449676 YUAZKBHFBJQTJG-JOCHJYFZSA-N 349.522 5.304 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1cccc(OC(F)F)c1 742436952 PATXCCSVSOKOKL-ITTMYVLYSA-N 338.400 5.110 30 20 EKED C=C[C@@H](CC(=O)O[C@@H](c1ccccc1)c1cccnc1)c1ccccc1 759315106 NHQVXKZPZWXIBW-MBSDFSHPSA-N 343.426 5.074 30 20 EKED C#CC[C@H](NCc1csc(Nc2ccc(C)cc2)n1)c1ccccc1 775400076 HSMIHJGIFKLYLJ-FQEVSTJZSA-N 347.487 5.049 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cccc(C3CC3)c2)c1 815593763 WHUZYTMBHYJNFS-IIBYNOLFSA-N 334.463 5.096 30 20 EKED Cc1ccccc1NC(=O)c1ccccc1Sc1ccccc1C#N 16029242 BIIYQJZMSODKJS-UHFFFAOYSA-N 344.439 5.270 30 20 EKED N#Cc1ccccc1CSc1nnc(-c2cccc3ccccc23)o1 126892915 ZPWAHTHRCVJZNA-UHFFFAOYSA-N 343.411 5.054 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)s1 176957884 URPCKDBGYKKCBG-LJQANCHMSA-N 338.863 5.152 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1OCC 189889793 GOEGEBFPRZKLKJ-UHFFFAOYSA-N 341.426 5.329 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(OCC#N)cc1 193002340 UPCBFZVKQNRZTM-KBPBESRZSA-N 348.368 5.020 30 20 EKED CC/C(=C/C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C)cc1 303943952 XVAHYUHPVWBGLM-SDXDJHTJSA-N 348.446 5.110 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340448767 KLMUODIKDVBPEV-UXHICEINSA-N 328.406 5.441 30 20 EKED Cc1ccc(-c2nnc([C@H](C)S[C@H](C)c3cccc(C#N)c3)o2)cc1 419466946 RWUGBMJPRWZNNM-CABCVRRESA-N 349.459 5.472 30 20 EKED C=CCC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 435668213 WCWXMCFSQRWIQG-HXUWFJFHSA-N 347.462 5.317 30 20 EKED C=C(C)[C@@H](N[C@@H](CC)c1ccc(C#N)cc1)c1ccc(F)c(F)c1 447593448 SAPGDSAKUYFXIG-VQTJNVASSA-N 326.390 5.195 30 20 EKED CC1(C)CCCC[C@@H]1CC(=O)N[C@H](CCCC#N)c1ccccc1 487498522 FMKRWFVDKLSHME-RTBURBONSA-N 326.484 5.144 30 20 EKED C=C(C)CCSCc1nnc(-c2ccc(Cl)cc2Cl)o1 507845920 AMWNVYHZJVSMRF-UHFFFAOYSA-N 329.252 5.243 30 20 EKED CC1(C)CCCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 525077603 AWGDKGRAKUMBIJ-UHFFFAOYSA-N 348.446 5.003 30 20 EKED CC(C)(CCC#N)CNCc1ccc(Oc2ccccc2F)c(F)c1 525695725 LXENQMPHYGTXEN-UHFFFAOYSA-N 344.405 5.177 30 20 EKED CC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 538114921 VCYLUYIFRQCXET-HXUWFJFHSA-N 332.472 5.528 30 20 EKED C[C@@H](CCc1c(F)cccc1F)N[C@H](CCCC#N)c1ccccc1 551222458 LJJJLDDPLLZBDY-HRAATJIYSA-N 342.433 5.311 30 20 EKED C=CCC[C@H](NCC(=O)Nc1ccccc1C(C)C)c1ccccc1 553340618 OZANEYBYPQGGOG-FQEVSTJZSA-N 336.479 5.046 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)Nc3cccc(F)c3)cc2)c1 609432763 BLBDUWQMNMAWOZ-UHFFFAOYSA-N 347.349 5.134 30 20 EKED N#Cc1cc(Cl)ccc1SCc1csc(-c2ccoc2)n1 610654852 GEIKOJJQYVHXPE-UHFFFAOYSA-N 332.837 5.220 30 20 EKED Fc1ccc(F)c(CNC(CCC(F)(F)F)CCC(F)(F)F)c1 657707108 SASUMHWQDDOQEQ-UHFFFAOYSA-N 349.265 5.108 30 20 EKED COc1cc(C)ccc1C(=O)/C=C/c1nc(-c2ccccc2)cs1 727975219 UVFAQPVMGIKVTN-ZHACJKMWSA-N 335.428 5.023 30 20 EKED CCCCCCCCC(=O)N(Cc1cscn1)c1ccccc1 731176552 DKONEDDHESSBJI-UHFFFAOYSA-N 330.497 5.427 30 20 EKED C=CC1CCN(C(=O)c2cc(-c3cccs3)nc3ccccc23)CC1 732003549 YUFIAELDWUYSTD-UHFFFAOYSA-N 348.471 5.002 30 20 EKED CCCCCCCC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 732136930 YODCTRYLWJQVSV-UHFFFAOYSA-N 344.474 5.374 30 20 EKED CCCCC[C@@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 742648751 AZHTYQYWGJRBLS-CVEARBPZSA-N 332.513 5.483 30 20 EKED CC(=NNc1cccc2cnccc12)[C@@H](C)c1nc2ccccc2s1 748788289 QCBHXUWBDAHSQY-CYBMUJFWSA-N 346.459 5.436 30 20 EKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1ccc(F)c(F)c1 751526141 ZHBHOIHOEJZNAS-GQCTYLIASA-N 339.316 5.062 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(SCC(F)F)cc1)c1ccncc1 766024054 YYVCIMCLUWGMLF-KBXCAEBGSA-N 348.462 5.407 30 20 EKED C#CC[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccccc1 773113297 CZXIFYIZLGQUIL-LPHOPBHVSA-N 332.472 5.225 30 20 EKED N#CC1(CCCCSc2nnc(-c3ccccc3Cl)o2)CCC1 901489822 KWOQGHDOIFIMBI-UHFFFAOYSA-N 347.871 5.346 30 20 EKED CSc1ccc(C(=O)/C=C\c2csc(Br)c2)cc1 913617528 HOHBPUMLNCZRMR-UQCOIBPSSA-N 339.279 5.129 30 20 EKED O=C(O)c1cc(NN=C2CCC[C@@H](c3ccccc3)CC2)ccc1F 1776063829 KTAKZNMDKOFYMR-OAHLLOKOSA-N 340.398 5.040 30 20 EKED CC(C)[C@H]1/C(=C/c2ccc(C(=O)O)cc2Cl)C(=O)c2ccccc21 1776308865 RVLCJAUGBVREAE-YZIPPPLESA-N 340.806 5.058 30 20 EKED CCCCCCCOc1ccc(CN[C@@](C)(CCCC)C(=O)O)cc1 1776788288 XMRPKZIAUITXEC-NRFANRHFSA-N 349.515 5.159 30 20 EKED CCN(C(=O)Nc1cc(Cl)ccc1C)[C@H](C)c1ccc(C#N)cc1 118793225 JFWUUDWSXCXUGA-CQSZACIVSA-N 341.842 5.135 30 20 EKED Cc1ccc(NC(=O)C(C)(C)C)cc1N[C@@H](C)c1cccc(C#N)c1 179845869 VYQRGVOWCVCSMW-HNNXBMFYSA-N 335.451 5.024 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CCSCC 191462385 PDEWCFYRUKEKQF-HNNXBMFYSA-N 334.529 5.192 30 20 EKED Cc1cc([C@@H](C)/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)c(C)s1 328741830 JDNPUZYXFMVMRX-LLVKDONJSA-N 342.464 5.310 30 20 EKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(C#N)c1 442790987 HXMRVNOZIQZYBV-MRXNPFEDSA-N 339.398 5.395 30 20 EKED C=C(C)[C@H](CC(=O)Nc1ccc(Cl)cc1-c1ccccc1)OCC 468287739 HLCNBWZQPICDPS-IBGZPJMESA-N 343.854 5.317 30 20 EKED Cc1cccc(C)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 474696300 JAGGDSKKZQLRPT-UHFFFAOYSA-N 342.398 5.220 30 20 EKED N#CC1(CCCSCc2ccccc2C(F)(F)F)CCOCC1 507131198 DYSIMJXNFOBNMT-UHFFFAOYSA-N 343.414 5.039 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)CCC=C2 511695033 IXTMEZHBPWYXCW-HNNXBMFYSA-N 348.471 5.293 30 20 EKED N#CC1(c2ccc(C(=O)Nc3cccc(C(F)F)c3Cl)cc2)CC1 541650072 QUMRPSBPDWAGHY-UHFFFAOYSA-N 346.764 5.085 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(SC3CC3)cc2)n1 542118557 YPWBQLTUZOPCNH-HNNXBMFYSA-N 342.489 5.011 30 20 EKED C=CCCC(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 588037229 BMVVIPBCJABUGO-NSHDSACASA-N 331.403 5.501 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccncc2s1 595039301 QXUOSRBKEGVEDN-QAPCUYQASA-N 335.476 5.382 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3c2sc2ccccc32)c(F)c1 610812861 XWGXQNCBPVQNDG-GOSISDBHSA-N 336.435 5.079 30 20 EKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 656688951 MPHGZGUFMOOORM-JTQLQIEISA-N 345.302 5.530 30 20 EKED C=CCN(C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C)C(C)C 726849169 OBXZIVFNNZTJJW-UHFFFAOYSA-N 342.870 5.744 30 20 EKED CCCN1Cc2cccc(N=Cc3cc(Cl)cc(Cl)c3O)c2C1 727265252 MBGWRLPRKGYEPF-UHFFFAOYSA-N 349.261 5.175 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 729891665 LULPBCOHTLRRCF-DGCLKSJQSA-N 334.872 5.198 30 20 EKED Cc1cccc(NC(=S)Nc2ccccc2SCCC#N)c1C 730952939 FZSZAXGOPDWOJF-UHFFFAOYSA-N 341.505 5.118 30 20 EKED C=CCCC(=O)O[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734729772 QGBAYUBQAQHZGZ-LBPRGKRZSA-N 335.856 5.342 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cc(C#N)cs2)cc1 748441331 XSIZAZWCIORTIW-ZHACJKMWSA-N 345.423 5.191 30 20 EKED CC(C)(C)Oc1ccc(C(=O)/C=C\c2scnc2C2CC2)cc1 782350606 BGQGEWANBYTOFK-KHPPLWFESA-N 327.449 5.094 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1ccc(SC(F)F)cc1 782889106 BWMYIIZIWVNOEX-RMKNXTFCSA-N 341.382 5.446 30 20 EKED C=CCC[C@@H](Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 796926098 NYOYTJKRYYJBQQ-LJQANCHMSA-N 341.451 5.265 30 20 EKED C=CCCc1ccccc1NC(=S)N[C@H](CC)c1cccs1 799900541 MDOUESYDLDLHNF-OAHLLOKOSA-N 330.522 5.304 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCCc3cc(SC(F)F)ccc32)C1 834880306 SLQSZZYNJMWUQX-JDFRZJQESA-N 336.451 5.051 30 20 EKED CC(C)(C)c1cc(NC(=O)c2sccc2C(F)F)c(C#N)s1 875496437 HTBILWBEFPNDRA-UHFFFAOYSA-N 340.420 5.169 30 20 EKED CC(C)[C@@H](N[C@H](C)c1cc(C#N)ccn1)c1ccc(C(F)(F)F)cc1 902884331 FIOOHUMWKZJYES-FZKQIMNGSA-N 347.384 5.020 30 20 EKED C=CCc1ccccc1/C=C/c1cc(C(=O)O)c2cc(C)ccc2n1 1776189076 IURHRXQKZFYICQ-ZHACJKMWSA-N 329.399 5.140 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C\c1c(C)cc(C)cc1C 1776783331 QTBCOPODOMEIDT-QXHGNLAOSA-N 345.527 5.418 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1CC(C)C 1776786944 CBGXGMOJUMKPJF-HXUWFJFHSA-N 333.516 5.179 30 20 EKED O=C(O)c1ccc2scc(/C=C/C(=O)c3coc4ccccc34)c2c1 1777683985 MQBRYBZWGZMAGG-FNORWQNLSA-N 348.379 5.242 30 20 EKED N#CCCSc1ccccc1NCc1ncc(-c2cccs2)o1 174310152 YQJZDLFLJKDAEH-UHFFFAOYSA-N 341.461 5.021 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(C(F)F)cc1 185620977 OEZQPPUOTYSLJL-CYBMUJFWSA-N 332.419 5.631 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(F)c1F 189882774 ZSJPBBMLWLBQBN-UHFFFAOYSA-N 343.417 5.388 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(C(C)C)nc1C 294818484 FUWVDIBBLSACPC-UHFFFAOYSA-N 326.440 5.211 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)CC(C)(C)C#N 330689700 AEXQZZYAXAUCMD-UHFFFAOYSA-N 330.497 5.298 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 410354274 VMFNIBKLPSGNAR-ZIAGYGMSSA-N 331.868 5.262 30 20 EKED C[C@@H](SCc1ccc(Oc2ccccc2)nn1)c1cccc(C#N)c1 443138723 XREICAJYXHULSX-OAHLLOKOSA-N 347.443 5.135 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@@H](C)c1ccc(C#N)cc1 447565291 KBMWUGPXFDETHF-KSSFIOAISA-N 332.369 5.211 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2=CCCC2)cc1Cl 471230379 PYKJJVGSEYNECJ-SFHVURJKSA-N 336.822 5.044 30 20 EKED C=CCOc1ccc(C(=O)Nc2c(CCC)cccc2C(C)C)cc1 472684042 ILLTVHWAZFMLBA-UHFFFAOYSA-N 337.463 5.580 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC2CC2)cc1 476162916 RHHVTABXEOSVIW-UHFFFAOYSA-N 349.474 5.580 30 20 EKED CC(C)c1ccc2c(c1)[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)CC2 476876664 HSOOHBSQSXNUSP-RBBKRZOGSA-N 346.474 5.001 30 20 EKED N#Cc1ccc(CSCc2c(Cl)ccc3cccnc23)c(F)c1 498115647 DTEFFHQCDDDDTN-UHFFFAOYSA-N 342.826 5.332 30 20 EKED N#CC1(c2ccc(C(=O)N(c3ccccc3)C3CCCCC3)cc2)CC1 537429617 SGNDMPDEYUPABO-UHFFFAOYSA-N 344.458 5.221 30 20 EKED C=CCCC[C@@H](C)NC(=O)c1ccccc1SCc1cccs1 540537948 JJMLRIKWEDGKPM-OAHLLOKOSA-N 345.533 5.515 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)c(F)c1 553791263 QAXOSQNOIPHGOJ-RBZFPXEDSA-N 326.390 5.028 30 20 EKED N#CCCC[C@@H](N[C@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 559864141 NPZUVFDVPDWEDJ-IRLDBZIGSA-N 343.474 5.570 30 20 EKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)CCCCCC#N)c2)C1 588154669 AYPAJJLVTRINDY-FXAWDEMLSA-N 342.483 5.194 30 20 EKED N#CCCCSCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1 600651650 HAOCGOXHCHHMOI-UHFFFAOYSA-N 344.333 5.036 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)CCc2ccc3ccccc3c2)cc1 603941143 RMKHFYXECCRPMV-UHFFFAOYSA-N 342.442 5.212 30 20 EKED C[C@@H](Nc1cccc(C#N)n1)c1ccc(Oc2ccccc2)c(F)c1 609894755 PIHOFHKFIRXMCP-CQSZACIVSA-N 333.366 5.058 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(SCC(F)F)cc1 610829946 SVXUDCXSPSDLLU-KBPBESRZSA-N 346.446 5.327 30 20 EKED CCCCN(C(=O)Nc1cccc(C#N)c1C)[C@@H](C)c1ccc(C)o1 610905995 NSUKYAARKAIRIZ-INIZCTEOSA-N 339.439 5.163 30 20 EKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(C)cc1C 726471780 UAAOCCVQFMNKDC-UHFFFAOYSA-N 343.883 5.052 30 20 EKED CC(C)C[C@@H](C#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732659043 IRIHEYZGTWAVDW-ZDUSSCGKSA-N 348.899 5.346 30 20 EKED CC(C)(C)Nc1ccccc1NCc1cccc(OCCCC#N)c1 798500041 IAACKTKWKXKDAS-UHFFFAOYSA-N 337.467 5.192 30 20 EKED CC1(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 808979185 SZCKSMWSLSOIIU-LBPRGKRZSA-N 332.856 5.096 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815635857 KFBMQKXVLZJMRI-RDTXWAMCSA-N 328.843 5.131 30 20 EKED Cc1c([C@@H](N[C@@H](C)c2cc(C#N)ccn2)C(C)C)oc2ccccc12 902800817 UMYKMLDPZLEOMW-YWZLYKJASA-N 333.435 5.056 30 20 EKED O=C(/C=C\c1ccc(Cl)c(F)c1)c1sccc1Br 921266190 WNZMOPDFEQVTBB-RQOWECAXSA-N 345.620 5.199 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccsc1 1776784603 PEYXVOQNICOPRJ-KRWDZBQOSA-N 325.518 5.336 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C)c3C)n2)cc1 57526916 RIILRAMNMKOHGD-SFHVURJKSA-N 346.455 5.225 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 90665313 RMNNZEQQVHNHPW-PBHICJAKSA-N 327.497 5.271 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccccc1Cl 106891599 LUIUFFVRFYZLOY-UHFFFAOYSA-N 332.790 5.131 30 20 EKED COc1ccsc1[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 186238380 FWYBCZDCDXEZPC-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccc(F)c(F)c1 191507759 JFEXXYWUFQMNAT-YJYMSZOUSA-N 333.426 5.019 30 20 EKED CCCC(=O)Nc1cccc(N[C@H](CC)c2ccc(C#N)cc2)c1C 278884662 YDORILWQRRZCHO-GOSISDBHSA-N 335.451 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1 413751370 USHLNKXPNUVCRA-LEWJYISDSA-N 344.458 5.152 30 20 EKED C=CCOc1ccccc1CN[C@@H]1C[C@H](C)Sc2sccc21 482883659 DOGOMSZRKDHINO-XJKSGUPXSA-N 331.506 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(C)ccc2C1 484650579 IKMISDXOBCNCPL-UHFFFAOYSA-N 348.490 5.437 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 489599452 REPNRLHKQQMHHQ-DYESRHJHSA-N 349.478 5.014 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 511839192 UHTUKQIGFNCNDT-YESZJQIVSA-N 342.508 5.237 30 20 EKED N#Cc1cccc(/C=C/c2nc(-c3c(Cl)cccc3Cl)no2)c1 520273016 YUOWEIIPLHACIP-BQYQJAHWSA-N 342.185 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1coc2cc(C)ccc12 530454603 NLZKMBIWPBHYIC-UHFFFAOYSA-N 347.458 5.774 30 20 EKED Cc1ccc(-c2ccc(CN[C@H](CCC#N)c3ccccc3)o2)cc1 533497351 KVJDCFNLKWIZET-OAQYLSRUSA-N 330.431 5.390 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2cccc(C#N)c2F)cc1 538203489 NLIYPVMMHWZGPI-CQSZACIVSA-N 328.456 5.049 30 20 EKED C=CCCOCCCCC(=O)Nc1cccc(-c2cccs2)c1 540495588 ZFIVROBUUMNUMO-UHFFFAOYSA-N 329.465 5.117 30 20 EKED COc1ccc2oc(C(C)=NNc3cccc4cnccc34)c(C)c2c1 729145010 GERJTYQIDASFJY-UHFFFAOYSA-N 345.402 5.134 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1cc(Cl)sc1Cl 742432642 YVLNWWRAAKWSFZ-SREVYHEPSA-N 349.242 5.341 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C/c2coc(-c3ccccc3)n2)cc1 749886396 MLMQYIKYBZXFRL-JLHYYAGUSA-N 333.387 5.025 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCC(F)(F)F)cc1 770644814 LOWFOODPQBHPIT-KRWDZBQOSA-N 346.352 5.013 30 20 EKED C[C@H](NCc1cccnc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 782383644 SXLZQNLIVCAKEB-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=CCCN(C)C(=O)Nc1ccccc1SCc1ccccc1 786057017 RTNBWHVLHRBQDE-UHFFFAOYSA-N 326.465 5.019 30 20 EKED C=C(C)[C@H](N[C@@H](CC)c1ccc(F)cc1O)c1ccc(F)c(F)c1 796949252 PHMZTKGZQDEVQN-HKUYNNGSSA-N 335.369 5.168 30 20 EKED N#CC1(CC(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)CC1 815072232 HCZYYXPBLMSZOW-UHFFFAOYSA-N 345.229 5.293 30 20 EKED CC(CCCCC#N)=NNc1ncnc2sc(-c3ccccc3)cc12 841607406 DNNQILWJLWEBNS-UHFFFAOYSA-N 349.463 5.230 30 20 EKED C=CCC[C@@H](N[C@@H]1CCCc2c[nH]nc21)c1ccc(C(F)(F)F)cc1 857858662 PMOJWRCOMPXXAC-IAGOWNOFSA-N 349.400 5.103 30 20 EKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc2oc(C3CC3)nc2c1 914703587 WFFIEIIUNBGDDE-UHFFFAOYSA-N 347.201 5.468 30 20 EKED O=C(O)c1cc(NN=C2CCCC[C@H]2C2CCCCC2)ccc1F 1776063286 KIMUSLYDBHPVLZ-HNNXBMFYSA-N 332.419 5.062 30 20 EKED CC(CC12CC3CC(CC(C3)C1)C2)=NNc1cccc(C(=O)O)c1C 1776086494 XPCOCXYMAQAMBB-UHFFFAOYSA-N 340.467 5.088 30 20 EKED CCCCCCCCCCN=c1c(C(=O)O)c[nH]c2c(C)cccc12 1776787752 LTHIOJUZYWRDQZ-UHFFFAOYSA-N 342.483 5.216 30 20 EKED CCn1c2ccccc2c2cc(NC(=O)C3(C#N)CCCCC3)ccc21 72029700 CBZIFEMIJJNUEL-UHFFFAOYSA-N 345.446 5.227 30 20 EKED CCCCCCCCC(=O)Nc1cc(OC)c(Cl)cc1OC 109466051 QGDWUFMBSHKKDY-UHFFFAOYSA-N 327.852 5.046 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(OC(F)F)cc1 172907521 WFGGTOWCWJSFHX-CYBMUJFWSA-N 348.418 5.294 30 20 EKED CCn1c(SCCCC(C)(C)C#N)nnc1-c1cccc(Cl)c1 177155279 JRTUYWFSTGQSBS-UHFFFAOYSA-N 348.903 5.040 30 20 EKED N#CCCSc1ccccc1NC(=O)CC/C=C\c1ccccc1 255228060 PMZVZPQYTYQHDA-WCIBSUBMSA-N 336.460 5.124 30 20 EKED Cc1cc(C)c(NC(=O)CCCSCCC(C)(C)C#N)c(C)c1 276632544 QHGNNKSJXGALQT-UHFFFAOYSA-N 332.513 5.004 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cc(C)sc2C)cc1Cl 303224228 WAVNEODPYKAHNA-ZDUSSCGKSA-N 335.900 5.434 30 20 EKED N#CC(CCSc1ccncc1)(c1ccccc1)c1ccccc1 434647512 HDSGLRPWZYQEDA-UHFFFAOYSA-N 330.456 5.074 30 20 EKED Cc1cc(CN[C@H](C)c2ccc(C#N)cc2)ccc1-c1ccccc1 488201204 ZTYKTUUISGPGIP-GOSISDBHSA-N 326.443 5.385 30 20 EKED N#CCCCOc1cccc(NC(=O)Nc2ccc(C3CCC3)cc2)c1 488383656 HTVSNABUYKNJEU-UHFFFAOYSA-N 349.434 5.281 30 20 EKED N#Cc1csc(CNc2ccc(-c3ccc(Cl)s3)nc2)c1 509045892 LZFAHOJASSHHMW-UHFFFAOYSA-N 331.853 5.009 30 20 EKED N#Cc1ccccc1SCc1ccc(C(=O)Nc2ccccc2)cc1 525086193 ZFXVYGNVYSQSIB-UHFFFAOYSA-N 344.439 5.103 30 20 EKED C=CCC[C@@H](C)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 542668687 QAXSEDHZYJTPNY-LJQANCHMSA-N 345.490 5.043 30 20 EKED N#CCc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)cc1 543187955 OEFYYADJSDCFLW-DEOSSOPVSA-N 340.470 5.216 30 20 EKED N#CC1CCC(CNc2cc(C(F)F)nc3ccc(Cl)cc23)CC1 565324742 HGTCHYXZYPZKLL-UHFFFAOYSA-N 349.812 5.568 30 20 EKED N#Cc1ccccc1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 598544309 RREAEUUUUHQZRX-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CCCCS[C@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 609803844 DIIRNXFRKXAVON-LLVKDONJSA-N 346.477 5.417 30 20 EKED Cc1cc(C#N)ccc1CS[C@@H](C)c1nc(-c2ccccc2C)no1 614394780 SJQLCWLIIPJVAS-HNNXBMFYSA-N 349.459 5.220 30 20 EKED CC(=NNc1ccc(F)cc1F)c1csc(-c2csc(C)n2)c1 729140765 NMUJMUDRDISDML-UHFFFAOYSA-N 349.431 5.294 30 20 EKED CC[C@@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 732915847 JFBBHXGZJJXCBQ-DHIUTWEWSA-N 326.443 5.905 30 20 EKED C[C@@H](CC#N)OC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 733710587 CUJAZCZWZNHMFR-SUMWQHHRSA-N 345.851 5.019 30 20 EKED O=C(/C=C/c1cnn(-c2ccccc2)c1)c1cccc(Cl)c1Cl 734980706 KXRSLZHGVYHYJY-MDZDMXLPSA-N 343.213 5.075 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1cccc2cccnc12 735230299 JJVQOJRHZCZTFB-UHFFFAOYSA-N 340.835 5.083 30 20 EKED COc1ccccc1-c1ccc(/C=C2\Cc3ccccc3C2=O)cc1 741468737 KHYCRLNEOYBTLP-XMHGGMMESA-N 326.395 5.185 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1cc(Cl)sc1Cl 742432643 YVLNWWRAAKWSFZ-VOTSOKGWSA-N 349.242 5.341 30 20 EKED C=CCOCCCC(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 742619746 MEPUONJKQQAQCI-UHFFFAOYSA-N 343.854 5.237 30 20 EKED CCCCCCCCCC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 754564953 HJBJQVLKPZXBPZ-PMACEKPBSA-N 349.490 5.303 30 20 EKED Clc1ccc(C=NOCc2nc(-c3ccccc3)cs2)cc1 766684296 LLPPHYVNLPUSQZ-UHFFFAOYSA-N 328.824 5.014 30 20 EKED O=C(/C=C\c1cncs1)c1ccc(-c2ccccc2Cl)s1 767721612 MRNAZCQYCRQPRB-WAYWQWQTSA-N 331.849 5.421 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C/c2ccc3ncccc3c2)cc1Cl 773160663 OTIWTEWVPISTFR-GQCTYLIASA-N 343.213 5.020 30 20 EKED CCC[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@H](C)C#N 780156047 COFHZUOTWOVGFK-AEFFLSMTSA-N 342.483 5.303 30 20 EKED CC(C)O[C@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 793033961 HPIBAUYRDXPBAB-QGZVFWFLSA-N 337.341 5.236 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(F)c(Cl)c1 794994859 JSAKKUSBUTTZNO-UHFFFAOYSA-N 348.874 5.254 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)o1 818235732 UUAQTNMNDZLCGW-CLFYSBASSA-N 339.372 5.121 30 20 EKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(OC(F)F)cc1 920942978 IZELBHGXMIQXRG-UHFFFAOYSA-N 332.133 5.051 30 20 EKED CC[C@@H](C)Cc1c(C)sc2nc(S[C@H](C)CCC#N)nc(O)c12 1643608383 LNMQARPAWDOUFR-GHMZBOCLSA-N 349.525 5.078 30 20 EKED CC(C)[C@H]1/C(=C/c2cccc(C(=O)O)c2Cl)C(=O)c2ccccc21 1776308592 HCMWPJJMGOSING-LPPOOGIUSA-N 340.806 5.058 30 20 EKED Cc1cc(CN[C@@H](CCC#N)c2ccccc2)cc(C)c1OC(F)F 130446488 SUSMHIFONXSNEJ-SFHVURJKSA-N 344.405 5.040 30 20 EKED C[C@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1ccc(OCC#N)cc1 182005965 BNJAYKAVBKKEPN-HRAATJIYSA-N 334.463 5.052 30 20 EKED C=C(C)[C@@H](NCc1cnc(-c2ccco2)s1)c1ccc(F)c(F)c1 193222903 JBOVBMZMHMIVAH-QGZVFWFLSA-N 346.402 5.088 30 20 EKED O=C(/C=C\c1csc(Br)c1)c1ccc(Cl)s1 209133137 UXHBTZDCLUVMPQ-UPHRSURJSA-N 333.659 5.122 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 214079682 ZPQUBHIWAUNEKB-MPYXGJHCSA-N 347.292 5.066 30 20 EKED CC(C)c1cccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 432640222 DAPNQCQJCNPMFM-HXUWFJFHSA-N 335.451 5.367 30 20 EKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cccc2ccccc12 474206952 QIWODGKAGBRMEK-INIZCTEOSA-N 342.442 5.132 30 20 EKED COc1ccc(Cl)c(CNc2ccccc2S[C@@H](C)CC#N)c1 479481597 QNLJCIQNNKMRGU-ZDUSSCGKSA-N 346.883 5.355 30 20 EKED CC[C@H](NCc1ccc(Cl)cc1C#N)c1ccc(Cl)s1 481067625 GLDJMPDOCDWASN-ZDUSSCGKSA-N 325.264 5.167 30 20 EKED N#CC1(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CCCCC1 512788660 QVDUFBKVJYAUPY-UHFFFAOYSA-N 346.858 5.074 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(CC#N)cc2)c(C)c1 534627131 DPFPUWWIJWHQAU-HNNXBMFYSA-N 338.476 5.204 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 536838696 MBIPKBBZVAZGLO-UGSOOPFHSA-N 333.262 5.689 30 20 EKED CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(Cl)c(C#N)c1 539370642 QUASAAFOFBZKFX-UHFFFAOYSA-N 347.245 5.242 30 20 EKED C[C@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2cccs2)o1 567539910 WPCIRQBRXIPBER-VIFPVBQESA-N 347.852 5.176 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)Nc2cc(C#N)cc(C)n2)cc1 587985553 USBZVXXNKSMBHP-MRXNPFEDSA-N 343.430 5.110 30 20 EKED C=CCCSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 606756033 XHSYPRISPUJUDJ-INIZCTEOSA-N 335.476 5.223 30 20 EKED CCc1oc2ccccc2c1C=NO[C@H](C)c1cccc([N+](=O)[O-])c1 727490249 HDVBVILAYSQHKM-CYBMUJFWSA-N 338.363 5.015 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(C#N)cc2)cc1 741464948 RPQQGRBBDPTYQI-XNTDXEJSSA-N 339.394 5.130 30 20 EKED C[C@H](ON=Cc1cccc(Cl)c1Cl)c1ncc(C(C)(C)C)o1 756850626 XLGVZXDVQBAZHB-JTQLQIEISA-N 341.238 5.391 30 20 EKED CC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 757196979 CDMRVEFLQJUEGS-CZAAIQMYSA-N 347.462 5.042 30 20 EKED CC(C)(C#N)CCCCN1CCC(c2nc(C(C)(C)C)cs2)CC1 769725577 CEKZTGAVTCBZNG-UHFFFAOYSA-N 347.572 5.340 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1ccccc1OC 789723430 YCRPMJDWHYWJFA-BMRADRMJSA-N 349.474 5.589 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nccc2ccccc12 792099394 IAUQQQPHVDUKTL-AZUAARDMSA-N 334.463 5.408 30 20 EKED N#C[C@@H](C(=O)CCCC1CC1)c1nc(-c2ccc(Cl)cc2)cs1 813060869 MORMLQBGVFGBEV-HNNXBMFYSA-N 344.867 5.220 30 20 EKED COc1c(O)cccc1/C=C/C(=O)c1ccc(-c2ccccc2)s1 11332120 OCJPMFOIZRGPNC-ZHACJKMWSA-N 336.412 5.025 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(OC(C)C)cc2)ccc1SC 60245350 UADJDSNKLOXNIM-YRNVUSSQSA-N 342.460 5.100 30 20 EKED C=C(C)COc1cc(CN[C@@H](C)c2cc(C)sc2C)ccc1OC 60946856 XGCCFITXBQQTJP-HNNXBMFYSA-N 345.508 5.179 30 20 EKED C=CCN(CCc1ccccc1)C(=O)c1ccc(SC(C)C)cc1 65776250 ZGIPSTJDXVLWEI-UHFFFAOYSA-N 339.504 5.058 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCC[C@@H](C)C1 109029112 LGIWSUXQDMOQDS-PMPSAXMXSA-N 345.512 5.123 30 20 EKED Cc1[nH]c2ccccc2c1C1CCN([C@@H](C)c2ccc(C#N)cc2)CC1 303732549 VPIDAFNJZPIAGT-KRWDZBQOSA-N 343.474 5.289 30 20 EKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cc2ccccc2o1 329473604 AOXILLQFNSHWQJ-QGZVFWFLSA-N 349.434 5.127 30 20 EKED Cc1cc(C)cc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431925655 KYUOXAYPFMEUKO-GHTZIAJQSA-N 349.478 5.099 30 20 EKED C=CCC(CC=C)C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 467328289 UWEGUENNFCDYSO-AWEZNQCLSA-N 340.492 5.064 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cccc(C#N)c1)C1CC1 509897562 XRFCOHIWNNIULC-MRXNPFEDSA-N 340.426 5.077 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](C)c1ccccc1Oc1ccccc1 522982630 ZLNDGXJWWDKBIQ-KRWDZBQOSA-N 338.451 5.148 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 524882545 YPMYCFKEJDJYFN-SBUREZEXSA-N 344.433 5.332 30 20 EKED C=CCC[C@H](NCc1ncc(CC)o1)c1ccc(C(F)(F)F)cc1 539333797 NQAVOTNPAVYGKW-INIZCTEOSA-N 338.373 5.053 30 20 EKED N#CCCC[C@H](N[C@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 559864146 NPZUVFDVPDWEDJ-UNMCSNQZSA-N 343.474 5.570 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@H](C#N)c1ccc(Cl)cc1 595414565 FFOXWHNZESIHPJ-KBXCAEBGSA-N 328.843 5.043 30 20 EKED CCC(CC)[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccs1 604083787 ZGTDTNITQICGCG-GOSISDBHSA-N 341.480 5.113 30 20 EKED C=CCCCN(C)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 605645186 UZXUAFYUJNDDMG-UHFFFAOYSA-N 346.430 5.047 30 20 EKED N#CCC[C@@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccccc1 611337062 LMJQLPOKNWWQBM-QZTJIDSGSA-N 345.273 5.615 30 20 EKED CC(C)Oc1cccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)c1 614180123 YIQXRLRPCZEXLD-KRWDZBQOSA-N 336.479 5.126 30 20 EKED C=C(C)[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)c(F)c1 614206787 FOVWNYOZBPZQPF-FQEVSTJZSA-N 340.417 5.173 30 20 EKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(F)cc1F 727264441 RHLVGQVZTVRGMS-KXFIGUGUSA-N 346.682 5.533 30 20 EKED CCCCCCCCCN(C)C(=S)N[C@@H]1CCOc2ccccc21 741487520 GJVHZVGPZQDOGO-GOSISDBHSA-N 348.556 5.067 30 20 EKED Cc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(O)c1 756787325 PSZYXWFOZOMUHF-KRWDZBQOSA-N 342.442 5.090 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)Cc1ccccc1CC#N 765275041 FXWYHAWJXIXRFM-UHFFFAOYSA-N 348.833 5.049 30 20 EKED C=C[C@H](CC(=O)O[C@H](c1ccccc1)c1nccs1)c1ccccc1 770183248 JUFMUZLIKQJBQF-OXQOHEQNSA-N 349.455 5.136 30 20 EKED N#CCOc1ccc(Cl)cc1CSc1cccc(Cl)c1C#N 782917380 FPGRNTQDBOQRNC-UHFFFAOYSA-N 349.242 5.060 30 20 EKED CSc1ccc(CN[C@@H]2C[C@H](C)Sc3sccc32)cc1C#N 886688672 XRXUOBZQLUMETK-XHDPSFHLSA-N 346.546 5.057 30 20 EKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)o2)c(F)c1 916141171 CMYZDDBQBRJNDH-YFHOEESVSA-N 340.325 5.130 30 20 EKED O=C(/C=C/c1ccc(Oc2cc(F)cc(F)c2)cc1)c1cccnc1 921260967 JAVOAAOPIFLPMT-VMPITWQZSA-N 337.325 5.048 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)c(F)c1 1776076898 LCXDBKADMOGRSG-GUYCJALGSA-N 348.462 5.554 30 20 EKED C=CCN(CC=C)C(=O)c1sc2cc(Cl)ccc2c1Cl 60525557 PSSVVSLZWGJUNH-UHFFFAOYSA-N 326.248 5.022 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1ccc2ncccc2c1 107842014 LYPYNCIZPXINEF-CSKARUKUSA-N 336.460 5.193 30 20 EKED C=CC[C@H](C(=O)Nc1cc(-c2ccncc2)ccc1C)c1ccccc1 187425091 ZUDDCQGQCTUDDM-NRFANRHFSA-N 342.442 5.355 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cnc2ccccc2c1 253614488 BNTMNMDRAVKQME-UHFFFAOYSA-N 349.393 5.026 30 20 EKED Cc1nnc(-c2cccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)c2)o1 329168467 JCBMPDLEEMCBRZ-FHLIZLRMSA-N 339.439 5.240 30 20 EKED N#CCCC[C@H](NC(=O)c1csc2ccccc12)c1ccccc1 352207285 VXYCMVWLYWZDMB-SFHVURJKSA-N 334.444 5.066 30 20 EKED N#CCCC[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccccc1 353912683 FUMOVMBNSSMZLG-GOSISDBHSA-N 332.369 5.230 30 20 EKED CC(C)(C#N)CCCCN1CC=C(c2c[nH]c3cc(F)ccc23)CC1 444640219 BMJFYCHCPOTKAT-UHFFFAOYSA-N 339.458 5.116 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(Cl)c2ccccc12 462640760 MZNXKAMAJPAYJC-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 464650901 SBPABBXEMIGYPM-INIZCTEOSA-N 334.419 5.200 30 20 EKED C[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 480810748 KRBKOGGZPNXMHG-INIZCTEOSA-N 349.434 5.004 30 20 EKED C=C(C)CCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510759804 BLSOTVUAPXHVDZ-CYBMUJFWSA-N 325.296 5.255 30 20 EKED N#Cc1csc(CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)n1 518445521 PCKVGUJLAOOBMC-GOSISDBHSA-N 345.899 5.079 30 20 EKED C[C@@H](Oc1ccccc1NC(=O)c1sccc1C#N)c1ccccc1 522332219 FEZSWBGRGRNONG-CQSZACIVSA-N 348.427 5.012 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccsc1 523088759 ZUZZUFAQYDBJGV-CQSZACIVSA-N 348.427 5.154 30 20 EKED COc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1Cl 536837968 IFLHOIQBSNGGPV-KDOFPFPSSA-N 328.843 5.044 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Cl 559862231 BYIJLYWTTMZEOO-KUHUBIRLSA-N 330.834 5.565 30 20 EKED N#CC1CCC(CNC(=O)Nc2ccc3oc4ccccc4c3c2)CC1 571623420 DMQKCIPISMXXDP-UHFFFAOYSA-N 347.418 5.037 30 20 EKED N#Cc1ccsc1C(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 609757569 JZBQWGJNBKVXEV-MRXNPFEDSA-N 344.867 5.031 30 20 EKED N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1ccc2ccccc2n1 685782530 IENYPSMOLDQHTI-FQEVSTJZSA-N 338.410 5.292 30 20 EKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cccc2ccccc12 753134582 JVMACIOTESPHCM-CMDGGOBGSA-N 342.423 5.254 30 20 EKED CCC[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 764563261 XMHCVZGFMSQKDV-OLZOCXBDSA-N 334.872 5.198 30 20 EKED C[C@@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 766348488 AABZXSXMUVPCBM-BZNIZROVSA-N 347.245 5.039 30 20 EKED C#CCCCCC(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1 773326249 RMXZHOJMKVKVLM-UHFFFAOYSA-N 340.854 5.084 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cc(Cl)cs3)c2)s1 785475301 PCDFNDOXQUQKEU-UHFFFAOYSA-N 344.892 5.291 30 20 EKED CCCC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccccn1 814740944 DQRZURGLRHFZOV-UHFFFAOYSA-N 343.645 5.053 30 20 EKED FC(F)(F)c1cc(NN=Cc2scnc2C2CC2)ccc1Cl 844606421 AOXXYXFQTKDLNV-UHFFFAOYSA-N 345.777 5.139 30 20 EKED C=C(C)c1cccc(NC(=O)N2CCC(OC3CCCCC3)CC2)c1 934875789 DGAHAESIHRXPKP-UHFFFAOYSA-N 342.483 5.065 30 20 EKED CC(C)Cc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776340446 SLXQVPRSPIPRMG-CPNJWEJPSA-N 348.442 5.186 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)OCc1ccccc1 189873684 TTWKFVBCJFBLOL-KRWDZBQOSA-N 337.463 5.082 30 20 EKED COc1cc(C(=O)/C=C\c2cccc(F)c2)ccc1SC(F)F 214926333 NSPMOYKFJYRBBT-ALCCZGGFSA-N 338.350 5.045 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1ccc(C#N)cc1Cl 439447648 FZIAAVCSLYSUJN-ZDUSSCGKSA-N 347.915 5.293 30 20 EKED N#C[C@@H]1CC[C@H](N[C@H](c2ccccc2)c2cccc3ccccc23)C1 471590724 OCARMYZUQOQGSD-DHJUGAMNSA-N 326.443 5.211 30 20 EKED Cc1c([C@H](C)NC(=O)c2ccc(C(C)(C)C#N)cc2)oc2ccccc12 474948216 QJDPTVALYRCQCL-HNNXBMFYSA-N 346.430 5.033 30 20 EKED C=CCCCC(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 480904348 WEEXBIDRRASPPW-INIZCTEOSA-N 325.374 5.115 30 20 EKED N#Cc1cccnc1Oc1ccccc1NCc1cc2ccccc2o1 486457560 QBHDUHCGBPUMCC-UHFFFAOYSA-N 341.370 5.104 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 498920406 ZKXCJZPTGHFYJE-UHFFFAOYSA-N 344.524 5.626 30 20 EKED CCN(C(=O)c1ccc(C(C)(C)C)cc1)[C@@H](C)c1ccc(C#N)cc1 509581178 YYFZXBFODZANGB-INIZCTEOSA-N 334.463 5.079 30 20 EKED N#Cc1ccccc1CN[C@@H](CCc1ccccc1)c1ccccc1 540381698 VIFUIBIRVSHVNG-QHCPKHFHSA-N 326.443 5.022 30 20 EKED C[C@@H](NCCCC(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 543874605 FVXLYEMBECSOQM-QGZVFWFLSA-N 331.463 5.206 30 20 EKED CC(C)[C@@H](NCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 565105773 XUPFIZHMWCRPHF-MRXNPFEDSA-N 326.406 5.322 30 20 EKED Cc1ccc([C@@H](NCc2ccc(CC#N)cc2)c2ccccc2)c(C)c1 570004308 XWVBEFBKYBOCDQ-DEOSSOPVSA-N 340.470 5.249 30 20 EKED Cc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1-c1ncco1 611483252 SWYMEZQMXCTAEI-HXUWFJFHSA-N 329.403 5.011 30 20 EKED C=CCN(Cc1cccs1)C(=O)CCc1ccc2ccccc2c1 614313822 HMBIRXARSQHYPS-UHFFFAOYSA-N 335.472 5.049 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC(C)C)c1cccs1 615915665 JYUCKQQQGVBSBU-MRXNPFEDSA-N 348.537 5.295 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=S)N(CCC#N)CC1CC1 728789794 IONZWGUWQDBLDW-UHFFFAOYSA-N 343.540 5.256 30 20 EKED CCCCCCCCCNC(=O)N(C)[C@H](C)c1sc(C)nc1C 730113407 QVRRGSOLNBNMEK-OAHLLOKOSA-N 339.549 5.213 30 20 EKED Cc1cccc(C(=O)/C=C/c2csc(-c3cccs3)n2)c1C 734305123 IZXWYQJYJBLDCC-CMDGGOBGSA-N 325.458 5.385 30 20 EKED CC(=NNc1cccc2cnccc12)c1ccc(-c2ccncc2)cc1 745203079 FEWPFCIMONCTQW-UHFFFAOYSA-N 338.414 5.133 30 20 EKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(-c2ccccc2)cc1 745624453 LJAZDNWMXMUTJY-UHFFFAOYSA-N 344.418 5.173 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(-c2ccncc2)cc1 745989905 GIJIDYAOGJIAQG-WMZJFQQLSA-N 336.394 5.193 30 20 EKED C=CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745990241 PCWZTVHJGDLFGT-WDZFZDKYSA-N 341.410 5.210 30 20 EKED Cc1ccc(C#N)cc1NC(=S)Nc1ccccc1-c1ccccc1 751006672 DEQVHMYAUKKZCB-UHFFFAOYSA-N 343.455 5.343 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)n1 756571964 QIGXRRURFZFSHR-ZJIFWQFVSA-N 330.497 5.049 30 20 EKED C=CC[C@@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccncc1 766020603 QOUAIDOFMOMETG-HNAYVOBHSA-N 336.435 5.113 30 20 EKED COc1c(Cl)cc(N[C@H](C)c2ccc(C#N)cc2F)cc1Cl 781420262 AVEZAQXGIHHPOW-SECBINFHSA-N 339.197 5.186 30 20 EKED N#C[C@H](C(=O)CCCc1ccc(Cl)cc1)c1nccc2ccccc12 792094501 ONISNFWXZYJKBG-LJQANCHMSA-N 348.833 5.087 30 20 EKED C=C[C@H](CC(=O)O[C@@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798669862 MWXUCLDVMBAAQN-UONOGXRCSA-N 349.352 5.065 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)CCCCCC#N 805881218 SAPHBFFOCBKRTG-HNNXBMFYSA-N 342.464 5.197 30 20 EKED COc1cc2c(cc1N[C@H](C)c1cccc(C#N)c1)oc1ccccc12 863997406 YFOKWDTVTXRPMZ-CQSZACIVSA-N 342.398 5.639 30 20 EKED O=C(/C=C/c1cc(Br)cs1)c1cccc(Cl)c1 916137560 LHLPLNHCUSZWFO-SNAWJCMRSA-N 327.630 5.060 30 20 EKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NCCCC(C)(C)C#N 185794004 REICOONCKKDGIN-ZIAGYGMSSA-N 326.406 5.117 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)c1nccs1 191491266 PAVICWIJWYNSRY-INIZCTEOSA-N 343.496 5.268 30 20 EKED N#Cc1cccc(COc2cccc(/C=C\C(=O)c3cccs3)c2)c1 206945179 HBXKAYMUISNFPL-KTKRTIGZSA-N 345.423 5.095 30 20 EKED CCC(C)(C)C1C/C(=C\c2cccnc2)C(=O)/C(=C/c2cccnc2)C1 207452843 XTMUEPLBFWCBOA-AYKLPDECSA-N 346.474 5.359 30 20 EKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329223397 XZMODXHIVRZFQS-CWIFOLKKSA-N 334.504 5.083 30 20 EKED Cc1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)co2)cc1 353912699 FXBYQDNYLJTODZ-NRFANRHFSA-N 345.446 5.175 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sccc1C1CC1 432984983 LCEQYUDKHLEIIH-UHFFFAOYSA-N 325.477 5.730 30 20 EKED C=CCC[C@@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1ccccc1 435110294 ILYICAZCLAAONY-QZTJIDSGSA-N 340.492 5.302 30 20 EKED C=C[C@](C)(CC)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 467988980 RTZPSOMFUJFEDR-GOSISDBHSA-N 337.916 5.025 30 20 EKED N#Cc1ccc(F)cc1CN(Cc1cccs1)Cc1cccs1 469248823 OFGCUQZQWUJIOZ-UHFFFAOYSA-N 342.464 5.023 30 20 EKED CC(C)Sc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476351041 BWIIJNKJGVQOFR-UHFFFAOYSA-N 338.476 5.241 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)C[C@@H](CC#N)c1ccccc1 484880385 XUQOAZZSQJJBON-HXUWFJFHSA-N 334.463 5.146 30 20 EKED CC[C@H]1C[C@@]1(NCc1cccc(OCCCC#N)c1)c1cccc(C)c1 500512201 IVEUHYNKWOKOFR-REWPJTCUSA-N 348.490 5.093 30 20 EKED CO[C@@H](CSCc1ccc(CC#N)cc1)c1ccc(Cl)cc1 509138269 NLTZANCKKILCDX-SFHVURJKSA-N 331.868 5.027 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)Cc1cccc(C#N)c1 520169764 HQJLIFXSHGFPIK-KRWDZBQOSA-N 332.472 5.383 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cc2ccccc2s1 527194543 QIBQFPSBMUBYCO-OAHLLOKOSA-N 334.488 5.553 30 20 EKED C=CCC1(C(=O)Nc2ccc(Oc3nc(C)cs3)c(F)c2)CCC1 572692673 CKVSMUVWNUWLHY-UHFFFAOYSA-N 346.427 5.068 30 20 EKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1F 574436999 ZOSILHDIASOKMA-AWEZNQCLSA-N 333.366 5.058 30 20 EKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 609375596 CLYNPZKRYBHERL-UHFFFAOYSA-N 338.476 5.242 30 20 EKED CCCC[C@H](CC)CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609435447 OOWJGOHXCAQZJA-CVEARBPZSA-N 347.528 5.419 30 20 EKED C[C@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 610323306 JKYGFILIHOEEEJ-AWEZNQCLSA-N 347.443 5.169 30 20 EKED CCC(CC)[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccccc1 727466812 JCRXBLAVQGMQGB-HSZRJFAPSA-N 349.522 5.304 30 20 EKED CC[C@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 732915849 JFBBHXGZJJXCBQ-PKTZIBPZSA-N 326.443 5.905 30 20 EKED Clc1ccc([C@H]2CCCC2=NNc2nncc3ccccc23)cc1 741453720 UNPGQEKIMLDVLA-MRXNPFEDSA-N 336.826 5.019 30 20 EKED C=CCOc1cccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741471620 CDFGZHPKPAFJPW-MDZDMXLPSA-N 341.410 5.210 30 20 EKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccsc1 749104750 NVOKIOSIEWLLBV-ALCCZGGFSA-N 341.413 5.281 30 20 EKED C/C(=C\C(C)(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772161367 IOCURHYALBSPCR-VISDOYDDSA-N 332.447 5.273 30 20 EKED C#CCC1(C(=O)Nc2cccc(COC(C)(C)C)c2C)CCCCC1 788450982 NDYPYJGCGAAVQS-UHFFFAOYSA-N 341.495 5.222 30 20 EKED CC[C@@H](NCC1CCC(C#N)CC1)c1ccc(Cl)c(Cl)c1O 799725129 DBNFHSQDWSRXNL-KOHJWAIASA-N 341.282 5.070 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cn1 903001657 WRWJGBGBYVMBFI-KSSFIOAISA-N 347.384 5.186 30 20 EKED Cc1ccc([C@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)s1 919764361 VNYLWALHVOYRJY-HNNXBMFYSA-N 346.455 5.086 30 20 EKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1cccc(-c2ccccc2)c1 1776073682 HXDUIGHIIKICOV-UHFFFAOYSA-N 348.377 5.027 30 20 EKED Cc1ccsc1C(=O)/C=C\c1c(F)ccc2sc(C(=O)O)cc12 1777477208 JKFDHPQWLQVZIN-RQOWECAXSA-N 346.404 5.005 30 20 EKED CCn1c2ccccc2c2cc(N=C(O)[C@H]3CCC(=O)[C@@H](C)C3)ccc21 328925578 WABNMBDXFTTZIV-GJZGRUSLSA-N 348.446 5.408 30 20 EKED CCn1c2ccccc2c2cc(N=C(O)[C@@H]3CCC(=O)[C@H](C)C3)ccc21 328925579 WABNMBDXFTTZIV-HUUCEWRRSA-N 348.446 5.408 30 20 EKED N#CCCC[C@@H](NCCc1c(F)cccc1Cl)c1ccccc1 433012340 JWZJYNCQSKAUGZ-LJQANCHMSA-N 330.834 5.046 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)cc1Cl 476093380 AOQRISZPGGTHGF-UHFFFAOYSA-N 341.882 5.682 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1Cc2ccccc2S1 476173312 ZZNOEVBSZNROCD-IBGZPJMESA-N 337.488 5.194 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@@H](c1ccccc1)C(C)C 481942563 GVGGRHJWZMPKPG-LJQANCHMSA-N 327.493 5.093 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2)cc1F)c1ccc(C#N)cc1 503568332 HQIJFTWLDUTKLD-INIZCTEOSA-N 330.406 5.215 30 20 EKED C=CCCC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccccc1Cl 525380447 QBCSLPPSAGXHSD-SFHVURJKSA-N 334.246 5.165 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccc(C(F)F)cc2)cc1 527233540 AEHYJZCKMGQVBA-UHFFFAOYSA-N 348.396 5.453 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 556208578 WGGCIGREEVVQNJ-AUUYWEPGSA-N 347.289 6.079 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(-c2ccc(F)cc2)s1 562034925 GWRUSKBACUBSBV-CQSZACIVSA-N 330.472 5.535 30 20 EKED CC(C)Oc1cccc([C@@H](N[C@H](C)c2ccc(C#N)cc2)C(F)F)c1 577395578 MBDJHPYECIMAOA-AUUYWEPGSA-N 344.405 5.002 30 20 EKED CC[C@@H](C)[C@H](C(=O)Nc1sc(C)c(C)c1C#N)c1ccccc1 603444843 CQXJRFWMOYRLJG-PXAZEXFGSA-N 326.465 5.005 30 20 EKED O=C(/C=C/c1cnn2ccccc12)c1cc2c(ccc3ccccc32)o1 729643836 ITTJMFRRJREUSY-CSKARUKUSA-N 338.366 5.130 30 20 EKED CCCCC1CCC(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)CC1 735792584 MRDPOSPLCUZGGC-OFLPRAFFSA-N 337.467 5.044 30 20 EKED O=C(/C=C\c1ccc2ccccc2c1)c1c(Cl)nc2ccccn12 737450313 RSVIJJNTQVWWMJ-LUAWRHEFSA-N 332.790 5.037 30 20 EKED CCCCCSc1nc2ccc(NC(=O)C(C)(C)C#N)cc2s1 741595492 ZUQQMKQBSTWXSB-UHFFFAOYSA-N 347.509 5.067 30 20 EKED C=CCOc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990649 WCBXKEYQWGNGDM-XGICHPGQSA-N 341.410 5.210 30 20 EKED N#Cc1ccc2c(c1)N(C(=O)c1c3ccccc3cc3ccccc13)CC2 758006299 MIBQRAYTRGGJTB-UHFFFAOYSA-N 348.405 5.068 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccc(OC(F)F)cc1)c1ccncc1 766018380 HCYFRSYJSMTMKI-ZWKOTPCHSA-N 332.394 5.041 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 776075565 XYTFJOMGUAIEAR-YLJYHZDGSA-N 342.442 5.070 30 20 EKED CC(=NOCCC(F)(F)F)c1ccc(SCC(F)(F)F)cc1 777459111 HFSKYWHDOFRFDZ-UHFFFAOYSA-N 345.308 5.034 30 20 EKED C#CCCCCCC(=O)N1CCCCC[C@H]1/C=C\c1cccs1 783474373 DXRJKEZPFFLPLW-OUFNUQFJSA-N 329.509 5.116 30 20 EKED C=CCC[C@@H](Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1)c1ccco1 796918614 QFLJLAVCJDGOQX-FUHIMQAGSA-N 340.467 5.013 30 20 EKED C[C@H]1/C(=C/c2ccccc2OCc2cccnc2)C(=O)c2ccccc21 809159610 SLNJZHVJQSXDPW-RDPIHGLISA-N 341.410 5.044 30 20 EKED N#Cc1ccc(C=NNc2cccc3ccccc23)c(C(F)(F)F)c1 811639977 LGAJTMYGIJOVBM-UHFFFAOYSA-N 339.320 5.176 30 20 EKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ccccc1 914555940 PKELHMCBXYMUFN-UHFFFAOYSA-N 338.842 5.095 30 20 EKED C=CCN(Cc1cccs1)C(=O)Cc1ccc(-c2ccccc2)cc1 60677809 BSPVPNUQVKVVDT-UHFFFAOYSA-N 347.483 5.172 30 20 EKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2SCCC#N)s1 153425105 BQEIDKHYCGNURV-UHFFFAOYSA-N 344.505 5.304 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C1CCCC1)C1CC1 175855221 VUKBGNMSCUJOJA-AWEZNQCLSA-N 343.496 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2cccc(C)c12 189900962 WBVSDDRNNZLHQK-UHFFFAOYSA-N 346.474 5.509 30 20 EKED N#Cc1cccc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)c1 237881960 ZKSUAAMRYFXNSM-OAQYLSRUSA-N 332.834 5.091 30 20 EKED CCc1nc(C)c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)s1 340436595 RXNYKOVNQOWYRD-PBHICJAKSA-N 327.497 5.100 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(-c2nc(C)cs2)c1 410344927 MCUDFTJFVRULLI-UHFFFAOYSA-N 348.471 5.489 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)CC(F)(F)F 417036653 HKHBOFGCSWMANC-ZDUSSCGKSA-N 342.405 5.249 30 20 EKED CC(C)(C#N)CCCCSCc1coc(-c2ccc(F)cc2)n1 435882289 SMOWJTIVROREIZ-UHFFFAOYSA-N 332.444 5.434 30 20 EKED Cc1ccc(CN(CCCCC(C)(C)C#N)Cc2ccco2)s1 444599199 QNZCEYUGBOGXDY-UHFFFAOYSA-N 330.497 5.372 30 20 EKED CC[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 447543173 REPZGOKHDLACTA-MSOLQXFVSA-N 342.895 5.489 30 20 EKED CCC(CC)[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1cccs1 463454547 AUQONLOXHQUMCQ-AUUYWEPGSA-N 340.492 5.017 30 20 EKED CC[C@@H](CC#N)NC(=O)Nc1ccc(SC2CCCCC2)cc1C 475013934 NPRIIILCZLQPFX-HNNXBMFYSA-N 345.512 5.234 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(C#N)cc1 475556526 VNBYVXOSYHAEHY-MRXNPFEDSA-N 347.462 5.293 30 20 EKED C=CCCc1ccccc1NC(=O)CCC(=O)c1cc(C)sc1C 504283532 DTJJQOIYFHDPCZ-UHFFFAOYSA-N 341.476 5.085 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2ccccc2F)o1)c1ccccc1 538257849 PJKRDDRZPWUUGB-LJQANCHMSA-N 336.410 5.278 30 20 EKED N#CCn1c(/C=C/c2cnc(C3CCCCC3)s2)nc2ccccc21 554518284 YGYDZMLNETWWCL-ZHACJKMWSA-N 348.475 5.234 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)CC2 581161254 QVUSJMRUJQSCRZ-XZOQPEGZSA-N 342.417 5.064 30 20 EKED CCCCc1oc2ccccc2c1CN(C)C(=O)CCCCCC#N 588256335 QQMWGTVTHZZGMY-UHFFFAOYSA-N 340.467 5.208 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 609970762 IBSYHNYPAZNAJE-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccccc1Oc1ccccc1Cl 642467540 WTOHDJFSZFPBPU-UHFFFAOYSA-N 342.826 5.338 30 20 EKED CC1(C)CCC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)C1 756516252 GEGDEXCHFXTDLB-HOTGVXAUSA-N 338.476 5.203 30 20 EKED C=C[C@H](CC(=O)Oc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 759910582 KOTJKNFPYRUFCJ-QGZVFWFLSA-N 347.414 5.224 30 20 EKED Cc1ccc(F)c(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)c1 763292511 PBVIJBJHRGPTJX-UITAMQMPSA-N 347.389 5.004 30 20 EKED CCCC(=CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)CCC 771282297 IRZARVIFVIMDLS-AWEZNQCLSA-N 330.428 5.138 30 20 EKED FC(F)(F)c1ccccc1ON=CCSCc1ccccc1 774392117 ABQJJQJWCIMOAA-UHFFFAOYSA-N 325.355 5.003 30 20 EKED CC1(C)CC[C@@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 781618740 YYORRPNNVXDZMD-UYAOXDASSA-N 332.447 5.107 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(SC(F)F)cc1 787026655 NFOVLBYFOFRPFE-SGTLLEGYSA-N 344.430 5.211 30 20 EKED O=C1/C(=C\c2cnc(-c3ccco3)s2)CCc2[nH]c3ccccc3c21 789147037 FROIBBIJCUKKCJ-BENRWUELSA-N 346.411 5.097 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](O)CC[C@H](C)CC 793950037 WHJOHWCTIXCUNL-SJLPKXTDSA-N 331.500 5.054 30 20 EKED Clc1cccc(C=NOCc2coc(-c3ccccc3)n2)c1Cl 821505673 RVONVUBNUQTTFK-UHFFFAOYSA-N 347.201 5.199 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2c(OC(F)F)ccc3ccccc23)cc1 916134115 BZIOLULCUONXLT-KHPPLWFESA-N 349.336 5.209 30 20 EKED Cc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)c1 1776127474 UIOZVLIGDCECNC-SDNWHVSQSA-N 342.394 5.256 30 20 EKED N#C[C@@H](C(=O)c1ccc(Cl)s1)c1nc(-c2ccccc2)cs1 78735522 PHQHUWUJJDVJNK-NSHDSACASA-N 344.848 5.015 30 20 EKED CC1(C)C[C@@H](c2ccccc2Br)Nc2ccc(C#N)cc21 91691869 BDUXCPJFSPQVAN-KRWDZBQOSA-N 341.252 5.155 30 20 EKED CCCCCCCC(=O)N(Cc1ccccn1)c1ccc(F)cc1 105345025 LXQNVXUYINNUFF-UHFFFAOYSA-N 328.431 5.114 30 20 EKED C=CCC[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C1CC1 180036220 XUYUBPPXQOLVLO-MRXNPFEDSA-N 344.842 5.342 30 20 EKED CCOc1ccc(/C=C\C(=O)c2ccc(Cl)s2)cc1OCC 207683988 GKYJIOOVEYGSNV-ALCCZGGFSA-N 336.840 5.095 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2Cl)o1)c1cccc(C#N)c1 237430183 JBIUJKXIMXZCAE-CQSZACIVSA-N 336.822 5.322 30 20 EKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nc(C2CC2)no1 329061620 JRJQNYAZELLXPB-SVGFKBNWSA-N 345.487 5.207 30 20 EKED Cc1nc2ccccc2cc1C(=O)Nc1sc(C(C)(C)C)cc1C#N 411009089 WIPHQNIDKYSGLM-UHFFFAOYSA-N 349.459 5.026 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)Cc1cc(Cl)sc1Cl 417224134 QZIGZJRMTLTOCI-LJQANCHMSA-N 338.325 5.024 30 20 EKED CC1=C(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCC1 437275510 KHEDSQJNNYNWFZ-UHFFFAOYSA-N 332.403 5.098 30 20 EKED N#CCCC[C@@H](N[C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 449341877 XCYSEQILLOTSFF-SJORKVTESA-N 344.380 5.116 30 20 EKED Cc1cc(CCCC(=O)Nc2ccc(CC#N)cc2Cl)c(C)s1 452642038 FJBLFKIFMGEZCK-UHFFFAOYSA-N 346.883 5.046 30 20 EKED N#CC1(c2ccccc2)CCC(NCc2ccc(C(F)F)cc2)CC1 462839785 KRLJUECYYBOKMO-UHFFFAOYSA-N 340.417 5.118 30 20 EKED C[C@@H](N(CCCC1(C#N)CCOCC1)Cc1ccccc1)C(C)(C)C 499631532 OWXZUCGPNPIUEB-LJQANCHMSA-N 342.527 5.024 30 20 EKED CC(C)(C#N)CCSc1ncnc2sc(-c3ccccc3)cc12 525503688 QOQOXSZZWGHYGE-UHFFFAOYSA-N 339.489 5.390 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C#N)c(Cl)c1 530402250 ZVADZGGOWIRBAD-UHFFFAOYSA-N 338.838 5.316 30 20 EKED C[C@@H](NC(=O)CCCCCC#N)c1ccc(Oc2ccccc2)cc1 588155569 LJEKWXJUGMKAOM-QGZVFWFLSA-N 336.435 5.130 30 20 EKED C[C@H]1CCCC[C@@H]1CC(=O)Nc1ccccc1S[C@H](C)CC#N 609428304 LTJUDBMYJINLRT-ARFHVFGLSA-N 330.497 5.236 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cc(Cl)ccc1OC 610829808 MYLMGYNTOZNFKA-UGSOOPFHSA-N 328.843 5.022 30 20 EKED Cc1oc(-c2ccsc2)nc1CSc1ccc(C#N)cc1Cl 611102352 BDYISEWQISNHPV-UHFFFAOYSA-N 346.864 5.529 30 20 EKED Cc1cc([C@@H](NCc2ccc(C(C)(C)C#N)cc2)C2CC2)ccc1F 614182836 JCJZFVPOUIYPMK-NRFANRHFSA-N 336.454 5.176 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)sc1Cl 618807394 UHVOCYPIEHRRFQ-XPTSAGLGSA-N 337.275 5.265 30 20 EKED CC(C)n1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cn1 732713933 OCYVJHHCHITLQT-UTCJRWHESA-N 343.641 5.320 30 20 EKED C=CC[C@H](NC(=O)CC1CCC(c2ccccc2)CC1)c1ccncc1 734458333 XQYHGQXXUIBXQQ-ZNIKRAEXSA-N 348.490 5.179 30 20 EKED Cc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)ccc1F 740013585 GWLKAFIKMOONHV-UHFFFAOYSA-N 336.435 5.024 30 20 EKED C(=NN=C1c2ccccc2-c2ccccc21)c1ccc2ccccc2n1 741461776 BIZMTDPSSFRVCO-UHFFFAOYSA-N 333.394 5.087 30 20 EKED CCSc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)cc1 755603224 CMDWCAMUGRZLIM-MDWZMJQESA-N 346.455 5.152 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1cc2c(ccc3ccccc32)o1 776154169 PYJPOGIZDGODAY-HNNXBMFYSA-N 326.399 5.308 30 20 EKED C#CC[C@H](NC(=O)Nc1c(CC=C)cccc1C(C)C)c1ccccc1 789457822 XIWVFEBKWZUTPG-NRFANRHFSA-N 346.474 5.425 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@H]2c2ccccc2)n1 835201794 ZOUUUSXQRHPEAD-GVDBMIGSSA-N 338.476 5.027 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)OC(=O)CCCCC#N)s2)cc1 847649198 DEBBOISAUVVDGU-OAHLLOKOSA-N 342.464 5.115 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1C(C)(C)C 43315502 PXSQIWKCNHCMJK-UHFFFAOYSA-N 328.481 5.266 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cccc3ccccc23)cc1OC 60833737 FKWHRLRFVNFJMG-QGZVFWFLSA-N 347.458 5.264 30 20 EKED Cc1cc(CCCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)s1 84695995 VCBKABCKTAHXAW-HNNXBMFYSA-N 346.521 5.144 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(F)c(Cl)c2)c1 110401443 YNAHODAIXLAGOF-RMKNXTFCSA-N 343.785 5.058 30 20 EKED CC(O)=Nc1ccc(C)c(/C(O)=N/[C@H]2CCCCC23CCCC3)c1 329599680 DPFZXDDWGAVTMO-SFHVURJKSA-N 328.456 5.411 30 20 EKED N#CCCC[C@H](NCc1sccc1Br)c1ccccc1 353912188 DVPUJOPXOKHWDP-HNNXBMFYSA-N 349.297 5.035 30 20 EKED CC1(C)C[C@@H](c2ccccc2)N(C(=O)C[C@H](CC#N)c2ccccc2)C1 425124264 UJCFTBIURQTZCW-SFTDATJTSA-N 346.474 5.074 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C#N)cc1Cl 426136746 BOBBOVCLDDDWAP-SFHVURJKSA-N 341.842 5.217 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(C)C)c(C)c1 438433998 HWHKFDDVPBKXKP-UHFFFAOYSA-N 338.451 5.002 30 20 EKED C=CC[C@@H](CC)NC(=O)Nc1cccc(COC(C)(C)CC)c1C 439455906 WQTIGSYIJDEAPH-QGZVFWFLSA-N 332.488 5.176 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCCc3c(Cl)sc(Cl)c32)C1 453284659 BFDGMKOSABYMEW-JBLDHEPKSA-N 329.296 5.104 30 20 EKED N#CCCCOc1cccc(NCC2CCC(C(F)(F)F)CC2)c1 466446263 PEXULUMBNNYHFD-UHFFFAOYSA-N 340.389 5.150 30 20 EKED CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCCC#N 471817681 VNEXXDYVXAALBC-GOSISDBHSA-N 349.906 5.153 30 20 EKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 474697266 KFEOXPKYIGCFPJ-OAHLLOKOSA-N 346.430 5.067 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccccc1Oc1ccccc1Cl 481586409 PMDXDCYUCLTNSZ-UHFFFAOYSA-N 330.815 5.172 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)sc2cccc(F)c12 494578829 IPGFWCSFXJQKRT-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cc1c(Cl)ccc2cccnc12 517624615 OPJDJZRKGMGNOB-UHFFFAOYSA-N 349.865 5.172 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 517752035 SWGOCNFLSQLQOH-KRWDZBQOSA-N 348.899 5.099 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 519079102 OXVPJJHXFMJBHS-AWEZNQCLSA-N 345.826 5.052 30 20 EKED C=C[C@H](CC(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 536123060 LOHLEPXPNIGCJL-OAHLLOKOSA-N 334.444 5.109 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1SC[C@H](C)C#N 541624016 NGNHWMQZBGQRTM-CABCVRRESA-N 332.513 5.339 30 20 EKED Cc1ccsc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543875517 ADWNAAOKJBWCRE-MRXNPFEDSA-N 332.472 5.446 30 20 EKED C=C[C@@H](Cc1nc(CSc2ccc(F)cc2)no1)c1ccccc1 545525185 UXDUNDXVOFZOJJ-AWEZNQCLSA-N 340.423 5.013 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 589485703 RJZVCOPYWXWEBG-UHFFFAOYSA-N 342.826 5.545 30 20 EKED N#Cc1ccc(SCc2csc(Cc3ccccc3)n2)c(F)c1 610165770 OFUILAOBJGXMTP-UHFFFAOYSA-N 340.448 5.037 30 20 EKED Cc1cc(C(=O)/C=C/c2csc(-c3cccs3)n2)c(C)s1 728439864 PWJZSLHHNOLRIY-AATRIKPKSA-N 331.487 5.446 30 20 EKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1csc2ccccc12 730019110 GBXGKCATOOBBSL-MRXNPFEDSA-N 349.503 5.102 30 20 EKED CCC(CC)[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 762033785 DXYLKIKSJTUSTL-BBRMVZONSA-N 326.465 5.059 30 20 EKED CC(=NNc1nc2cc(Cl)ccc2cc1C)C1CCSCC1 777442864 OQTDUMBXNPMHEY-UHFFFAOYSA-N 333.888 5.128 30 20 EKED CC(=NNc1ccc(C(C)(C)C)cc1)c1c(C)nn(C(C)C)c1C 779825202 OLZPFEHHPCMYNY-UHFFFAOYSA-N 326.488 5.214 30 20 EKED O=C(/C=C/c1scnc1C1CC1)c1c[nH]c2cc(Cl)ccc12 782328705 KEDZTJUVXDXHTF-AATRIKPKSA-N 328.824 5.051 30 20 EKED O=C1/C(=C/c2sccc2Cl)CCc2ncc(C(F)(F)F)cc21 782352886 XAAOPNQTXBFBSV-VMPITWQZSA-N 343.757 5.028 30 20 EKED Cc1nc(C)c(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)o1 821028733 VUGICEPDQIXZHO-WAYWQWQTSA-N 330.598 5.148 30 20 EKED CC(C)=CCC[C@H](C)CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 842803018 LOAXFLGYXRLFQT-ZFWWWQNUSA-N 338.373 5.049 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)cc1 915087523 UPJDNSBIJBYWOH-RAWXMELESA-N 344.458 5.107 30 20 EKED CCOc1ccc(/C=C\C(=O)c2cccc3ccccc23)cc1OC 916134837 JYHCNCVNMGRZRR-QBFSEMIESA-N 332.399 5.143 30 20 EKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cc1 18065490 XXBVDKYUYJDMCU-FMIVXFBMSA-N 347.439 5.270 30 20 EKED N#Cc1ccc(OCc2coc(-c3cccc(Cl)c3)n2)c(Cl)c1 26112528 LRANCHQJTIRMMR-UHFFFAOYSA-N 345.185 5.099 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1C(C)(C)C 56543316 HGNBQHOGISKDLG-UHFFFAOYSA-N 340.442 5.343 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc([N+](=O)[O-])c1 189882551 SWLFILPEKJDZHU-UHFFFAOYSA-N 338.407 5.007 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc(C)cc1 195565369 VPMGLHDLGXRMEU-CQSZACIVSA-N 348.899 5.169 30 20 EKED CC[C@H](c1ccc(F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303767066 PYAJLHPJNBVLKT-GFCCVEGCSA-N 343.286 5.094 30 20 EKED C[C@H]1C(=O)CC[C@@H](C(O)=Nc2ccc3c(Cl)cccc3n2)C1(C)C 329335988 XWSMIDCTJNVLQX-AAEUAGOBSA-N 344.842 5.118 30 20 EKED C=CCCc1ccccc1NC(=O)C1(c2ccc(Cl)cc2)CC1 410376512 WKLJNOZNGHKGNT-UHFFFAOYSA-N 325.839 5.129 30 20 EKED CC(C)CNC(=O)c1cccc(CSCCCCC(C)(C)C#N)c1 435887568 CFXJIVUVCOXCEU-UHFFFAOYSA-N 346.540 5.026 30 20 EKED C[C@@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1 443155555 QGMYDNVUMAFSSB-CHWSQXEVSA-N 344.867 5.033 30 20 EKED CCCN(Cc1ccccc1)C(=O)N[C@H](CCCC#N)c1ccccc1 458793934 AEJFKICNZKHCEF-OAQYLSRUSA-N 349.478 5.043 30 20 EKED CC[C@]1(C)CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 467569509 QOGDYLMDBKMMDI-OAQYLSRUSA-N 349.434 5.004 30 20 EKED N#C[C@@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nccc2ccccc12 483202164 ORRUGVQHFTZNKV-MRXNPFEDSA-N 346.773 5.124 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccc(CC#N)cc1 488865090 SPLAHPJTPMPVIF-UPCLLVRISA-N 339.504 5.060 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(COC(C)(C)C)c1C 666255835 AFLANCKZHQRLBF-HDICACEKSA-N 342.483 5.025 30 20 EKED C#CC[C@@H](OC(=O)C[C@H](C)c1ccc(C(C)C)cc1)c1ccccn1 739171240 YVUBFGUBIBKYGI-LAUBAEHRSA-N 335.447 5.006 30 20 EKED CCCC[C@@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccccc1 746046575 AGKGJKVKDRVYEF-IFMALSPDSA-N 336.479 5.389 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(C)c(C)cc2C)c1 772981736 ABBJOYQHGJZUPV-ICSRJNTNSA-N 336.479 5.144 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ccsc1 789719983 SLOQBZSWHURYJP-UHFFFAOYSA-N 327.493 5.561 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccccc1 792774470 APQIOCNVNNKIFO-NRFANRHFSA-N 340.426 5.380 30 20 EKED C=CCC[C@H](Nc1ccc(N2CCSCC2)c(C)c1)c1ccco1 796915375 CEKSBZSVIVYVIQ-SFHVURJKSA-N 342.508 5.261 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C#Cc1ccc(CC)cc1 816444191 GHWLYBKHDKVFPI-UHFFFAOYSA-N 331.459 5.091 30 20 EKED N#CC1(CCCC[S@@](=O)Cc2cc(Cl)ccc2Cl)CCC1 899392741 VMTWOMUDDZLUAT-OAQYLSRUSA-N 344.307 5.106 30 20 EKED N#CCc1ccc(NC(=O)N[C@@H](c2ccccc2)C2CCCCC2)cc1 915330061 AIFHAUHEJPUEKK-NRFANRHFSA-N 347.462 5.196 30 20 EKED N#Cc1ccc(Oc2ncnc3scc(-c4ccccc4)c23)cc1 15175243 OXUNTFOZHDWEHW-UHFFFAOYSA-N 329.384 5.022 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(C)s1 65680348 WJVNZWFWJWMVKE-UHFFFAOYSA-N 348.427 5.281 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccccc1OC(F)F 172906195 RKYICCZNDDKEKW-CYBMUJFWSA-N 348.418 5.152 30 20 EKED CCCCCCCCCCNc1ncnc2sc(C(=O)O)c(C)c12 325271661 ASBUMTFNARZSTB-UHFFFAOYSA-N 349.500 5.251 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(C2=CCCC2)cc1)c1ccccc1 352199060 UJJGWBOEPMMXFM-JOCHJYFZSA-N 344.458 5.419 30 20 EKED C[C@H]1C[C@@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccsc2S1 417375077 YZLJTHUGSVFIOQ-JBBXEZCESA-N 340.517 5.212 30 20 EKED Cc1cc2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2[nH]1 432788216 XDLKCBCHXJCRGF-IBGZPJMESA-N 346.434 5.033 30 20 EKED N#CCCC[C@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 433015948 ZOGLOISCINYPNI-FQEVSTJZSA-N 349.409 5.005 30 20 EKED C[C@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(C#N)cc1F 482066757 NOYCCQJXNSLXPP-YHBQKQJXSA-N 346.808 5.029 30 20 EKED CCn1c(-c2cccc(OCCCC#N)c2)nc2cc(Cl)ccc21 524218301 ZQDQTVSHYWHJTQ-UHFFFAOYSA-N 339.826 5.059 30 20 EKED N#CCC[C@@H](N[C@@H]1CCc2c(Cl)cc(Cl)cc21)c1ccccc1 537946752 RXYWDCLQWDQNEE-RTBURBONSA-N 345.273 5.615 30 20 EKED C[C@H](Nc1ccc(CN2CCCC[C@H]2C)cc1)c1cccc(C#N)c1 538500311 WTYJXIOPNJSMIC-MSOLQXFVSA-N 333.479 5.106 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccc(Cl)c2)C2CCCC2)s1 540622047 CKRRIDTZOBNMGH-GOSISDBHSA-N 330.884 5.294 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1C(C)C 548479326 WHHQJGYHBCHZHX-UHFFFAOYSA-N 348.899 5.745 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1F)c1nc2ccccc2n1C(F)F 556338099 GLLSEGYQLDRIJO-SNVBAGLBSA-N 347.365 5.295 30 20 EKED N#CCCC1CCN(C(=O)C2(C3CCCCC3)CCCCC2)CC1 583382846 NOZHGUBIMRAZFB-UHFFFAOYSA-N 330.516 5.060 30 20 EKED Cc1cc(C)c(CNc2ccccc2S[C@@H](C)CC#N)c(C)n1 601920773 KNHHHKWWMVMDMF-HNNXBMFYSA-N 325.481 5.013 30 20 EKED N#Cc1cc(CN[C@H](c2cccc(Cl)c2)C2CCCCC2)ccn1 610956824 MFJOKLFHCUUFDU-FQEVSTJZSA-N 339.870 5.018 30 20 EKED C=C(C)[C@@H]1CC=C(C)C(=NNc2ncnc3sc(C)c(C)c23)C1 725789087 ZRQHILDIZZZBIB-CQSZACIVSA-N 326.469 5.008 30 20 EKED Clc1ccc(C=NOCc2ncc(-c3cccc(Cl)c3)o2)cc1 727433363 UVQMERNLOWVWSQ-UHFFFAOYSA-N 347.201 5.199 30 20 EKED CC(=NNc1ccc(C(F)(F)F)cn1)c1cccc(Cl)c1Cl 734977396 QFOZXDFTULBEDH-UHFFFAOYSA-N 348.155 5.243 30 20 EKED C#CCCOc1ccc(CNc2ccc(COC3CCCC3)cc2)cc1 740016617 PQOUSKQBIYYONR-UHFFFAOYSA-N 349.474 5.160 30 20 EKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H](C)C(C)C 743294581 PJYPQUHSJNVRQL-DYESRHJHSA-N 349.478 5.240 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3c(F)cccc3s2)n1 747197167 BAOHOXNQGFMJRY-NSHDSACASA-N 344.436 5.110 30 20 EKED CCC(CC)CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 759550845 FAIKCNVCSNVQGV-LBPRGKRZSA-N 348.418 5.091 30 20 EKED CC(C)c1ccc2c(c1)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)CCC2 762625748 PVTAJCBPBSPWHS-GAJHUEQPSA-N 348.490 5.268 30 20 EKED CCCCCCCCCC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 765328983 VJBMNSHGGZYLQC-PMACEKPBSA-N 331.500 5.164 30 20 EKED CC(C)[C@@H]1/C(=C\c2csc(-c3ccccn3)n2)C(=O)c2ccccc21 766507725 XAHUJNOJDHIHGN-OXRZLYTFSA-N 346.455 5.225 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)c(COC)c1)c1ccccc1 773074407 FYKFVXKBALFSIA-LAUBAEHRSA-N 339.479 5.200 30 20 EKED C[C@@H](Nc1cc(F)c(OC(C)(C)C)c(F)c1)c1cccc(C#N)c1 782784387 UPAMDZOZUDCLEM-GFCCVEGCSA-N 330.378 5.187 30 20 EKED C=CC[C@H](NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21)c1ccncc1 783559845 GVBBMTPKXFQDEY-NYVOZVTQSA-N 348.490 5.132 30 20 EKED CC(C)C[C@@H](C)N(C(=O)CCCCCC#N)c1ccc2[nH]ccc2c1 808342964 BFNLRBCKIIWZBH-QGZVFWFLSA-N 339.483 5.410 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3c(F)cccc3Cl)co2)cc1 809159185 KDGABIVHMTVBGF-MDZDMXLPSA-N 341.769 5.339 30 20 EKED CCCCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351887 HMXOUJCXRAQWHE-FQEVSTJZSA-N 335.451 5.044 30 20 EKED CCCCCCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917045407 ZESJZFDVONNPSC-CYBMUJFWSA-N 334.872 5.486 30 20 EKED O=C(/C=C/c1ccsc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605600 XMYDURBWEOYKQU-AATRIKPKSA-N 341.413 5.281 30 20 EKED COc1ccc2ccccc2c1CNc1cccc(OCCCC#N)c1 237334565 OASPXEDGCXMTHV-UHFFFAOYSA-N 346.430 5.143 30 20 EKED CC(C)[C@@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 303156892 GKTTYMBCZYADSK-HXUWFJFHSA-N 334.463 5.256 30 20 EKED C=CCN(C)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 429347273 WQRSFFPDBWFSHQ-HNNXBMFYSA-N 326.465 5.190 30 20 EKED C[C@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 429755701 HXHUANROCSPLGV-YJBOKZPZSA-N 349.434 5.003 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC(C)(C)C1 443606419 XPJVWDODMCPUHS-CABCVRRESA-N 345.512 5.029 30 20 EKED CC(C)(C)C[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462720322 WLVPPOVOGPTDBR-LJQANCHMSA-N 326.871 5.479 30 20 EKED CCN(CCC#N)[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 471195890 VWYOGRSFJZYPBE-SNVBAGLBSA-N 338.295 5.021 30 20 EKED C=CCCc1ccccc1NC(=O)N1Cc2cccc(Cl)c2C1 483123066 ZRYCVTOQVCSNDP-UHFFFAOYSA-N 326.827 5.006 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2ccccc2Cl)cc1 504380919 HWPAOXXELMALMM-UHFFFAOYSA-N 340.854 5.057 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(OC)cc1 505011199 RNTLDVWJULXMAR-INIZCTEOSA-N 338.451 5.039 30 20 EKED Cc1ccc([C@H]2CCCN2Cc2cccc(OCCCC#N)c2)s1 513478399 CYCICRJTNMBODJ-LJQANCHMSA-N 340.492 5.076 30 20 EKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(Cl)c1 540347510 WZHGMTDVAKISBJ-LJQANCHMSA-N 326.871 5.382 30 20 EKED C=C[C@@H](CC(=O)N1CC(C)(C)[C@@H]1c1cccs1)c1ccccc1 564003808 NSDJLDQRFWKUOO-KXBFYZLASA-N 325.477 5.018 30 20 EKED C=CCC1(C(=O)Nc2ccc(N3CCCCCC3)cc2C)CCC1 568792053 JAYWEARABZNHDA-UHFFFAOYSA-N 326.484 5.060 30 20 EKED CCCC(C)(C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609712586 VBNPQJCGZOGPOM-UHFFFAOYSA-N 337.423 5.051 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2cc(Cl)ccc2o1 618807381 UGXWZDBXPXOLRO-KPZWWZAWSA-N 336.822 5.296 30 20 EKED CSc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cc1 727264580 SNGVIWAULBONBC-VAWYXSNFSA-N 337.469 5.428 30 20 EKED C=CCCCCCN(C)C(=S)Nc1c(Cl)ccc(C)c1Cl 739460428 SSEIRRASLKHBJM-UHFFFAOYSA-N 345.339 5.677 30 20 EKED C[C@H](Nc1ccc(F)cc1C(C)(F)F)c1ccc(OCC#N)cc1 866604517 XFHBWNTYEVWGNE-LBPRGKRZSA-N 334.341 5.013 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C=C1CCCC1 919896043 ULFWFCGNIZLAFH-UHFFFAOYSA-N 332.403 5.098 30 20 EKED CC(C)c1cc(Cl)ccc1NC(=O)N(C)Cc1cc(C#N)cs1 932025240 XXTBTSZVCQGEAX-UHFFFAOYSA-N 347.871 5.060 30 20 EKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc4ccccc4o3)c2c1 1777685581 NSLSGQOLTITTOO-ALCCZGGFSA-N 348.379 5.242 30 20 EKED COc1ccc2oc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)c(C)c2c1 154335791 CRWFXPVPSVJCTL-LSDHHAIUSA-N 334.419 5.033 30 20 EKED N#CCCSc1ccccc1NC(=O)c1ccc(C2CCC2)cc1 191475816 HDDDICLFVOOXAI-UHFFFAOYSA-N 336.460 5.212 30 20 EKED Cc1sc2ncnc(S[C@@H](C)c3ccc(C#N)cc3)c2c1C 303741433 ZFPQGUPXAFCHPY-LBPRGKRZSA-N 325.462 5.033 30 20 EKED Cc1ccc(-c2nc(N=C(O)[C@H]3CCC(=O)[C@H](C)C3)sc2C)s1 329006689 XWRXHXOSMFJIOA-SKDRFNHKSA-N 348.493 5.082 30 20 EKED C=CCC[C@H](NCc1cnc(-c2ccncc2)s1)c1ccccc1 344863683 YWNJLAOZXCMFJA-IBGZPJMESA-N 335.476 5.002 30 20 EKED CC(C)CCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CCCC1 444399935 XRDPIEYZDBNNFG-UHFFFAOYSA-N 341.499 5.310 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C)s1 464473612 URCFIXYTVPVGHX-UHFFFAOYSA-N 327.493 5.480 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)=O)cc1F 476090290 KGPGHAXMYRWTBA-UHFFFAOYSA-N 339.410 5.133 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 509820829 RMZGLTKGFIRVSS-GOSISDBHSA-N 328.799 5.011 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 533496404 JEBNXCWFVPTOPJ-HXUWFJFHSA-N 332.472 5.550 30 20 EKED C=CCCC[C@@H](C)NC(=O)N(Cc1cccs1)Cc1cccs1 540490956 JKLROIOSQGDXRK-OAHLLOKOSA-N 348.537 5.266 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3ccccc3)o2)n1 541405929 HVTVHPQMRHGOPN-CQSZACIVSA-N 336.416 5.017 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)C1CC1 564087644 CEKDSPMJXRMVOC-UHFFFAOYSA-N 334.419 5.034 30 20 EKED Cc1oc(C(C)C)cc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 569149151 KVXZNUZHHYJGDU-UHFFFAOYSA-N 330.453 5.194 30 20 EKED N#CCCCOc1cccc(N[C@@H](c2cccnc2)C2CCCCC2)c1 593708028 MCMZORDZGFOUDK-JOCHJYFZSA-N 349.478 5.498 30 20 EKED N#CC1(c2ccc(-c3cccc(C(F)F)c3F)cc2)CCOCC1 600851256 XFMCNMPCLOADCN-UHFFFAOYSA-N 331.337 5.002 30 20 EKED FC(F)Oc1cccc(Cl)c1C=NNc1cccc2ccccc12 732924711 FJWPLSVEIMCVJH-UHFFFAOYSA-N 346.764 5.541 30 20 EKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H](C)C(C)C 743294582 PJYPQUHSJNVRQL-LAUBAEHRSA-N 349.478 5.240 30 20 EKED CC(C)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1 745989830 BXWLHSUSDIVIKZ-LFYBBSHMSA-N 343.426 5.432 30 20 EKED Cc1c(C(=O)/C=C/C=C\c2ccccc2[N+](=O)[O-])oc2ccccc12 750901979 HDEIYPZHYPKKGD-OOICBWJJSA-N 333.343 5.102 30 20 EKED CC(=C/c1ccc(Cl)cc1)/C=C/C(=O)c1ccc(OCC#N)cc1 753714781 POTIPAUFODGPJH-OIUMKKOASA-N 337.806 5.085 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(SC(F)F)cc1 766349903 KPGCGVOSRCZCMT-STQMWFEESA-N 332.419 5.285 30 20 EKED C[C@H](CCc1ccc(Cl)s1)Nc1ccccc1O[C@H](C)C#N 780744645 LSZJHBRVMTYZJE-CHWSQXEVSA-N 334.872 5.126 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1nc2ccccc2s1 796752805 JHFHWNUCUTZCBB-KLHDSHLOSA-N 338.476 5.079 30 20 EKED N#CCC[C@H](NCc1csc(-c2cccs2)n1)c1ccccc1 130417166 YVLCIPSXEOOSOD-INIZCTEOSA-N 339.489 5.006 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccc(C#N)cc1 303114178 CPAHRPXGWCTBME-IZZDOVSWSA-N 348.402 5.025 30 20 EKED CSc1cc(/C(O)=N/[C@@H]2CC23CCCCC3)ccc1N=C(C)O 329128333 VIFIAKNFMISRFR-MRXNPFEDSA-N 332.469 5.044 30 20 EKED C=CCC(C)(C)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 426583172 CWCAUWSBFVZHMY-GFCCVEGCSA-N 328.309 5.001 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(OC(F)(F)F)c1)c1ccc(C#N)cc1 447586625 OLZYLOGYYCIAHH-SCLBCKFNSA-N 348.368 5.259 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H](C)[C@H]1C 475572866 ZZNZKGYQCXQNDM-BRWVUGGUSA-N 328.500 5.437 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(CC[C@@H](C)C2)C1 475578076 LLECFNRGLGMFLO-VGOFRKELSA-N 340.511 5.583 30 20 EKED Cc1ccc([C@@H]2CCCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1 476120977 MXOWWLZEJWAZJA-YADHBBJMSA-N 346.474 5.136 30 20 EKED CC(C)(C#N)CCCSCc1ccccc1OCC(F)(F)F 480404418 XFBQXRZEXQODLC-UHFFFAOYSA-N 331.403 5.191 30 20 EKED C[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 480810749 KRBKOGGZPNXMHG-MRXNPFEDSA-N 349.434 5.004 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc2ccccc2o1 510211130 RRMWYKQDCRFZOM-UHFFFAOYSA-N 343.411 5.054 30 20 EKED CCCN(CC1CC1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510668645 RUCJYLDLHGWLMW-UHFFFAOYSA-N 349.434 5.004 30 20 EKED N#Cc1ccc(SCc2nc(-c3cccc4ccccc34)no2)cc1 518341591 RLTUDLGWIDGWRY-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C=CCC[C@@H](NCc1ncccc1C)c1ccc(C(F)(F)F)cc1 540433404 PZTYSMGXGKNDPV-QGZVFWFLSA-N 334.385 5.206 30 20 EKED CSc1ccccc1C[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 556202894 UDUJAVZVQGHTJJ-XLIONFOSSA-N 338.520 5.364 30 20 EKED C=CCC[C@@H](NCc1ccc(Oc2ccccc2)nn1)c1ccccc1 561160523 HPAUUPDVWGIHJU-OAQYLSRUSA-N 345.446 5.066 30 20 EKED C[C@H](SCCCOCCc1ccccc1)c1ccc(C#N)cc1 565506268 WQZRYHFBBZMICN-KRWDZBQOSA-N 325.477 5.002 30 20 EKED CC(C)(C#N)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 590121750 VLMCNHNXSACKBU-NRFANRHFSA-N 331.463 5.013 30 20 EKED Cc1nc(-c2cccc(N[C@@H]3CCCc4cc(C#N)ccc43)c2)oc1C 611475773 LAHSWORLTYGWCX-OAQYLSRUSA-N 343.430 5.320 30 20 EKED CC(C)C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccs1 614183664 AOLLOIZZCRLBDS-GOSISDBHSA-N 326.509 5.426 30 20 EKED C[C@H](CCNC(=O)c1c(Cl)cc(C#N)cc1Cl)CC(C)(C)C 615491049 NSLDHOAKXMUZIR-LLVKDONJSA-N 341.282 5.057 30 20 EKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c(Cl)c1 741472111 FRNDBBSGSCELTR-VURMDHGXSA-N 349.817 5.307 30 20 EKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 779825179 MQAGRABHYWODGC-SFHVURJKSA-N 339.504 5.422 30 20 EKED C[C@H]1CC(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C[C@H](C)C1 780311330 AOPLIFCSCZHACZ-CKEIUWERSA-N 338.476 5.059 30 20 EKED C#CCCCCCC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 780398982 URMWHHVYYVSCOI-SFHVURJKSA-N 334.463 5.382 30 20 EKED CC(C)C[C@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792095625 WBHGPSURYSYZPF-SFTDATJTSA-N 342.442 5.241 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nc3ccccc3s2)CCC(F)(F)CC1 850739755 NXKRLHMPEJYVLT-LBPRGKRZSA-N 348.418 5.078 30 20 EKED C=CCN(C(=O)Nc1ccc(Sc2nc(C)cs2)cc1)C(C)C 920061572 ZFWOXYKZILDCGP-UHFFFAOYSA-N 347.509 5.031 30 20 EKED CC(=NNc1ccccc1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776032797 UIKGLBFTUNJUMI-UHFFFAOYSA-N 346.386 5.013 30 20 EKED Cc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cc1C(=O)O 1776131213 LAYFHGNVWXCLFY-NTEUORMPSA-N 342.394 5.256 30 20 EKED C=C(C)CN(CC)C(=O)c1cc(-c2cccs2)nc2ccccc12 24457677 ILLURGMWHINTAL-UHFFFAOYSA-N 336.460 5.002 30 20 EKED N#C[C@H](C(=O)CCCc1ccccc1)c1nc(-c2ccccc2)cs1 51534060 QTZWDMBEZMUFOM-GOSISDBHSA-N 346.455 5.009 30 20 EKED C=C[C@H](CC(=O)Nc1ccccc1CC(F)(F)F)c1ccccc1 136023083 SGMFUFXUNVVVAJ-CQSZACIVSA-N 333.353 5.090 30 20 EKED CCC(C)(C)C1CCC2(CC1)C[C@@H]2/C(O)=N/[C@@H]1CCC(O)=N[C@H]1C 329113124 RSGRIJAMJCIXOL-PAMUITKKSA-N 334.504 5.083 30 20 EKED CCCCCCCCCC(=O)N1CCC(c2ccc(O)cc2)CC1 392171572 LEVPDMSSALOERN-UHFFFAOYSA-N 331.500 5.239 30 20 EKED C[C@@H](SCCC#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 413014991 RICUQIFYDUKKNF-SECBINFHSA-N 327.236 5.356 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 431870366 SXIDSTLBXSLFAN-UHFFFAOYSA-N 336.778 5.032 30 20 EKED N#Cc1ccc(CC(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 471437307 RYXGGBSEUNYGOL-UHFFFAOYSA-N 346.817 5.060 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 476688128 LDJCVMDAFWJHPK-ZDUSSCGKSA-N 348.780 5.304 30 20 EKED Cc1ccc(-c2ccc(OCCCC3(C#N)CCOCC3)cc2)cc1 499907334 JVOIVOWDFVXQOH-UHFFFAOYSA-N 335.447 5.141 30 20 EKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)c2cccc(CC#N)c2)cc1 502699391 RNWFAQNVSAQETR-NRFANRHFSA-N 346.474 5.027 30 20 EKED C[C@@H]1C[C@@]1(NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 503441340 ZQEYBSVRCRUDQV-VFNWGFHPSA-N 338.882 5.166 30 20 EKED CC1(C#N)CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 507718310 JHWICMAPTTVSNH-UHFFFAOYSA-N 330.884 5.194 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(Oc2ccncc2)cc1)c1ccccc1 536099030 PTTZBFHHUIBOEI-KRWDZBQOSA-N 344.414 5.172 30 20 EKED CCOc1ccccc1[C@@H](CC(C)C)NCc1ccc(CC#N)cc1 542252145 BMMHSNJCWHJLMZ-OAQYLSRUSA-N 336.479 5.028 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@@H](C)c1cccc(C#N)c1 588954982 QCDMGUJZXSIWCG-YCRPNKLZSA-N 329.447 5.076 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1c(F)cccc1Cl 611394315 CDNQKBABEFFHIE-KZULUSFZSA-N 328.818 5.079 30 20 EKED C=C[C@H](CC(=O)N1CCCC[C@H]1c1ccccc1OC)c1ccccc1 677541092 NEDYDCHGLIBWPY-NQIIRXRSSA-N 349.474 5.109 30 20 EKED CC[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)C 729316065 HGVQGLIBEHGQDL-UWJYYQICSA-N 334.463 5.353 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)C1CCCCC1 730420150 AKIDYTQDRQFLMU-DOMZBBRYSA-N 344.455 5.218 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2ccccc2s1 733679581 BLLCRHDMMHUQEX-HOTGVXAUSA-N 340.492 5.469 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@@H](C)C3)n2)cc1 744034356 HCAIYEUDEXNAPY-DJIMGWMZSA-N 338.476 5.121 30 20 EKED O=C1/C(=C\c2ccc(-c3ccncc3)cc2F)CCc2sccc21 751534125 HDGKYXUMYABAGT-WJDWOHSUSA-N 335.403 5.162 30 20 EKED C=CC[C@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccncc1 766019864 NMLWVVKPCXIRIB-IRXDYDNUSA-N 330.884 5.179 30 20 EKED CC[C@H](NCc1cc(C#N)ccc1F)c1ccc2cc(OC)ccc2c1 773029035 ACNYJSMIWYFTSP-QFIPXVFZSA-N 348.421 5.100 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1ccncc1 776158459 UGLCCMPPOJTRGK-CXAGYDPISA-N 326.827 5.449 30 20 EKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1cc2ccccc2s1 780188976 SPYMLTPOZCKLPM-CMDGGOBGSA-N 348.452 5.316 30 20 EKED CCCCCOc1ccc(C(C)=NNc2nncc3ccccc23)cc1 915910021 ZRXHZAAALKDKQV-UHFFFAOYSA-N 348.450 5.035 30 20 EKED CCCCc1nc(CON=Cc2ccccc2C(F)(F)F)cs1 920399286 PRNVKNLFIMRVKU-UHFFFAOYSA-N 342.386 5.055 30 20 EKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 64532909 ZQVNWGRMBARWLU-IBGZPJMESA-N 349.434 5.003 30 20 EKED CC(C)(C#N)CCCSc1nc(C(F)(F)F)nc2ccccc12 177210253 YGOLYMIGBQHFRM-UHFFFAOYSA-N 339.386 5.071 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 191432273 RGTLHWMQMYINIW-VGSWGCGISA-N 348.490 5.763 30 20 EKED OC(=Nc1cc(C(F)(F)F)cnc1O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329026670 VRYYLGLIKLMVMZ-CYZMBNFOSA-N 342.361 5.001 30 20 EKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 364721672 LLSSPDCVGUDAQD-HXUWFJFHSA-N 347.462 5.165 30 20 EKED CC(C)(c1ccc(NCc2cccc(C#N)c2F)cc1)C(F)(F)F 432338908 GUGUVKHHMZHRDA-UHFFFAOYSA-N 336.332 5.149 30 20 EKED N#C[C@H](NC(=O)CCCC1CCCC1)c1cccc(Cl)c1Cl 463745751 OHOBEJJFLGXJFG-HNNXBMFYSA-N 339.266 5.035 30 20 EKED CC(C)CN(CC(C)(C)C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 474751206 QAVLPIVKHQODQH-UHFFFAOYSA-N 329.488 5.024 30 20 EKED C[C@H](SCCCOc1cccc(C#N)c1)c1ncc(C(C)(C)C)o1 477345554 APAIUFMPIMGGHW-AWEZNQCLSA-N 344.480 5.107 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)c(OC(C)C)c1 489548285 GCKIFHUXYNMWIX-UHFFFAOYSA-N 344.480 5.064 30 20 EKED CCCC1CCC(N(CCCC2(C#N)CCOCC2)C(C)C)CC1 499525245 XYKXBUOTPXVVEO-UHFFFAOYSA-N 334.548 5.156 30 20 EKED C[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)c(F)c1 539607228 DIZXJSUWPLDNMR-QGHHPUGFSA-N 349.236 5.342 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 574603008 KKMMNYBBYNIRON-CQSZACIVSA-N 335.781 5.576 30 20 EKED N#CCCCCCC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 588273885 CJOOBKIPXYJWBO-UHFFFAOYSA-N 349.459 5.376 30 20 EKED C=CCN(Cc1cccs1)C(=O)C[C@@H](CC)c1ccc(C)cc1 606163299 QVEAMSDFRKDZLC-QGZVFWFLSA-N 327.493 5.155 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(-c2ccccc2)s1 728700043 LFFXATMFLTWNDO-CMDGGOBGSA-N 325.820 5.360 30 20 EKED CCCCc1ccc(NC(=S)N(CCC#N)CC(CC)CC)cc1 729642995 XLNOOMJUQWGWLZ-UHFFFAOYSA-N 345.556 5.378 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cn1 732714703 XAFFXPUXKYZLAZ-FPYGCLRLSA-N 340.423 5.228 30 20 EKED C=CCSc1ccccc1NC(=O)CS[C@@H](C)c1cccs1 737403127 VLDDILNXMCKTLF-ZDUSSCGKSA-N 349.546 5.459 30 20 EKED CSc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1 741473191 NWTVWPYMDIOZHI-YFHOEESVSA-N 331.440 5.367 30 20 EKED N#Cc1ccc(/C=C2/CCSc3ccc(Cl)cc3C2=O)s1 749006252 SQJOMSUFLPHODZ-YFHOEESVSA-N 331.849 5.035 30 20 EKED CSc1ccc(C(=O)/C=C\c2coc(-c3ccccc3)n2)cc1F 749893319 GGOVPJBTMBEZHR-HJWRWDBZSA-N 339.391 5.099 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CC/C=C\c2ccccc2)s1 797566295 FLBRDMYJSFLAKW-MRDWYFFCSA-N 338.476 5.110 30 20 EKED Cc1nn(C(C)C)cc1/C=C\C(=O)c1cc2cc(Cl)ccc2o1 798369347 FFQJDOBHJRXJKA-XQRVVYSFSA-N 328.799 5.068 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)cc1 915087522 UPJDNSBIJBYWOH-IBHRTIHJSA-N 344.458 5.107 30 20 EKED CCOc1cc(/C=C2\C(=O)c3ccccc3C2(C)C)cc(Cl)c1O 920070419 SJBQZTGSIIMYPT-OQLLNIDSSA-N 342.822 5.002 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccccc1OC(F)F 172907481 NSCSCDOVXILTMN-ZDUSSCGKSA-N 348.418 5.294 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1Cc2cc(C)c(C)cc2O1 189871989 ZXVVMPIEZKGXCG-NRFANRHFSA-N 349.474 5.098 30 20 EKED N#Cc1c(Cl)nsc1N[C@@H](c1ccccc1)c1cccc(F)c1 301596645 GJTSVCSNVVHNAR-HNNXBMFYSA-N 343.814 5.009 30 20 EKED N#CCSc1cccc(/C(O)=N/[C@@H]2CCCCC23CCCC3)c1 329603277 GFLJUMOWOFVZKA-QGZVFWFLSA-N 328.481 5.110 30 20 EKED C=CCCc1ccccc1NC(=O)CC1CCC(C(F)(F)F)CC1 410356868 YLYDOEHYBUYXKX-UHFFFAOYSA-N 339.401 5.503 30 20 EKED Cc1ccc(C)c2c(C)c(C(=O)N[C@@H](CCC#N)c3ccccc3)oc12 439659295 SJPLHHMOVXFKKV-SFHVURJKSA-N 346.430 5.133 30 20 EKED CC[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 457489833 MFEPNZZTTGUNEN-NHCUHLMSSA-N 349.478 5.181 30 20 EKED N#CCCCCN[C@H](CCSc1ccccc1)c1ccc(F)cc1 482460945 RGGUCQVWZOKFBL-HXUWFJFHSA-N 342.483 5.333 30 20 EKED N#Cc1cc(F)ccc1CSc1ncc(C(F)(F)F)cc1Cl 483066427 FXJLCFIBFIABMD-UHFFFAOYSA-N 346.736 5.057 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(CC#N)c2)c(C)c1 498486698 SZDUAIDHDNLRCT-OAHLLOKOSA-N 338.476 5.204 30 20 EKED CC[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1OC(F)F 498812702 FTGZRIBZKVJEOO-CQSZACIVSA-N 338.304 5.001 30 20 EKED CCN(C(=O)c1cc(Cl)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 509607827 YTDMWYPHZARDKB-GFCCVEGCSA-N 347.245 5.088 30 20 EKED C=CCOc1ccccc1C(=O)Nc1cc(C(F)F)ccc1Cl 566381640 VUKWAZAYPRKDAA-UHFFFAOYSA-N 337.753 5.095 30 20 EKED COc1cccc2c1CCC[C@@H]2N[C@H](CCCC#N)c1ccccc1 581205750 OULAMKCBJNZUSC-RTWAWAEBSA-N 334.463 5.097 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 611390435 AKZOPOGJXPBBTH-IERDGZPVSA-N 334.463 5.074 30 20 EKED C=C(C)[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(F)c1 614160411 UEOFDASXJAQUQK-RTWAWAEBSA-N 338.401 5.121 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1ccccc1Cl 727263954 KVKFGWFZRNGSMX-ZHACJKMWSA-N 325.820 5.360 30 20 EKED C#CCCOc1ccc(CN[C@@H](C)c2ccc(SCC)cc2)cc1 733327071 NEOPRRXRAQHVCS-KRWDZBQOSA-N 339.504 5.052 30 20 EKED N#CCOc1ccc(Cl)cc1COc1ccccc1-c1ccccc1 735304661 MFXPMAOUWRVRJT-UHFFFAOYSA-N 349.817 5.488 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cccc(C#N)c2)cc1 741468336 FEKVXZBKBARDQO-ZROIWOOFSA-N 339.394 5.130 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@@H](C)c1cccc(C#N)c1 743709219 UGWKAOYSJARPHD-KRWDZBQOSA-N 329.488 5.011 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(C#N)s2)ccc1Oc1cccnc1 762443881 SUBGSZJBDJAVLF-QPJJXVBHSA-N 346.411 5.012 30 20 EKED N#CCC1CCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 781801555 ADUGDBPPBWYHJC-UHFFFAOYSA-N 347.422 5.260 30 20 EKED C=C(C)[C@@H](N[C@@H](CC)c1ccc(C)cc1O)c1ccc(F)c(F)c1 794815805 PNIMYKGIIYPKSF-AZUAARDMSA-N 331.406 5.337 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CC2CC(c3ccccc3)C2)n1 798838576 PKZKIWGWINHJSY-PREGVCBESA-N 338.476 5.027 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H]2CC(C)(C)CCc3ccccc32)cc1 799345216 VTAMXOUVRGMYTN-HTAPYJJXSA-N 348.490 5.171 30 20 EKED C[C@H](C=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CCC#N 814948752 DCYVQKKMWNCXQQ-VIFPVBQESA-N 337.267 5.062 30 20 EKED N#CCCC[C@@H](NCc1cc2c(Cl)nccc2o1)c1ccccc1 877550607 ZIBNVZMPLCPAFT-QGZVFWFLSA-N 339.826 5.006 30 20 EKED CCCC(=O)Nc1cccc(N[C@H](CC)c2cccc(C#N)c2)c1C 902905753 QOBZFEGQNHSQBY-GOSISDBHSA-N 335.451 5.169 30 20 EKED CC(C)(C)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776272510 RPVURYBWMODBRX-GHRIWEEISA-N 348.442 5.285 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776697223 BIUVXIAZZNKXJG-HHQWOOOKSA-N 342.822 5.448 30 20 EKED Cc1ccc(Oc2ccccc2NC(=O)c2cccc(CC#N)c2)cc1 42229355 AWTOWXQLFATRDY-UHFFFAOYSA-N 342.398 5.106 30 20 EKED CC(C)Oc1ccc(C#N)cc1N[C@H](C)c1ccc(OC(F)F)cc1 63640730 FKVUUHAHCZPOLO-CYBMUJFWSA-N 346.377 5.120 30 20 EKED CCc1c(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)oc2ccccc12 110969095 LRZFEOGIQZFJMJ-VOMSXAGXSA-N 345.398 5.182 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccccc1C(C)(C)C#N 131702378 KLMDTHZNWRYDLR-INIZCTEOSA-N 349.503 5.352 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@@H](C)CC[C@@H]1C 135546381 GNOOWHMWLIJNQV-HOTGVXAUSA-N 349.434 5.064 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCO[C@@H](CCC)C1 189879600 PZZVRCZRIYOJSI-MSOLQXFVSA-N 329.484 5.072 30 20 EKED COc1ccc(CNc2cccc(OCCCC#N)c2)c2ccccc12 237200268 VYCKQDIFIGKGQU-UHFFFAOYSA-N 346.430 5.143 30 20 EKED Cc1ccc(SC2CCCC2)c(/C(O)=N/[C@@H]2CCC[C@H]2C#N)c1 329205120 DGZBYRCEZFGJFR-WMLDXEAASA-N 328.481 5.027 30 20 EKED C[C@H](N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 439571901 OEABIQABOSCMIV-ZWKOTPCHSA-N 342.442 5.762 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2cccc(COC(C)C)c2)CCCC1(C)C 445232625 BGHRTFXPNKRRDV-IBGZPJMESA-N 344.499 5.210 30 20 EKED CC[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1 447608348 VHNRPXSTGOERDX-HXUWFJFHSA-N 343.430 5.654 30 20 EKED C=CCC[C@@H](NCc1ccncc1F)c1ccc(C(F)(F)F)cc1 449195385 VGTCKICBCOJIHN-QGZVFWFLSA-N 338.348 5.037 30 20 EKED N#Cc1ccsc1C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471447053 OENMRMVLHGBWNS-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(OC)c(F)c1)c1ccc(F)c(F)c1 480682331 NZWIONQIPKKHCI-BUXKBTBVSA-N 335.369 5.081 30 20 EKED C[C@@H](c1ccccc1)N(C(=O)c1sccc1C#N)c1ccccc1 502766586 SKJIIPCIZXHMLG-HNNXBMFYSA-N 332.428 5.028 30 20 EKED CC(C)c1ccc([C@H](C)SCCCC2(C#N)CCOCC2)cc1 512314152 MTWUKDZHZDKUJS-KRWDZBQOSA-N 331.525 5.705 30 20 EKED N#CCc1ccc(NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 516858030 WRZCBSORZNUZPG-UHFFFAOYSA-N 339.851 5.142 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccccc1Oc1ccccc1Cl 520637530 OYJOIHCVLUHJPW-CQSZACIVSA-N 345.826 5.052 30 20 EKED CC(C)C[C@@H](NCCCSCC#N)c1cccc(C(F)(F)F)c1 538159059 AQLKEVQFPKAFIP-MRXNPFEDSA-N 344.446 5.029 30 20 EKED C=CCC[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccco1 552282887 QQTDOAMLDUOWMO-SFHVURJKSA-N 334.419 5.931 30 20 EKED CC(C)N(C)c1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 570608766 MTYJLAQZXNQMQH-UHFFFAOYSA-N 347.384 5.034 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCCCC1(C)C 574873019 RWIQVAWNLSFRCE-GJZGRUSLSA-N 330.497 5.236 30 20 EKED N#CC1(CNC(=O)N(c2ccccc2)c2ccccc2)CCCCC1 594869443 KQJPENLXUUAYLA-UHFFFAOYSA-N 333.435 5.008 30 20 EKED Cc1ccc(C[C@H](C#N)SCc2ccc(Br)cc2)cc1 603452573 YZEHEJZMQXSLTF-QGZVFWFLSA-N 346.293 5.126 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccccc1Cl 728438447 XEJHZNPUOYQRBQ-BQYQJAHWSA-N 331.849 5.421 30 20 EKED CC(C)(C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 737319554 YLMPATZAENOHGC-KRWDZBQOSA-N 348.833 5.042 30 20 EKED C=CCN(C(=O)Nc1cccc(CO[C@@H]2CCC[C@H](C)C2)c1)C(C)C 745277788 USJPPCJLCWCRFK-FXAWDEMLSA-N 344.499 5.210 30 20 EKED C[C@H](Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1Cl 760214843 AAILLZOIHBHKHK-JTQLQIEISA-N 339.197 5.208 30 20 EKED C=C[C@@H](Cc1nc(-c2cccc(C(F)F)c2)no1)c1ccccc1 771516004 VXJLTFYRZDUXCZ-ZDUSSCGKSA-N 326.346 5.187 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc2ccccc12 775384621 DPVQKVCLUJXEAN-XOBRGWDASA-N 332.472 5.501 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1cc2c(ccc3ccccc32)o1 776165006 MZNDELSFSSORFW-CQSZACIVSA-N 344.389 5.448 30 20 EKED FC(F)(F)c1ccc(C2CC(=NNc3ccc(Cl)nc3)C2)cc1 781593371 YILWSBPKVGHRRR-UHFFFAOYSA-N 339.748 5.099 30 20 EKED N#CC1(CCCS[C@H]2CCc3cc(Cl)ccc32)CCOCC1 795384583 URUNCTBJZOVQEE-KRWDZBQOSA-N 335.900 5.161 30 20 EKED Cc1cc2ccccc2nc1NN=C1CCC[C@H](c2cccnc2)C1 799883475 DSSUWHVDUJIBRK-INIZCTEOSA-N 330.435 5.064 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)s1)c1ccncc1 902806832 PESCCRGBNXRGHS-WCQYABFASA-N 326.387 5.130 30 20 EKED CC(C)c1ccc([C@@H](C)NN=Cc2c(C(C)C)nn(C)c2Cl)cc1 917550574 AZBYSHONBYOPPA-CQSZACIVSA-N 346.906 5.005 30 20 EKED C=CCN(C(=O)Nc1ccc(Sc2ccccc2)cc1C)C(C)C 919915335 GDUXMHSQIXFRLH-UHFFFAOYSA-N 340.492 5.575 30 20 EKED Cc1ccc(C(=O)/C=C/c2cn(C)nc2-c2cc3ccccc3o2)s1 920063922 LNUPRTLWULIJBM-CMDGGOBGSA-N 348.427 5.099 30 20 EKED CCCC[C@H](CC)CC(CC)=NNc1ccc(C(=O)O)cc1OC 1776051568 PWEBPRVVVIYIFW-AWEZNQCLSA-N 334.460 5.178 30 20 EKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)ccc1OC 1776784574 ILFUVIUQEZKJDR-UHFFFAOYSA-N 349.515 5.356 30 20 EKED N#Cc1ccc(OCc2ncc(-c3cccc(Cl)c3)o2)c(Cl)c1 28141425 PDLCYWWJYHBAOD-UHFFFAOYSA-N 345.185 5.099 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 90665548 OBJWDESEPBQLPD-KDOFPFPSSA-N 332.369 5.401 30 20 EKED C=CCCc1ccccc1NC(=O)c1ncoc1-c1ccc(C)cc1 410343823 GBSVINDFFXFKME-UHFFFAOYSA-N 332.403 5.021 30 20 EKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 439602359 GFBXLTRBCQKGHC-INIZCTEOSA-N 339.398 5.395 30 20 EKED CC(C)(C)C[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462720321 WLVPPOVOGPTDBR-IBGZPJMESA-N 326.871 5.479 30 20 EKED CCc1c(C)sc(NC(=O)C[C@H](CC)c2ccccc2)c1C#N 504905140 DBNJBODAGSCCCZ-AWEZNQCLSA-N 326.465 5.013 30 20 EKED CO[C@@H](C)c1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 537732761 YEJHJHHZZMGLGA-RYHLMMNBSA-N 334.463 5.210 30 20 EKED CCc1c([C@H](C)N[C@H](CCC#N)c2ccccc2)oc2ccccc12 539506987 IRFSLSLUAODJSL-OXJNMPFZSA-N 332.447 5.691 30 20 EKED CC(C)[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 539609104 DXYBOXQCTRQLJL-CWTRNNRKSA-N 332.369 5.023 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2cc(Cl)ccc2o1 540607320 PTTXCOZRECHLGW-KBXCAEBGSA-N 338.838 5.782 30 20 EKED C[C@H](c1ccc(CNC(C)(C)c2cccc(C#N)c2)cc1)C(F)(F)F 595633262 QCISQDKCMBNBDS-CQSZACIVSA-N 346.396 5.249 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1c[nH]c2cc(F)ccc12 727975627 VDTUWIUCOJHFPQ-CMDGGOBGSA-N 348.402 5.327 30 20 EKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccccc2C2CC2)S1 750817719 IVRFRJRKLBYYIJ-LDADJPATSA-N 348.471 5.072 30 20 EKED CCCCCCCC(=O)N1CCCC[C@@H]1c1nc2ccccc2o1 762430725 OIHOMWRSTCACCV-QGZVFWFLSA-N 328.456 5.242 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1cccc(N2CCCCC2)c1 776867753 AGPNQYDTGDYTGA-QFIPXVFZSA-N 331.463 5.038 30 20 EKED C[C@@H](NC[C@@H]1CC1(Cl)Cl)c1ccc(-c2cccc(C#N)c2)cc1 782522937 HKIFEFCCGXCDKL-ACJLOTCBSA-N 345.273 5.070 30 20 EKED FC(F)(F)C(F)(c1ccc(NCc2ccoc2)cc1)C(F)(F)F 842733401 CUVSQWFURDVHIG-UHFFFAOYSA-N 341.226 5.181 30 20 EKED CC(=NNc1ccccc1Cl)c1sc2ccccc2c1C(=O)O 1776014997 XUPQNVKZHSRCDP-UHFFFAOYSA-N 344.823 5.089 30 20 EKED CCCCCCCCCCN=c1c(C(=O)O)c[nH]c2ccc(C)cc12 1776787721 CJXMPWQESSWPRI-UHFFFAOYSA-N 342.483 5.216 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Cl)c1 7276713 AVVIABYWCSYJLG-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C=C(C)[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(F)c(F)c1 187756530 RVKLCVNLLFXMMQ-QGZVFWFLSA-N 346.402 5.088 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cccc(C(F)F)c1 279989156 GKLGYPGWKMRZFI-CYBMUJFWSA-N 332.419 5.488 30 20 EKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccc(C(C)(C)C#N)cc3)oc12 303030472 UAWYYMKMJAMFOP-UHFFFAOYSA-N 346.430 5.412 30 20 EKED N#CCCCOc1cccc(NCc2c(Cl)oc3ccccc23)c1 325244210 FEMBZISIRBZMFT-UHFFFAOYSA-N 340.810 5.381 30 20 EKED CC1(C)CCC(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CC1 330003437 BUIGECLJBWDPBI-UHFFFAOYSA-N 334.504 5.085 30 20 EKED CCC(CC)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 392245969 PYAYYVBIHSRXNZ-JTSKRJEESA-N 336.479 5.417 30 20 EKED CCc1cccc(C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432462160 SEGCADOXBUFTRC-IBGZPJMESA-N 335.451 5.114 30 20 EKED C=C[C@H](C)NC(=O)c1oc2ccccc2c1CSc1cccs1 465114269 WLIAAEFPIXEQGB-LBPRGKRZSA-N 343.473 5.091 30 20 EKED N#CC[C@H](CC(=O)N1CCCCC[C@@H]1c1ccccc1)c1ccccc1 474956052 UMEGNVFVCRYIET-FGZHOGPDSA-N 346.474 5.218 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(-c2ccccn2)cc1)c1ccccc1 485157348 FJLOLAHJSJLKFM-HXUWFJFHSA-N 328.415 5.047 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C 505058691 YYMIUFVLUGCKHK-YLJYHZDGSA-N 334.463 5.215 30 20 EKED C[C@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1F 512619963 NUPSOSCTYLFWGP-NEPJUHHUSA-N 336.332 5.128 30 20 EKED C[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)c(F)c1 537406846 JKZISSMKPYGEFP-GTNSWQLSSA-N 346.858 5.238 30 20 EKED CC(C)(C#N)CCN1CCC(c2nc3cc(Cl)ccc3s2)CC1 538464903 LGNOHIDSDFDTLR-UHFFFAOYSA-N 347.915 5.069 30 20 EKED C=CCCO[C@H](C)c1nc(-c2ccc(C)cc2OC2CCCC2)no1 545759050 YRMKZIYGLCSKMM-OAHLLOKOSA-N 342.439 5.020 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc(F)c(Cl)cc1Cl 556608265 KJNQZZZQJSQIIH-NSHDSACASA-N 349.236 5.344 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(C1CCC1)C1CCC1 572039749 SGHKKIOYNJIYHH-UHFFFAOYSA-N 325.496 5.693 30 20 EKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)C[C@@H](CC#N)c1ccccc1 597885464 JTCWGLBTEYKMAZ-RTWAWAEBSA-N 346.474 5.055 30 20 EKED CC[C@H](c1ccccc1)N(CC(C)C)C(=O)c1cccc(CC#N)c1 609509575 DYWLTJFOUVAQON-OAQYLSRUSA-N 334.463 5.002 30 20 EKED C[C@H](CCC(C)(C)C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609929571 FDKDSKHAJCATJJ-HUUCEWRRSA-N 347.528 5.417 30 20 EKED C[C@H](N[C@H](C)c1cc(Cl)sc1Cl)c1cccc(C#N)c1 610829840 OIDZZKALPYQGEI-VHSXEESVSA-N 325.264 5.338 30 20 EKED Cc1cc(N2CCCC2)ccc1NCc1ccc(C(C)(C)C#N)cc1 614053427 GCQHOLAOCUDFLE-UHFFFAOYSA-N 333.479 5.009 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(C#N)c1 616123442 NLJRHGJDZJCBGH-MRXNPFEDSA-N 347.462 5.293 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1ccc(-c2ccncc2)cc1 745990128 KZEHGVOOJMRPQZ-BHQIHCQQSA-N 339.316 5.062 30 20 EKED CC[C@@H](C#N)Oc1cccc(CNCc2cc3cc(C)c(C)cc3o2)c1 749285999 RZBRPSQVHBAKHB-IBGZPJMESA-N 348.446 5.020 30 20 EKED Cc1cc(C)cc(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c1 814210393 OBBRKFOIZKHMDI-IBGZPJMESA-N 337.492 5.025 30 20 EKED Clc1ccc(NN=Cc2conc2Cc2ccccc2)c(Cl)c1 814751968 WDLYXVDSHSLNRW-UHFFFAOYSA-N 346.217 5.018 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCC1CCC(C(C)C)CC1 1776783229 KOEHCZMLQNWMGK-CTWPCTMYSA-N 325.537 5.242 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 29150717 QLWRVZZQSGJNDO-UHFFFAOYSA-N 333.218 5.047 30 20 EKED N#C[C@@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccn1 41493558 RNKCPNNBPCZGLJ-LLVKDONJSA-N 347.226 5.093 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cc(F)cc(F)c1 151242284 KGGSLUOUWNQRNZ-NSHDSACASA-N 347.390 5.003 30 20 EKED Cc1ccc(C(F)(F)F)cc1N[C@H](C)c1ccc(OCC#N)cc1 325709618 RAWVQODBVHYCMK-CYBMUJFWSA-N 334.341 5.089 30 20 EKED CC[C@@H](c1ccc(F)cc1F)[S@](=O)CCC1(C#N)CCCCC1 417153386 VJIMOEQHWKOLBK-GAJHUEQPSA-N 339.451 5.029 30 20 EKED C=CCC[C@@H](NC(=O)C[C@@H](C)c1ccccc1OC)c1ccccc1 435300150 FRSYZPBAIUVUMG-YLJYHZDGSA-N 337.463 5.013 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCCCCC(C)(C)C#N 435889631 PDYYJTYMZRPOGR-UHFFFAOYSA-N 334.510 5.665 30 20 EKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455917891 KGBJUDUTHTZZAC-UTKZUKDTSA-N 347.462 5.066 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1SCc1ncc(Cl)s1 479100541 GMDNGBAHLIHGEQ-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1cc2ccccc2s1 481062140 QKFHMXBIWOGRDE-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 505017432 VVSUXVXYTYRGLT-UHFFFAOYSA-N 338.426 5.141 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1cccc(C)c1C 540499856 ABZIJDFTEXAZFJ-NRFANRHFSA-N 343.511 5.120 30 20 EKED C=CCC[C@H](N[C@H](C)c1cncc(Br)c1)c1ccccc1 578643981 IVKSDPZWBZRGRZ-KDOFPFPSSA-N 345.284 5.202 30 20 EKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 590607952 BBWBLMLEBKFJQH-UHFFFAOYSA-N 343.386 5.019 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 605915659 RZHHTGSOLAZYPI-UHFFFAOYSA-N 336.863 5.091 30 20 EKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 609824826 ABWRUPMYXDLDMV-SBUREZEXSA-N 342.442 5.007 30 20 EKED COc1ccc2cc(C(=O)/C=C/c3nccc4ccccc34)ccc2c1 740764592 YZSJHFPJJSOJAJ-ZHACJKMWSA-N 339.394 5.293 30 20 EKED Cc1ccccc1C1CC(=NNc2ncnc3c2oc2ccccc23)C1 743432376 KTBLBACDJDGCCE-UHFFFAOYSA-N 342.402 5.030 30 20 EKED CC1(C)CCC[C@H](CC(=O)[C@H](C#N)c2nc3ccccc3s2)C1 756506086 SUVRQOMPUDWFNY-KGLIPLIRSA-N 326.465 5.079 30 20 EKED CCC(CC)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 759537019 AJXGRAIZPOZEGQ-MRXNPFEDSA-N 326.465 5.121 30 20 EKED C#CCCCCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 779868335 XPRHBQFKUARNON-UHFFFAOYSA-N 346.430 5.181 30 20 EKED CCC[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 813060801 KDMAHTMEWMVZTP-YUELXQCFSA-N 344.867 5.076 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1cc(Cl)ccc1Cl 916137574 OJYBXLPFRPFKRH-XBXARRHUSA-N 328.198 5.438 30 20 EKED O=C(O)c1cc(NN=C(CC2CCC2)c2ccccc2)ccc1Cl 1776033605 GQCXKELKXZDBHJ-UHFFFAOYSA-N 342.826 5.045 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)c1ccccc1 108981765 ZADSBAJNUZFUTQ-HZPDHXFCSA-N 338.476 5.213 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](C)c1ccccc1 108981766 ZADSBAJNUZFUTQ-HOTGVXAUSA-N 338.476 5.213 30 20 EKED Cc1cccc([C@H]2CCCCN2C(=O)Nc2ccc(CC#N)cc2)c1C 174717024 ROCWIHRAJXTDES-OAQYLSRUSA-N 347.462 5.129 30 20 EKED COc1ccccc1[C@H](CC(C)C)NCc1ccc(C#N)cc1Cl 439446646 ZJUUXPJANKMFKM-IBGZPJMESA-N 342.870 5.097 30 20 EKED COc1cc2ccccc2cc1CN[C@H](CCCC#N)c1ccccc1 449338667 GZWKJLGIQAIBHF-JOCHJYFZSA-N 344.458 5.373 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 466568800 XIBFIVVGLSONEI-QGZVFWFLSA-N 338.451 5.175 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(F)c(C)c1 475575772 SOBANNWVZHKLCT-UHFFFAOYSA-N 340.442 5.308 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 490209487 NPNKCLTVZYPRJL-AWEZNQCLSA-N 349.808 5.966 30 20 EKED CC(C)C[C@@H](NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 517550916 UENFFAQNHUJCAC-LJQANCHMSA-N 346.396 5.454 30 20 EKED CC(C)(CCC#N)CNc1cccc(OCc2cccc(F)c2)c1 532890466 LGQAKHPBTCLZFE-UHFFFAOYSA-N 326.415 5.147 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(SC3CCCC3)cc2)CC1 533257887 JBJJXESWYVCOSJ-UHFFFAOYSA-N 330.497 5.151 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccccc1Oc1ccccc1 540596036 JHPBIDYZDXCGMU-HNNXBMFYSA-N 334.444 5.263 30 20 EKED Cc1ccccc1[C@H](CC(F)(F)F)N[C@@H]1CCc2ccc(C#N)cc21 569513777 PXSAQWSONOSIOY-MOPGFXCFSA-N 344.380 5.137 30 20 EKED CC1=C(C)C[C@H](C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 592590838 BWRRRNQJEVULRA-CZUORRHYSA-N 328.481 5.013 30 20 EKED Cc1cccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603968577 CMXJICJUQMPOEM-UHFFFAOYSA-N 346.455 5.167 30 20 EKED CC(C)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209168 ZOPJYEUDBWRINM-FQEVSTJZSA-N 349.434 5.003 30 20 EKED N#C[C@H](C(=O)CCC1CCC1)c1nc(-c2ccc(Cl)cc2)cs1 750688403 SMTJHAAOKWIIGB-OAHLLOKOSA-N 344.867 5.220 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(Cl)c(C(F)(F)F)c1 754688868 AROISMRCOVEUHW-SNAWJCMRSA-N 331.746 5.020 30 20 EKED CCC(CC)[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 762042712 WQJOEUVUPSEROD-MFKMUULPSA-N 334.872 5.198 30 20 EKED S=C(Nc1ccsc1)Nc1cccc(C#Cc2cccs2)c1 790304408 GHNJLYJIUUYJKA-UHFFFAOYSA-N 340.498 5.018 30 20 EKED COc1cccc(/C=C\C(=O)c2ccc(SC)cc2)c1OC(C)C 916133435 OGGFJXDPKUZEBY-RAXLEYEMSA-N 342.460 5.100 30 20 EKED CC(C)c1cccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)c1 1776375441 QSBAJSQBWCQDKR-KTKRTIGZSA-N 328.795 5.058 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)c(Cl)c2)c1 113952466 VBEHJFCJNTYGBF-XJKSGUPXSA-N 346.833 5.011 30 20 EKED CC(C)=CCSc1ccccc1C(=O)Nc1ccc(CC#N)cc1 124237240 AVFWQAGJXFKJPO-UHFFFAOYSA-N 336.460 5.063 30 20 EKED CCCCCCCCCCCCCCCC[C@H](CO)CCCC 141557125 XAPVLYDBPDYDAB-JOCHJYFZSA-N 326.609 7.657 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2cccs2)cc1)c1cccc(C#N)c1 190696292 QJAKRMBELVPQHU-CQSZACIVSA-N 347.443 5.045 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1ccc2ncccc2c1 208112721 LYPYNCIZPXINEF-NTMALXAHSA-N 336.460 5.193 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 471165083 LBRLKFHBYRZFTA-LBPRGKRZSA-N 341.282 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H](C)[C@@H]1C 475572869 ZZNZKGYQCXQNDM-ZACQAIPSSA-N 328.500 5.437 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C2(CCC2)C1 475582643 LEBBWVYPKQFJTB-QGZVFWFLSA-N 340.511 5.583 30 20 EKED C=CCN(C(=O)C[C@H]1C=CCCC1)c1nc(-c2ccccc2)cs1 487604859 HEFLKMAJOLOWJU-INIZCTEOSA-N 338.476 5.076 30 20 EKED C=CC[C@@H](C(=O)N(C)Cc1ccccc1C(F)(F)F)c1ccccc1 494891169 IJLGSELNGKBVKI-QGZVFWFLSA-N 347.380 5.024 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 514681990 CRUDNJNGIVDCHL-OPAMFIHVSA-N 332.422 5.675 30 20 EKED C[C@@H](Oc1ccccc1NCc1ccc(C#N)cc1F)c1ccccc1 522404680 BZCYTBFTSLMQLR-MRXNPFEDSA-N 346.405 5.449 30 20 EKED N#Cc1ccccc1SCc1csc(-c2ccccc2F)n1 525598395 IVFPRVDRTOYWSG-UHFFFAOYSA-N 326.421 5.113 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1)c1ccccc1 536171044 ZZUKHYOIGJWUPL-JKSBSHDWSA-N 337.438 5.095 30 20 EKED C=CCC[C@H](N[C@H](CC)[C@H]1CCOC1)c1ccc(C(F)(F)F)cc1 540150001 CMCQVJSOJMOGAU-JQHSSLGASA-N 341.417 5.117 30 20 EKED Cc1nc(C(F)(F)F)c(CS[C@H](C)c2ccc(C#N)cc2)s1 546754009 AWKIHZFSWIKYAS-SECBINFHSA-N 342.411 5.336 30 20 EKED C[C@H](C(=O)Nc1sc2c(c1C#N)CCCCCC2)c1cccs1 564303220 GZLNQDZPZLZTGW-LBPRGKRZSA-N 344.505 5.082 30 20 EKED C=CCC[C@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 568306360 DCVUCOYFFGBQLS-KRWDZBQOSA-N 336.391 5.244 30 20 EKED Cc1ccccc1C(NCc1ccc(C#N)s1)c1ccccc1C 572448655 KIODBTCNNBEYNP-UHFFFAOYSA-N 332.472 5.116 30 20 EKED CC[C@@H](C#N)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 593447349 DEGJUJUSVAKIJV-KBPBESRZSA-N 341.842 5.001 30 20 EKED CC1CCC(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 609651342 AJHLONCOCHOHJR-PCKAHOCUSA-N 330.497 5.093 30 20 EKED CC(C)(C)CCCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 729070686 SRWSABKKGFJTIK-HNNXBMFYSA-N 326.465 5.203 30 20 EKED CC(C)CCC(=NNc1ccccc1C(=O)O)c1ccc(Cl)cc1 1776030106 AZOZFPMFVGGMJC-UHFFFAOYSA-N 344.842 5.291 30 20 EKED N#C[C@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2ccccc2s1 89964633 VPQRVSJMHYNYLL-MRXNPFEDSA-N 344.395 5.046 30 20 EKED N#Cc1csc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)c1 177692359 MSCPXHBBJKXAAQ-LJQANCHMSA-N 338.863 5.152 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(Cl)c1 191239899 PCYMPBABIYRKFB-CYBMUJFWSA-N 344.867 5.153 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 328984026 FYAJGHRRWUKLLC-VNQPRFMTSA-N 332.419 5.628 30 20 EKED CCC(CC)(C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 440356919 POVKZMBNWWVISG-UHFFFAOYSA-N 334.463 5.184 30 20 EKED C[C@@H](Sc1ccc(C#N)cn1)c1ncc(-c2ccc(Cl)cc2)o1 443517442 DQMNLIKMJVROAP-LLVKDONJSA-N 341.823 5.115 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(C)c1 519979048 HRKGFPBFDSKGLE-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C[C@H](NC(=O)CCCCCC#N)c1ccc(Cl)c2ccccc12 588164467 UONOJHYCYDMEAR-AWEZNQCLSA-N 328.843 5.144 30 20 EKED Cc1cccc(-c2nnc(SCCC3(C#N)CCCCC3)o2)c1 591124381 XWXJWXTUGAATQH-UHFFFAOYSA-N 327.453 5.001 30 20 EKED COc1cc(C)ccc1C(=O)/C=C\c1nc(-c2ccccc2)cs1 727975218 UVFAQPVMGIKVTN-KHPPLWFESA-N 335.428 5.023 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 729948093 ADOLREODNCNHHI-UHFFFAOYSA-N 348.352 5.064 30 20 EKED CCCC(C)(C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734928598 IHRDGMHDFMCYPC-IBGZPJMESA-N 335.451 5.042 30 20 EKED C=CC[C@H](NC(=O)C[C@H](C)c1ccc(C(C)C)cc1)c1ccncc1 737854619 KKYPSCKJMJLSRL-UWJYYQICSA-N 336.479 5.132 30 20 EKED Cc1ccc(C)c(SCc2cccc(C(=O)O[C@H](C)CC#N)c2)c1 744136055 VWRDYPXTTHNJEY-MRXNPFEDSA-N 339.460 5.055 30 20 EKED CCCCCC1=C(C)CCC1=NNc1nnc(-c2ccccn2)s1 788029198 RYRKTRHFABUMBC-UHFFFAOYSA-N 341.484 5.059 30 20 EKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792103613 LJLIZOQKWKNMPZ-SFTDATJTSA-N 342.442 5.241 30 20 EKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1Cl 795984457 YHCQUEICGBSNPU-GDBMZVCRSA-N 327.811 5.032 30 20 EKED N#CC1(CCCC[S@@](=O)Cc2ccc(Cl)c(Cl)c2)CCC1 899379525 ALYUBJZRVDCWKG-OAQYLSRUSA-N 344.307 5.106 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)cc1 110655649 JKGQCEMUBDSEBV-MSGBMKDASA-N 333.431 5.072 30 20 EKED CCC[C@H]1CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 135770534 AMWMQXRQRNGPFU-CVEARBPZSA-N 345.512 5.125 30 20 EKED C[C@H](Sc1nnc(-c2cc3ccccc3o2)o1)c1cccc(C#N)c1 189854807 CSNAXFVHKAWOIW-LBPRGKRZSA-N 347.399 5.208 30 20 EKED CC[C@H](NCCC1(C#N)CCCCC1)c1nc(C(F)(F)F)cs1 411519835 TXZWCRXWXPDEQG-LBPRGKRZSA-N 345.434 5.067 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CCC(C)(C)CC1 438051138 BPTXDSDPLMMIMS-AWEZNQCLSA-N 345.512 5.171 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cccc(C(F)(F)F)c1 439443741 ANRPHJZPWLTTRL-NSHDSACASA-N 338.760 5.081 30 20 EKED Cc1oc(-c2ccccc2)nc1CS[C@@H](C)c1cccc(C#N)c1 443156971 PWLGQBHVXKUTQJ-HNNXBMFYSA-N 334.444 5.516 30 20 EKED CC[C@H](N[C@H]1CC(C)(C)Oc2cc(F)ccc21)c1ccc(C#N)cc1 447583647 CAIVYRZVBFWSMC-OALUTQOASA-N 338.426 5.040 30 20 EKED C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 467820095 WDNYYPIBWMHOTA-KRWDZBQOSA-N 338.278 5.425 30 20 EKED N#C[C@H](C(=O)c1ccc2sccc2c1)c1nc2ccccc2s1 473076912 KQTJJQIKWOPGCU-CYBMUJFWSA-N 334.425 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(C(C)(C)C)CC1 475545478 JYQWJHJZLRLFJP-UHFFFAOYSA-N 340.511 5.749 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc2ccccc12 476152735 MMGHWSWUQHRVFJ-UHFFFAOYSA-N 330.431 5.339 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)C(F)(F)F 483972305 FKEVJIFOGHASOA-UHFFFAOYSA-N 327.390 5.456 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H]1C 505009993 AEKRSHYROSVCQR-PXNSSMCTSA-N 334.463 5.215 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](CC)c1ccc(C)cc1 523115185 YQXYCCVRRYMKCH-OAQYLSRUSA-N 348.490 5.189 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(CC#N)cc3)cc2)cs1 541325710 RANZUTIMSOJREQ-OAHLLOKOSA-N 347.487 5.035 30 20 EKED C=CCC(C)(C)c1noc([C@H](F)c2ccc(C(F)(F)F)cc2)n1 551493480 YFKPMWHTSWSDJX-GFCCVEGCSA-N 328.309 5.001 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1Cl 552956747 OJSNTHDVCSIGPP-BUXKBTBVSA-N 328.818 5.079 30 20 EKED C=CCC[C@@H](NC(=O)Nc1ncsc1C(C)C)c1ccccc1 572351141 IWYFNQKSXSKWIY-OAHLLOKOSA-N 329.469 5.096 30 20 EKED CC(C)(CCC#N)CNCc1ccc(-c2ccccc2Cl)s1 582623672 MHTPISDYOBUBBF-UHFFFAOYSA-N 332.900 5.488 30 20 EKED CC(C)(C)C[C@@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588159266 IFGXZHKFCGIFFT-QGZVFWFLSA-N 334.891 5.408 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(F)c2ccccc12 590254391 UDAHHENHLQSRQJ-JLCFBVMHSA-N 330.406 5.189 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1oc2ccccc2c1C)C(C)C 605973834 DEVRUQMKHHHOEU-SFHVURJKSA-N 328.456 5.046 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NCc2ccnc(C#N)c2)cc1 610956795 HRWFUQCHUHDYHF-INIZCTEOSA-N 345.471 5.419 30 20 EKED C=CCN(Cc1csc(-c2ccsc2)n1)Cc1ccccc1F 615463620 BSDFQYLQIVZECK-UHFFFAOYSA-N 344.480 5.199 30 20 EKED N#Cc1ccc(CNCc2cc(-c3ccccc3)cs2)cc1Cl 619748760 TTYNILYBVKAAGH-UHFFFAOYSA-N 338.863 5.230 30 20 EKED Cc1ccc(-c2ncc(/C=C3/CCc4sccc4C3=O)s2)cc1 734304794 WPNPFVCONCHIQB-UVTDQMKNSA-N 337.469 5.393 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](c2ccc(F)cc2)C(C)C)n1 756571973 QSAFDGXVWAFDLA-DOTOQJQBSA-N 344.455 5.022 30 20 EKED O=C(/C=C\c1nc(Cl)cs1)c1ccc(SC(F)F)cc1 759084260 OHIPQKXYYJUISZ-WAYWQWQTSA-N 331.796 5.007 30 20 EKED CC(=NNc1c(F)cccc1Cl)c1[nH]c(-c2ccccc2)nc1C 769827139 OPYNRRUSUPSJKT-UHFFFAOYSA-N 342.805 5.014 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCCC[C@@H]1c1noc(C)n1 775490082 VISIYRUVALONET-SJLPKXTDSA-N 349.519 5.208 30 20 EKED CC(C)n1nccc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 794937734 IVTTZPJYIDYFCX-CMDGGOBGSA-N 330.387 5.260 30 20 EKED CN(c1ccc(NC(=O)CCCCCC#N)cc1F)C1CCCCC1 805177450 BTLGVWYJSBQOQQ-UHFFFAOYSA-N 345.462 5.007 30 20 EKED Cc1cccnc1[C@H](NCc1ccc(C(C)(C)C#N)cc1)C(C)(C)C 934287181 BIMAQRRLTWHZSS-FQEVSTJZSA-N 335.495 5.068 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c(C)c1 1776132851 HRDLMQWGZQDLDA-FLIBITNWSA-N 346.382 5.158 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)c(N)c(Cl)c1 271767531 UGDMXEVDXCCQJN-YVEFUNNKSA-N 348.277 5.271 30 20 EKED FC1(F)CC[C@H](NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 324393637 BJQPTZADHSHENL-NSHDSACASA-N 347.249 5.002 30 20 EKED C[C@H](SCCC#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 413015003 RICUQIFYDUKKNF-VIFPVBQESA-N 327.236 5.356 30 20 EKED CC[C@H](C)C[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 438049742 LPWMQLNZQMURMA-KKUMJFAQSA-N 333.501 5.027 30 20 EKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(C#N)cc1 439573094 OCOGDDUFENNGEG-INIZCTEOSA-N 339.398 5.395 30 20 EKED CC(C)(C#N)CCSc1nnc(-c2ccccc2)c2ccccc12 463039323 RMUIXPOACAQLHF-UHFFFAOYSA-N 333.460 5.329 30 20 EKED CC(C)c1ccc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 504372875 YHKPIUDQOOFRLL-INIZCTEOSA-N 349.478 5.494 30 20 EKED COc1ccc([C@@H](C)Nc2cc(C#N)ccc2OC(C)C)cc1Cl 507471708 YANDEWLBXAXFCM-CYBMUJFWSA-N 344.842 5.181 30 20 EKED C[C@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1C 510049208 KCLLVEPINCNVRN-JKSUJKDBSA-N 349.434 5.003 30 20 EKED N#CCN(C(=O)c1cc2sc3ccccc3c2s1)C1CCCC1 523147058 JKLWRZROJKWBCR-UHFFFAOYSA-N 340.473 5.024 30 20 EKED N#Cc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)c(F)c1 532990331 MVKJUBBPQOGYRA-HSZRJFAPSA-N 344.433 5.161 30 20 EKED C=C[C@@H](CC(=O)N(CC)c1nc2ccccc2s1)c1ccccc1 534009882 KGOARSPUUBXKPR-HNNXBMFYSA-N 336.460 5.009 30 20 EKED CN(Cc1cc(C#N)cs1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 539926795 DIDJDFUAPLPMGH-AWEZNQCLSA-N 344.789 5.009 30 20 EKED C=CCC[C@@H](Nc1cccc(C(=O)N2CCCCC2)c1)c1ccco1 556894842 HTVYGZXTEBXMNT-LJQANCHMSA-N 338.451 5.025 30 20 EKED N#Cc1c(Cl)cccc1SCc1coc(-c2ccccc2)n1 557187846 VCNDNZCKQTYRTP-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 558593062 PFEXETJCOHKJJR-AWEZNQCLSA-N 333.366 5.058 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2sc(Cl)cc2C1 577060860 XRFBVNXLXAWPEJ-UHFFFAOYSA-N 346.883 5.110 30 20 EKED C/C=C/c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 584861479 HMERRIFIEGVUDW-FARCUNLSSA-N 342.446 5.109 30 20 EKED CC(C)c1ccc(-c2ncc(CN3CCC[C@H](CC#N)C3)s2)cc1 595611253 IJSMOYIUIPWQSF-MRXNPFEDSA-N 339.508 5.059 30 20 EKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2ccccc21 603656305 ILLMHEAAPNSJTE-FQEVSTJZSA-N 347.462 5.029 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCSc2ccc(Cl)cc21 618803807 IWTPRLLABKMDCD-QZTJIDSGSA-N 340.879 5.026 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc2ccccc2s1 619755531 KJRRJNNACOEEAJ-LBPRGKRZSA-N 326.852 5.277 30 20 EKED C=Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 760109913 GUDDVOGABMUIDR-QFIPXVFZSA-N 338.410 5.237 30 20 EKED CC(C)[C@@H]1/C(=C\c2cnc(-c3ccncc3)s2)C(=O)c2ccccc21 766505492 JCICBZDKIHKZGE-MVDPLZLPSA-N 346.455 5.225 30 20 EKED c1ccc(-c2csc(NN=C3CCC[C@H](c4cccnc4)C3)n2)cc1 799873788 XVAXRVWPNMDOCE-INIZCTEOSA-N 348.475 5.331 30 20 EKED N#CCCCCCC(=O)OC(c1ccccc1F)c1ccccc1F 805897356 QZYLPNXBMDRVHG-UHFFFAOYSA-N 343.373 5.071 30 20 EKED CC(CC(F)(F)F)=NNc1nc2cc(C(F)(F)F)ccc2s1 814860364 QOGUJDKHBYWBMB-UHFFFAOYSA-N 341.280 5.055 30 20 EKED Cc1cc(C)c(NN=Cc2ccccc2OCc2ccccn2)c(C)c1 819840566 DWDFBEUAVNZWNX-UHFFFAOYSA-N 345.446 5.032 30 20 EKED N#Cc1ccccc1NC(=S)Nc1ccccc1Oc1ccccc1 915995587 CXUXYKYMIBJSTA-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc2sccc2c1 1776784799 XYXNFNVPXHRAGC-QGZVFWFLSA-N 333.497 5.195 30 20 EKED CCC[C@H]1CC[C@H]([C@@H]2CC=C(B3OC(C)(C)C(C)(C)O3)CC2)CC1 1857776834 QSIBNMWSVJTKLV-KZNAEPCWSA-N 332.337 5.951 30 20 EKED Cc1cc(C)cc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 18115434 BWOWPZKZLPIJQF-UHFFFAOYSA-N 326.399 5.094 30 20 EKED COc1ccc(CNc2cccc(C(C)C)c2)cc1OCCCC#N 80192229 MWEJKJZZQPXZNZ-UHFFFAOYSA-N 338.451 5.113 30 20 EKED Cc1ccc(N=C(O)C2CC2)cc1N=C(O)CCC1CCCCC1 328932977 PKWZBVIWTZILEB-UHFFFAOYSA-N 328.456 5.942 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)c(F)cc2CC1 329031289 XEQZQZOJAHLPOO-BPLDGKMQSA-N 344.430 5.554 30 20 EKED CC(C)(C)c1cc(C#N)c(NC(=O)Cc2cccc(C(F)F)c2)s1 411008932 VDYXWGCUCVMBCV-UHFFFAOYSA-N 348.418 5.036 30 20 EKED C=CCCC(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 470122352 AVUVUDBOUGNJMK-UHFFFAOYSA-N 337.206 5.085 30 20 EKED CC(C)CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 482623898 NJAWREFOPZVRKW-UHFFFAOYSA-N 348.446 5.001 30 20 EKED C=CCSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 502577566 DGSXQYJAOYQNEU-UHFFFAOYSA-N 328.268 5.111 30 20 EKED C=C[C@H](CC(=O)Nc1cccnc1-c1ccccc1)c1ccccc1 533999199 JUEVABLQOFPZFK-QGZVFWFLSA-N 328.415 5.047 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1OC(F)F 537407292 JRFISVNVAQZWFZ-SJKOYZFVSA-N 348.368 5.101 30 20 EKED CC[C@@H](C)n1ncc(NCc2ccc(C(C)(C)C#N)cc2)c1C1CC1 594500504 NNWZMHIWBUVBLX-OAHLLOKOSA-N 336.483 5.145 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 732414342 KHGKGJGSLDNILG-UHFFFAOYSA-N 334.423 5.532 30 20 EKED C=CC[C@@H](C)C(C)=NNc1nc2cc(C(F)(F)F)ccc2s1 743444618 RMNPPUUXBQOTJI-SECBINFHSA-N 327.375 5.315 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(-c2ccncc2)cc1 745989973 IMBRHSKCCIRBJX-KTKRTIGZSA-N 336.394 5.193 30 20 EKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2ccc(F)cc2F)ccc1OC 749450704 CVSQGPJWYVSNNJ-QGOGUYACSA-N 346.373 5.047 30 20 EKED C=C[C@H](CC(=O)O[C@@H](c1ccccc1)c1ccncc1)c1ccccc1 759275449 MEYRBQPYVLSITD-JPYJTQIMSA-N 343.426 5.074 30 20 EKED C=CCCCC(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763991508 PBMZDTGNYJBJSO-CYBMUJFWSA-N 333.815 5.264 30 20 EKED N#Cc1cccc(CN[C@H]2CCCc3cc(SC(F)F)ccc32)c1 775372135 YRWNLEGIOCGDHP-SFHVURJKSA-N 344.430 5.040 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1O 775522921 BRLHUEIJPUIUJR-ZWKOTPCHSA-N 328.843 5.131 30 20 EKED Cc1cccnc1[C@H]1CCCC(=NNc2nc3ccccc3s2)C1 799105446 XQJFMJVZSPISEG-AWEZNQCLSA-N 336.464 5.125 30 20 EKED CCC[C@H](CC1CCCCC1)C(=O)OCCCC1(C#N)CCOCC1 800169978 YXDBZYAIRZURPK-LJQANCHMSA-N 349.515 5.017 30 20 EKED C#CC[C@@H]1CCCN(C(=O)Nc2ccc(SC(C)(C)C)cc2C)C1 831412313 QMFMSVXWEGDIPH-MRXNPFEDSA-N 344.524 5.153 30 20 EKED Cc1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776127633 YVRCEZIHHOGYBX-CSKARUKUSA-N 348.423 5.318 30 20 EKED O=C(O)c1cccc(/C=C\C(=O)c2csc3ccccc23)c1Cl 1777685278 IVTDHXHYBWTTEZ-HJWRWDBZSA-N 342.803 5.149 30 20 EKED Cc1ccc(C(=O)/C=C\C2=Cc3cc(Cl)cc(Cl)c3OC2)o1 207874914 JSDCVJYTUWXXPJ-ARJAWSKDSA-N 335.186 5.110 30 20 EKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)Nc1c(C(C)C)cccc1C(C)C 280971206 IMYZQFHCIQWITL-UZLBHIALSA-N 344.499 5.036 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)c(F)cc2CC1 329031288 XEQZQZOJAHLPOO-AEGPPILISA-N 344.430 5.554 30 20 EKED CC(O)=Nc1ccc(C)c(/C(O)=N/C[C@@H]2C[C@H]2C2CCCCC2)c1 329311304 GEWBPMRBSSJZGW-LPHOPBHVSA-N 328.456 5.124 30 20 EKED N#CCCC[C@H](NC(=O)c1cc(F)c2ccccc2c1)c1ccccc1 352224625 BGDGLLHTUZBRBS-NRFANRHFSA-N 346.405 5.144 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)S[C@H](C)c3cccc(C#N)c3)o2)cc1 419466948 RWUGBMJPRWZNNM-HUUCEWRRSA-N 349.459 5.472 30 20 EKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 467611048 QKWJYKUIBZVQGY-MAUKXSAKSA-N 349.434 5.003 30 20 EKED C=CCC1(C(=O)Nc2cccc(CSc3ccccn3)c2)CCC1 479909566 GWFXIIYBFNCGJT-UHFFFAOYSA-N 338.476 5.059 30 20 EKED CCC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512642496 QFTXHBKZEJCNGI-BLVKFPJESA-N 332.369 5.168 30 20 EKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)NCC(C)(C)CCC#N 513145963 ANTNYKUIYUISRL-QGZVFWFLSA-N 349.906 5.008 30 20 EKED N#Cc1cccnc1N[C@H](Cc1ccc(Cl)cc1)c1ccccc1 515923838 JVIXTZJQKWRSKY-LJQANCHMSA-N 333.822 5.003 30 20 EKED CC(C)CC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 518255116 GBBGCZKCSPYPNJ-GJZGRUSLSA-N 333.501 5.027 30 20 EKED Cc1cccc(Oc2ccccc2NC(=O)c2ccc(CC#N)cc2)c1 536166477 WOJFUESRQCTPEE-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C=CCC[C@H](N[C@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 537948126 XWPLMZJHRYFPKP-DOMZBBRYSA-N 340.414 5.520 30 20 EKED N#CCn1c(/C=C\c2cnc(C3CCCCC3)s2)nc2ccccc21 554518282 YGYDZMLNETWWCL-KHPPLWFESA-N 348.475 5.234 30 20 EKED N#CC1(CCCSc2c(Cl)cccc2Cl)CCOCC1 563726013 SHKMBCDAZCDOMX-UHFFFAOYSA-N 330.280 5.186 30 20 EKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)CC2(C#N)CC2)c1 590127255 PUJBHSZOGQUTJH-UHFFFAOYSA-N 340.810 5.073 30 20 EKED COc1ccc(C(C)C)cc1CSCCCC1(C#N)CCOCC1 594563284 SAFIAIKXMLZULH-UHFFFAOYSA-N 347.524 5.152 30 20 EKED C[C@@H](SCc1csc(-c2ccsc2)n1)c1ccc(C#N)cc1 609825494 BPCZRFORRASUFZ-GFCCVEGCSA-N 342.514 5.738 30 20 EKED C[C@@H](CCC(C)(C)C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609929570 FDKDSKHAJCATJJ-GJZGRUSLSA-N 347.528 5.417 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](CC(C)(C)C)c2ccccc2)cc1 728712089 ZMQXQIOFVCGIKS-DYESRHJHSA-N 336.479 5.245 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2csc3ccccc23)cc1 730018911 BUHVUNZQRYEPLZ-GJZGRUSLSA-N 336.460 5.043 30 20 EKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc2cc(O)ccc2c1 760266665 XXWJFFRDFTWKIF-HJWRWDBZSA-N 335.428 5.166 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1ccccc1 773115645 NRLDSINSDSKVGH-BEFAXECRSA-N 345.458 5.459 30 20 EKED CC(C)Oc1ccccc1C=NOCc1cccc(C(F)(F)F)c1 852284855 UMQYEMDPIHWXQB-UHFFFAOYSA-N 337.341 5.043 30 20 EKED C[C@@H](ON=CC1CC1)c1ncc(-c2ccc(Cl)cc2Cl)o1 853734310 ABLWDDAWBOTRBT-SECBINFHSA-N 325.195 5.122 30 20 EKED CC(C)c1ccccc1CNc1ccc(Oc2ccnc(C#N)c2)cc1 864038628 XHISZYDTZYCTIG-UHFFFAOYSA-N 343.430 5.481 30 20 EKED N#C[C@@H](C(=O)CCC1CCCC1)c1nc2cc(Cl)ccc2s1 917043795 NLWMJYHRNQLMHD-ZDUSSCGKSA-N 332.856 5.096 30 20 EKED CCOc1cccc(C=Nc2cccc(Nc3ccccc3)c2)c1O 920942338 YXRJLWSNFGQCMH-UHFFFAOYSA-N 332.403 5.285 30 20 EKED CC(=NNc1cccc(C(=O)O)c1C)c1ccccc1-c1ccccc1 1776089443 RSDTVLHQWYHYQC-UHFFFAOYSA-N 344.414 5.196 30 20 EKED CCN(Cc1coc(-c2ccc(C)cc2)n1)[C@H](C)c1ccc(C#N)cc1 65432977 WAEDZHVKQBUHGE-QGZVFWFLSA-N 345.446 5.105 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(F)c(F)c1 71813664 PUVJAJDJCLCDOB-SOFGYWHQSA-N 345.345 5.124 30 20 EKED CC(C)c1ncc(CNCc2ccc(-c3ccccc3C#N)cc2)s1 91068105 MDGCIHIPOVOVOG-UHFFFAOYSA-N 347.487 5.095 30 20 EKED CCOCc1cc(/C=C/C(=O)c2ccc3ccccc3c2)ccc1OC 164505649 ZDUMBDTWDQZXJD-XYOKQWHBSA-N 346.426 5.281 30 20 EKED C=CC[C@@H](CC)NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442846297 JKKBVYCOFRVDBC-LLVKDONJSA-N 337.250 5.073 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)c(F)c1 442863029 BRIPNWZZTJISRL-GFCCVEGCSA-N 334.847 5.485 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Cl)c(F)c1 442872938 OFQTZUSPFWCNLG-LBPRGKRZSA-N 334.847 5.343 30 20 EKED CC[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 447537395 VNMYEHLKFCZAIK-XZOQPEGZSA-N 344.433 5.528 30 20 EKED CC[C@@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 447581426 UKGVBKUMQFZNMO-HNAYVOBHSA-N 347.487 5.484 30 20 EKED C=CCCCCCN(C)[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 468272781 XUAOCJAWHLHNSL-QGZVFWFLSA-N 327.472 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCC(C)(C)COC 482237126 IINYLKGUDOOKNB-UHFFFAOYSA-N 346.515 5.113 30 20 EKED C=CCn1c(SCc2cc(C)sc2C)nnc1-c1ccccc1 516377153 NRVGSRWLGRKPCS-UHFFFAOYSA-N 341.505 5.102 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1cccc(C#N)c1 531587173 CNWRHJMVYBEYDM-INIZCTEOSA-N 347.487 5.183 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](C)c1oc2ccccc2c1C 606922543 VZERFQOKXREANZ-MRXNPFEDSA-N 328.456 5.190 30 20 EKED C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(OCC#N)cc1 729267353 RSNLQYFBTBAOHS-CYBMUJFWSA-N 349.261 5.089 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc(Cl)c(Cl)c1 731835413 CHDSKLDIAYKKMI-VQHVLOKHSA-N 344.197 5.545 30 20 EKED Cc1ccc(-c2ncc(/C=C3/Cc4c(F)cccc4C3=O)s2)cc1 734304065 DFLFZHNFJOHXQC-ZROIWOOFSA-N 335.403 5.080 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2cccc(C#N)c2)o1 734304696 SRZITGWZGJIXNE-RMKNXTFCSA-N 331.346 5.162 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc4c(c3)COC4)s2)cc1 742433988 BRIARSBNGOMXPB-CMDGGOBGSA-N 347.439 5.045 30 20 EKED O=C(/C=C\c1nc(Cl)cs1)c1cc2c(ccc3ccccc32)o1 759073968 AEZMTDHWUABBSA-VURMDHGXSA-N 339.803 5.592 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(F)c(Br)c1)c1ccccc1 773113877 GIQGKZUFNBJKPM-UGSOOPFHSA-N 346.243 5.003 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CCCC3(C)C)n2)cc1 773982091 DGXGQEHYHPKQRL-JKSUJKDBSA-N 338.476 5.121 30 20 EKED C=CCC[C@H](NCc1cc(=O)oc2cc(C)c(C)cc12)c1ccccc1 775465326 WUJHWRZIGJRMHE-NRFANRHFSA-N 347.458 5.207 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)[C@@H](C)c1ccccc1C(F)(F)F 799726358 OASQNDJSWFUWOK-QVOMUQBLSA-N 338.417 5.117 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1c(F)cccc1Cl 809158688 CCUUSLZJWXWQKQ-KTKRTIGZSA-N 327.742 5.030 30 20 EKED COc1cccc2cc(/C=C\C(=O)c3c(F)cccc3Cl)oc12 809158791 DHYUIIIIFIURLZ-HJWRWDBZSA-N 330.742 5.130 30 20 EKED O=C(/C=C/c1cc(Br)cs1)c1c(F)cccc1Cl 809159297 MPYTXXVCKANYAI-SNAWJCMRSA-N 345.620 5.199 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)c1 1776341401 CMAYUMYTOLHXHV-CMDGGOBGSA-N 342.822 5.133 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776805970 KVZXBVONHUQBEK-ZRDIBKRKSA-N 347.414 5.105 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(Cl)c1 125234307 RLQIJVFHJWNILZ-NSHDSACASA-N 348.830 5.126 30 20 EKED COc1cc(CN[C@@H](CCCC#N)c2ccccc2)cc2ccccc12 449341676 VRZKRVABRHCWKW-QFIPXVFZSA-N 344.458 5.373 30 20 EKED N#Cc1ccc(F)c(CNc2ccccc2COCc2ccccc2)c1 486434490 WXLQTMMGHZQERE-UHFFFAOYSA-N 346.405 5.026 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(N2CCCC2)cc1C)c1ccccc1 487546669 YZWCYJOFKGNBOI-OAQYLSRUSA-N 348.490 5.284 30 20 EKED C=CCC[C@H](C(=O)Nc1cc(OC)ccc1Cl)c1ccccc1 488711473 OJGAKKJUZGPUDG-INIZCTEOSA-N 329.827 5.037 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(-c3cccs3)c2)c1 509228720 YIELAGJSHKLUFT-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(-c2ccncc2)cc1 512668610 VYKZHQPHEHMNIP-JKSUJKDBSA-N 345.421 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1cccs1 530447277 GZFUKEWSHHONOK-UHFFFAOYSA-N 342.508 5.354 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 533948837 XIXLQIVPIOEFLT-QGZVFWFLSA-N 344.414 5.172 30 20 EKED C=CCC[C@H](N[C@H](C)c1cncs1)c1ccc(C(F)(F)F)cc1 557274812 ZIWRYSPWQHVJJQ-DOMZBBRYSA-N 340.414 5.520 30 20 EKED C=CCC[C@H](Nc1cccc(COCc2ccco2)c1)c1ccco1 560544412 QETHMOKHTGSCTC-FQEVSTJZSA-N 337.419 5.709 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)CC2 569396966 VXHWGHVVQCFFCF-RPWUZVMVSA-N 338.454 5.119 30 20 EKED CC(C)Oc1cccc([C@H](N[C@H](C)c2cccc(C#N)c2)C(F)F)c1 585725928 FMORWLQLECFYBN-KUHUBIRLSA-N 344.405 5.002 30 20 EKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 606920109 JWXXVVXSXXHJCN-AWEZNQCLSA-N 342.405 5.154 30 20 EKED COc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)c2ccccc12 610830033 YRIJLTLQRYHCMG-HZPDHXFCSA-N 330.431 5.132 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2)o1 619755352 FHSFWGYWFJHLIB-AWEZNQCLSA-N 336.822 5.322 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl 734981505 RJUQEFSTOKMSBQ-MPYXGJHCSA-N 348.185 5.354 30 20 EKED N#CCOc1cc(F)ccc1NCc1sc2ccccc2c1Cl 760458874 NNOVFQLACOXOCB-UHFFFAOYSA-N 346.814 5.208 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1cccc(-c2ccncc2)c1 772809661 YTQIHCNWLXYRRO-CMDGGOBGSA-N 336.394 5.193 30 20 EKED COc1ccc2cc(NCc3cccc(OCCCC#N)c3)ccc2c1 796460426 YQKBBQQCRQEXHT-UHFFFAOYSA-N 346.430 5.143 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2cccc3ccccc23)s1 797572679 FWFUTSBDARTONH-QGZVFWFLSA-N 348.471 5.013 30 20 EKED CCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211269 GZEUTGZOEPANHU-YOEHRIQHSA-N 340.389 5.273 30 20 EKED Cc1cccc(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c1C 814209762 DNXYEMDLHDBXAL-IBGZPJMESA-N 337.492 5.025 30 20 EKED C=C(C)C(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 819945080 FDZAUKBLEMXFES-AWEZNQCLSA-N 344.867 5.242 30 20 EKED CN(CCC(C)(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 831230123 DXMOALWMZHSGFU-HXUWFJFHSA-N 349.478 5.242 30 20 EKED CC(C)c1ccccc1NC(=O)N1CCC(c2ccc(C#N)cc2)CC1 929168721 OPQZEZWHCNGXPT-UHFFFAOYSA-N 347.462 5.093 30 20 EKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccc(CCC#N)cc2)c1 932572263 AXAOJJQDYDAHQP-OAQYLSRUSA-N 347.462 5.129 30 20 EKED CCC[C@@H](C=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1 1776033431 GFBRRHIQWQOAIG-AWEZNQCLSA-N 330.815 5.020 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(CC)oc2ccccc12 1776783307 OHTCBHGLBNHLEJ-INIZCTEOSA-N 345.483 5.289 30 20 EKED N#C[C@H](C(=O)c1cc2sc3ccccc3c2s1)c1ccccn1 41492812 FQVXITRASDBWRF-LBPRGKRZSA-N 334.425 5.001 30 20 EKED C[C@H](Sc1nnc(-c2cccc(Cl)c2)o1)c1ccc(C#N)cc1 118173608 ZVVLPCYTERTVRM-NSHDSACASA-N 341.823 5.115 30 20 EKED COc1ccc2oc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)c(C)c2c1 153714503 VWHYEVRIRWLLLZ-HUUCEWRRSA-N 334.419 5.033 30 20 EKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C#N)c1 182102904 LXMVGXVDBACJSI-YVEFUNNKSA-N 336.332 5.042 30 20 EKED CC(C)c1ccc2occ(/C(O)=N/[C@@H]3CCCC34CCOCC4)c2c1 329172139 AANIJRCQCRMAIC-LJQANCHMSA-N 341.451 5.210 30 20 EKED N#Cc1ccc(S[C@@H](c2ccccc2)c2ccc(F)c(F)c2)nc1 463268890 WBSZGPLWHRACOM-IBGZPJMESA-N 338.382 5.113 30 20 EKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1 483045749 KJJCRTQMDJITOZ-UWJYYQICSA-N 334.463 5.420 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(COC(C)C)cc1 485410843 XLZSPOPKVXOSGH-UHFFFAOYSA-N 344.499 5.212 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519199301 WUMDYTJKDBGSLA-SFHVURJKSA-N 349.434 5.147 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(C)C)cc1 521190499 CPWRNMLSTNNIAF-UHFFFAOYSA-N 349.478 5.372 30 20 EKED C=C[C@@H](CC(=O)N(Cc1ccc(C)s1)C(C)C)c1ccccc1 535363556 BFCUMHCBBQOJRA-KRWDZBQOSA-N 327.493 5.153 30 20 EKED C=CCC[C@H](NC[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccco1 552047206 DANJAMHZJXRDPF-ZWOKBUDYSA-N 344.524 5.021 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc2ccc(CC)cc12 561322829 UNFORZLQOIQXRF-UHFFFAOYSA-N 347.458 6.099 30 20 EKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1F 574437013 ZOSILHDIASOKMA-CQSZACIVSA-N 333.366 5.058 30 20 EKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CCCCC1 604461409 VUDGCOSAKBHTGH-UHFFFAOYSA-N 349.434 5.147 30 20 EKED C=CCCCCCN(C)C(=O)c1ccccc1-c1ccccc1C#N 610051083 DAQNMZXKXPPUPC-UHFFFAOYSA-N 332.447 5.044 30 20 EKED CCC(CC)(NCc1ccnc(C#N)c1)c1ccc(Cl)c(Cl)c1 610993279 JSFYUQMLEQKPCX-UHFFFAOYSA-N 348.277 5.065 30 20 EKED Cc1cccc(N(C(=S)Nc2ccc(C#N)c(Cl)c2)C(C)C)c1 726491079 BIRKIIGNJHRZQU-UHFFFAOYSA-N 343.883 5.132 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1ccc(Cl)c(Cl)c1O 727650514 LBZJVMGKHRVFBS-UHFFFAOYSA-N 346.217 5.083 30 20 EKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1cccc(F)c1 735318304 KDNGTDUHFBEWJW-GFCCVEGCSA-N 335.831 5.376 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(Cl)nc2)cc1 749005504 KVTZGPRBTHLQFW-SDQBBNPISA-N 349.817 5.307 30 20 EKED N#CCOc1cc(F)ccc1NCc1ccc(-c2ccccc2)cc1 779605369 ZIJOLGBJLHFCKZ-UHFFFAOYSA-N 332.378 5.007 30 20 EKED O=C1/C(=C\c2cnc(C3CCC3)s2)CCc2[nH]c3ccccc3c21 781550947 DEHIVKLMVPJOKH-RAXLEYEMSA-N 334.444 5.104 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)c1ccccc1F 789720111 UTIGGDASNQHCEJ-UHFFFAOYSA-N 347.380 5.408 30 20 EKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 794945303 LVHLRPZKQLAGFH-FPYGCLRLSA-N 337.709 5.082 30 20 EKED CSc1ccccc1[C@@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 800023481 CPMFOZAYYRXZNW-NVXWUHKLSA-N 339.460 5.100 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc(C)c(NC(C)=O)c1C 822926791 QOSJKDURDLXCKJ-MRXNPFEDSA-N 346.515 5.587 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC(F)(F)C(F)(F)F 867727088 QHJONJIRMYEHTB-UHFFFAOYSA-N 335.316 5.065 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)c1sc2c(C)cccc2c1C 1776013967 XYUJCIGHPSHGIV-UHFFFAOYSA-N 338.432 5.052 30 20 EKED O=C(O)c1ccc(NN=C2CCCC[C@@H]2C2CCCCC2)cc1F 1776075329 AGQMIPSSPVMPAS-OAHLLOKOSA-N 332.419 5.062 30 20 EKED Cc1ccc(-c2cccc(/C=C/C(=O)c3csc(C(=O)O)c3)c2)cc1 1777429645 BBKCMLIPZSFXMH-JXMROGBWSA-N 348.423 5.318 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1sccc1C 56469586 LOFIJOGQQBZEDS-UHFFFAOYSA-N 348.427 5.281 30 20 EKED C=CCOc1ccccc1CN[C@@H](c1ccc(Cl)cc1)C1CC1 60843033 XBPOIFQMVWXXHQ-HXUWFJFHSA-N 327.855 5.146 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1CCC(F)(F)F 126091777 QNJXEUVWSRIBHT-UHFFFAOYSA-N 342.405 5.392 30 20 EKED Cc1ccc(C)c2c1CCC[C@H]2N[C@H](CCCC#N)c1ccccc1 340431017 BMGFKVVMCLCUJG-FGZHOGPDSA-N 332.491 5.706 30 20 EKED Cc1cc2c(cc1C)[C@H](N[C@@H](CCC#N)c1ccccc1)CCS2 427519361 OSIRJUZODHNWFO-VQTJNVASSA-N 336.504 5.475 30 20 EKED N#CCCCC(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1 462025845 GMZBQCVMBNFIHO-UHFFFAOYSA-N 330.840 5.124 30 20 EKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)c1cccc(C)c1 463261405 DYFVMPQHGWIZHG-KRWDZBQOSA-N 349.503 5.217 30 20 EKED C=CCC[C@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1ccccc1 469680838 PGLTWCRFSYDEJF-JCYILVPMSA-N 339.401 5.179 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(C)c1 475584858 QMGFBWVMYMGWIU-UHFFFAOYSA-N 336.479 5.511 30 20 EKED C=CCCCC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 479212741 STTOLXGQURSITE-GFCCVEGCSA-N 348.899 5.305 30 20 EKED C=CCCCC(=O)N(C)[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 479600919 SDLPSIVJUBFFKG-INIZCTEOSA-N 342.508 5.303 30 20 EKED Cc1ccc([C@H](Nc2cc(Cl)ccc2C#N)c2ccccn2)cc1 480575378 FWKIRTWXWMADOM-FQEVSTJZSA-N 333.822 5.117 30 20 EKED Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1OC(C)C 487213084 WQXQTOWQMDOSPO-UHFFFAOYSA-N 338.451 5.077 30 20 EKED C=C[C@@H](CC(=O)N1CC[C@H](c2cccc(Cl)c2)C1)c1ccccc1 496740044 SWWPSIYRYHCKHK-LPHOPBHVSA-N 339.866 5.016 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)cc2)cc1 536162873 ILQZWNIBFXSQII-FQEVSTJZSA-N 333.435 5.051 30 20 EKED C[C@@H](N[C@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 543961293 HTBHFCWSNLUVSN-HZPDHXFCSA-N 332.472 5.699 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1cc2cc(Br)ccc2o1 554363283 IGMARYYASCMCDH-LBPRGKRZSA-N 349.272 5.176 30 20 EKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 558593063 PFEXETJCOHKJJR-CQSZACIVSA-N 333.366 5.058 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727973154 SQFDBEPPWIFDOY-KHPPLWFESA-N 325.820 5.360 30 20 EKED CC[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2s1 734078917 FIOQAKOAIKASFP-HOTGVXAUSA-N 340.492 5.469 30 20 EKED COc1ccc2oc(C(C)=NNc3cc(F)c(F)cc3F)c(C)c2c1 734301768 OHOYWTFZMQEXBX-UHFFFAOYSA-N 348.324 5.003 30 20 EKED Cc1cc(OCc2ccccc2)ccc1N[C@H](C#N)Cc1ccccc1 735316833 DFPGOSIXJSIRKA-NRFANRHFSA-N 342.442 5.121 30 20 EKED C#CC[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 756996081 NTLPALDORGOQOT-KRWDZBQOSA-N 337.772 5.213 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(OCCC(C)C)cc1)c1ccncc1 766020997 SEIHPFASBWCWQW-PGRDOPGGSA-N 338.495 5.475 30 20 EKED C[C@H](NCc1ccc2oc3ccccc3c2c1)c1cccc(C#N)c1 775335518 LJIBKWFAXXUKMD-HNNXBMFYSA-N 326.399 5.308 30 20 EKED O=C(/C=C\c1ccsc1Cl)c1ccc(-c2ccncc2)cc1 790219239 HSDIKTHUJNHMQB-WAYWQWQTSA-N 325.820 5.360 30 20 EKED CC(/C=C\C(=O)c1ccc(C#N)cc1)=C\c1ccccc1OC(F)F 811685066 ILWHNAYCPIVZES-UZEUEGTNSA-N 339.341 5.002 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(C(F)(F)F)co1 871825954 CXJYJUFLZRDUDI-NSHDSACASA-N 340.370 5.305 30 20 EKED C[C@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1ccc(C#N)cc1F 926148783 TUQAVVXCTRKBCH-ZJUUUORDSA-N 342.361 5.189 30 20 EKED Cc1ccc(-c2cccc(C=NNc3cccc(C(=O)O)c3C)c2)cc1 1776087355 WYBFOQCOPMBUII-UHFFFAOYSA-N 344.414 5.115 30 20 EKED C[C@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccc(C#N)cc1 154328701 FIXQWFJCQONYPC-UWVGGRQHSA-N 325.264 5.338 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1Cl 247707865 GLGIMAAJVMEMFX-LJQANCHMSA-N 346.817 5.248 30 20 EKED Cc1nnc(S[C@H](C)c2cccc(C#N)c2)n1[C@@H]1CCC[C@@H](C)C1 248923972 LGKPRLKLRGNWRN-HBUWYVDXSA-N 340.496 5.063 30 20 EKED Cc1c([C@H](/N=C(/O)[C@@H]2CCC(=O)[C@H](C)C2)C(C)C)oc2ccccc12 328895748 BOCIVRBYJYCBEJ-ZXYWRSMDSA-N 341.451 5.400 30 20 EKED Cc1c(N=C(O)[C@H](C)/N=C(/O)C2CCCCC2)sc2c1CCCC2 329777266 OWSDUPVNNRLXQX-ZDUSSCGKSA-N 348.512 5.449 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1nc2ccccc2s1 409447951 YJVHEICIGJIMMX-INIZCTEOSA-N 327.497 5.153 30 20 EKED CC(C)O[C@H](CSCc1ccc(CC#N)cc1)c1ccccc1 427663178 CJJQEVAGTDZKMZ-HXUWFJFHSA-N 325.477 5.152 30 20 EKED N#CCCC[C@@H](NCCCc1ccccc1Cl)c1ccccc1 433021150 VXYCPQVLBWQJRR-HXUWFJFHSA-N 326.871 5.297 30 20 EKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2cccc(CC#N)c2)c1 455916818 JLJBVVMIUHSBSK-NRFANRHFSA-N 347.462 5.210 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466230951 APKZMLSRRUFNIG-SJORKVTESA-N 332.447 5.005 30 20 EKED C=CCCC(=O)N1CCCCC[C@@H]1c1ccc(C(F)(F)F)cc1 471337236 PUUKQSLXUZNDEE-MRXNPFEDSA-N 325.374 5.115 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccc(C(F)(F)F)c1 480871088 ZZCNCEUNDYDEJP-LLVKDONJSA-N 338.760 5.081 30 20 EKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)csc2c1 483716640 ZBOXDTPNGCYFIE-ZDUSSCGKSA-N 340.473 5.280 30 20 EKED Cc1c(C(=O)Nc2ccc(Cl)c(C#N)c2)oc2ccc(Cl)cc12 494740247 XSIMQNFAKMODMI-UHFFFAOYSA-N 345.185 5.172 30 20 EKED CC(C)c1ccc(-c2ncc(CN3CCC(CC#N)CC3)s2)cc1 541951203 CNBSFKQFUAXEPB-UHFFFAOYSA-N 339.508 5.059 30 20 EKED CC(C)(C#N)CC[S@](=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 555509381 QYQDOEHALDXHGX-JPYJTQIMSA-N 345.895 5.118 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(F)c2ccccc12 590254393 UDAHHENHLQSRQJ-PEBXRYMYSA-N 330.406 5.189 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)NC1(c2ccc(C#N)cc2)CCC1 594516332 CMMFUZRHRKRILY-OAHLLOKOSA-N 339.508 5.177 30 20 EKED Cc1ccc(C(F)(F)F)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 598869322 FMBBZRJUZFTMPW-OAHLLOKOSA-N 346.352 5.040 30 20 EKED CSc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1Br 600853140 XBXKSKHYDRDDGB-NSHDSACASA-N 347.281 5.216 30 20 EKED C[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1cccc(C#N)c1 618984887 KKSDITFAOXVWJB-AVRGHOLYSA-N 330.884 5.116 30 20 EKED CCc1cnc(CON=C(C)c2ccc(-c3ccc(F)cc3)s2)o1 742354887 QONWGBOCJYJEOS-UHFFFAOYSA-N 344.411 5.045 30 20 EKED CC(C)Cc1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 759442068 XWAUDBXGFXCQMN-MAUKXSAKSA-N 346.430 5.006 30 20 EKED Cc1ccc(CCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 797572567 CKXMXBAKQYZRJG-AWEZNQCLSA-N 346.521 5.010 30 20 EKED C=C[C@H](CC)CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 904083542 LMNNIMYZZOPDKW-LLVKDONJSA-N 338.835 5.203 30 20 EKED N#Cc1ccc(C2(c3nc(-c4ccccc4Cl)no3)CCCC2)cc1 904566353 ALYPXRCPGMTKNH-UHFFFAOYSA-N 349.821 5.122 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1OCCCC 1776787093 POWWZUUTLGFNDY-IBGZPJMESA-N 349.515 5.159 30 20 EKED Cc1ccc(C)c([C@H](C)N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)c1 151288753 UFKXKWGPWSODIZ-RXVVDRJESA-N 349.478 5.051 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccccc1F 189889606 YQVZXRGIZJDMRC-INIZCTEOSA-N 339.454 5.495 30 20 EKED Cc1cc(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)ccc1Cl 330017563 RIGYJUWLCBFIKP-UHFFFAOYSA-N 348.874 5.030 30 20 EKED Cc1ccc(Cl)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1C 425676440 DSWIRVCLXTWQPL-CQSZACIVSA-N 341.842 5.053 30 20 EKED Cc1ccccc1[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)C(C)C 438846740 KRMYSFQTHOAFLG-LEWJYISDSA-N 349.478 5.036 30 20 EKED N#Cc1ccc(CSCc2nc(C(F)(F)F)cs2)c(Cl)c1 438879979 SLQCSQMENXEMKA-UHFFFAOYSA-N 348.802 5.120 30 20 EKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 461922637 NOXQIKSWIIEKBX-HOTGVXAUSA-N 346.430 5.018 30 20 EKED Cc1ccc(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)s2)cc1 477319796 HMMJHBPIVQTVCE-MRXNPFEDSA-N 332.472 5.446 30 20 EKED C=C(C)[C@H](NC(=O)Nc1c(C)cccc1CC)c1ccc(F)c(F)c1 479780559 YGURACJKVMGAIG-SFHVURJKSA-N 344.405 5.275 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCC(C)C)c1 510639313 VRYOLEQZUZWWNQ-UHFFFAOYSA-N 344.480 5.003 30 20 EKED CCCCN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CC1 510660193 GDDKORBRRDTZDK-UHFFFAOYSA-N 349.434 5.147 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 534474149 YHAQUAKMFOIVQJ-GVDBMIGSSA-N 342.508 5.237 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)s1 540604547 XNRQYMYBUUGPSG-SFHVURJKSA-N 330.884 5.294 30 20 EKED C=CCC[C@H](NCc1ccncc1OCc1ccccc1)c1ccco1 552317444 AVGOJLSEEKPXFX-FQEVSTJZSA-N 348.446 5.051 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 557272587 BEPWSRRORSKWQV-SCLBCKFNSA-N 333.262 5.689 30 20 EKED N#C[C@@H](Sc1nc(-c2ccccc2)co1)c1ccc(Cl)cc1 588310529 XEPYTEHOSLXKKV-MRXNPFEDSA-N 326.808 5.352 30 20 EKED C[C@@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1cccc(C#N)c1 611438755 IKWQVVCTKHMZJU-HZPDHXFCSA-N 340.426 5.869 30 20 EKED CC(=NNc1ccc(OC(F)F)cc1)c1oc2ccccc2c1C 726427127 QTBGUVIFJIAGQY-UHFFFAOYSA-N 330.334 5.179 30 20 EKED C[C@@H]1C[C@H](CC(=O)[C@H](C#N)c2ccc3ccccc3n2)CC(C)(C)C1 727629218 PJDXFBJQMLEPNA-JFIYKMOQSA-N 334.463 5.264 30 20 EKED C[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 734079641 FCVSLNSNUFUUMB-SMDDNHRTSA-N 346.883 5.342 30 20 EKED Cc1ccc(N(CCC#N)C(=O)C2CCC(c3ccccc3)CC2)cc1 742593564 SFAYYQXXNYPYEQ-UHFFFAOYSA-N 346.474 5.216 30 20 EKED CC(C)Cc1ccc([C@H](NCc2ccc(OCC#N)cc2)C2CC2)cc1 750877486 AIDVHPHJQXENEI-QHCPKHFHSA-N 348.490 5.028 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2C[C@@H](C(C)C)c3ccccc32)c1 774243401 KJZBLQLPGQALEN-YFXJRYMSSA-N 348.490 5.342 30 20 EKED C=CC[C@H](OC(=O)CCc1ncc(-c2ccccc2)o1)c1ccccc1 778737665 CXWZJCNMGCPDGM-IBGZPJMESA-N 347.414 5.135 30 20 EKED C#CCC1(C(=O)N(C)[C@@H](C)c2sc(C(C)C)nc2C)CCCCC1 789664160 QEUBVHHRHWCHIL-INIZCTEOSA-N 346.540 5.068 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CN(CC)c1ccccc1 789719028 NAHMBMHYRBCYLR-UHFFFAOYSA-N 336.479 5.004 30 20 EKED C=C[C@@H](CC(=O)O[C@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798669861 MWXUCLDVMBAAQN-KGLIPLIRSA-N 349.352 5.065 30 20 EKED C/C(=C/c1ccccc1C(F)(F)F)COC(=O)CCCCCC#N 805984399 OJRRXLHLIUYTQA-OWBHPGMISA-N 339.357 5.126 30 20 EKED C=CCOc1cccc(CNc2cccc3oc(C(F)(F)F)nc23)c1 864008798 GXPMCPXDETZZQK-UHFFFAOYSA-N 348.324 5.024 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)CC(F)(F)F 890166078 XEPVNYOSCAFTCH-UHFFFAOYSA-N 341.417 5.846 30 20 EKED CCCCOc1cc(/C=C/C(=O)c2cc(F)ccc2F)ccc1OC 916134163 FQFYEJSDWVRCNX-WEVVVXLNSA-N 346.373 5.048 30 20 EKED O=C(O)c1ccc(NN=C2CCC[C@H](c3ccccc3)CC2)cc1F 1776075842 IPXQMXXCHFNLPW-HNNXBMFYSA-N 340.398 5.040 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1coc(-c2ccccc2)n1 159562266 UWIPDKGEZXPUBB-HNNXBMFYSA-N 349.459 5.348 30 20 EKED OC(=Nc1ncccc1OCC1CCCCC1)[C@H]1CCC(F)(F)C1 330039079 BQVINNWICLGZMW-AWEZNQCLSA-N 338.398 5.064 30 20 EKED CCc1nc(C(C)C)ccc1CN[C@H](CCCC#N)c1ccccc1 339236468 PSLSXVHXTLIXDT-JOCHJYFZSA-N 335.495 5.292 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ncc(C#N)cc1Cl 339278548 KSAYGSHECIAVRV-UHFFFAOYSA-N 341.842 5.106 30 20 EKED COc1ccc2c(c1)CCC[C@@H]2N[C@H](CCCC#N)c1ccccc1 340446792 HEWPFWZVEJTTAK-YADHBBJMSA-N 334.463 5.097 30 20 EKED C=CCc1cccc(C(C)C)c1NCCCC1(C#N)CCOCC1 347853401 AEPRJZRSKZDUML-UHFFFAOYSA-N 326.484 5.051 30 20 EKED CC(C)[C@H](c1ccccc1Cl)N(C)CCCC1(C#N)CCOCC1 410375908 ZZPOEJRJFBVVLQ-LJQANCHMSA-N 348.918 5.069 30 20 EKED C=CCOc1cccc(NC(=O)Nc2ccc(Cl)cc2Cl)c1 440783783 QITRKZSAHVAQAR-UHFFFAOYSA-N 337.206 5.202 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 464567127 GRMFLOWWQZDPET-DLBZAZTESA-N 327.493 5.440 30 20 EKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)cc1C 475179117 SPWIFYMYJHZJQN-NRFANRHFSA-N 346.474 5.082 30 20 EKED Cc1ccccc1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C 483565318 TVFPEESRBZJTHC-FQEVSTJZSA-N 349.478 5.315 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1ccc(C#N)cc1F 507028513 YIURAYYPGHKJBA-GFCCVEGCSA-N 337.423 5.302 30 20 EKED CC(C)(C#N)CCCN[C@H](c1cccc2ccccc12)C(F)(F)F 510429209 VCHYEPRPXVUEAK-QGZVFWFLSA-N 334.385 5.363 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccccc1Oc1ccccc1Cl 520637529 OYJOIHCVLUHJPW-AWEZNQCLSA-N 345.826 5.052 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 533948836 XIXLQIVPIOEFLT-KRWDZBQOSA-N 344.414 5.172 30 20 EKED C=C[C@H](CC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1)c1ccccc1 536182901 RDAGAUWIJRHXDX-FVJLSDCUSA-N 337.438 5.095 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 536835228 WJYVEMKDDABNFW-PXNSSMCTSA-N 330.431 5.642 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 539052277 TWDRPIKUKLONIF-FZKQIMNGSA-N 333.262 5.689 30 20 EKED N#CC1(c2ccc(C(=O)Nc3cc(C(F)F)ccc3Cl)cc2)CC1 554236443 RBDVJZVZBQHYDP-UHFFFAOYSA-N 346.764 5.085 30 20 EKED C=C(C)C[C@H](C)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 577560617 DIZOLPDOCDZXAM-GWCFXTLKSA-N 328.309 5.217 30 20 EKED Cc1ccc(C[C@@H](C#N)SCc2ccc(Br)cc2)cc1 603452568 YZEHEJZMQXSLTF-KRWDZBQOSA-N 346.293 5.126 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 609970763 IBSYHNYPAZNAJE-CQSZACIVSA-N 348.427 5.154 30 20 EKED CCCCCCCC(=O)Nc1cccc(CSC2CCOCC2)c1 734797274 ZGPZCPJOBPFNHZ-UHFFFAOYSA-N 349.540 5.398 30 20 EKED CC(C)(C)c1ncc(/C=C2\CCOc3ccc(Cl)cc3C2=O)s1 736433418 FKPAYAPAIILFBI-DHZHZOJOSA-N 347.867 5.143 30 20 EKED CCCCCCCCC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1 739780336 PBZKRGJABLSTGM-MRXNPFEDSA-N 328.456 5.269 30 20 EKED CC(C)COc1ccc(C(=O)/C=C\c2nccc3ccccc23)cc1 740764336 RPPHNSLQLNJCGS-QXMHVHEDSA-N 331.415 5.166 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c(Cl)c1 745990146 LRMSMVCZGABVIZ-VQHVLOKHSA-N 349.817 5.307 30 20 EKED CSCC(=NN(c1ccccc1)c1ccccc1)c1ccccc1 749442745 DVAFMVFFQPCQMJ-UHFFFAOYSA-N 332.472 5.592 30 20 EKED Cc1cc(F)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 771250681 LNQAXUFSOVHQDT-NRFANRHFSA-N 344.389 5.042 30 20 EKED CCc1ccc([C@@H](CC)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772984557 OLBADFLFNOVZAC-IFMALSPDSA-N 336.479 5.171 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(C#N)cc3F)s2)cc1 781108968 WCWUMVWCYAIBPT-CLFYSBASSA-N 348.402 5.025 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccsc2)cc1 915179212 BFCDFGNJVOBRBE-HUQFFUELSA-N 344.439 5.055 30 20 EKED O=C(/C(=C\c1cccnc1)c1ccccc1)c1nc2ccccc2s1 916133607 CMKFNTOOBAHLPG-LGMDPLHJSA-N 342.423 5.115 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc(-c2nccs2)cc1 920944394 WNHCNJPLWHSUIK-UHFFFAOYSA-N 330.412 5.420 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1Cl 66801518 ZDUBWOWWVGANOR-NSHDSACASA-N 348.830 5.126 30 20 EKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1 67253637 BZHNSMOFPFDSLO-LJQANCHMSA-N 338.863 5.152 30 20 EKED CCCOc1ccc(/C=C/C(=O)c2cc3ccccc3o2)cc1OC 83201455 JOBWDSSBUFTFHL-CSKARUKUSA-N 336.387 5.126 30 20 EKED Cc1coc2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc12 187939805 ZFOGMNFQQLNOAC-UHFFFAOYSA-N 349.390 5.068 30 20 EKED CCn1c(SCCCCC#N)nnc1-c1ccc(C(C)(C)C)cc1 195562762 FKFPHAVKCGKMMT-UHFFFAOYSA-N 342.512 5.048 30 20 EKED Cc1cccc(/N=C2\N=C(O)/C(=C/c3cc(F)ccc3F)S2)c1 206951577 LQDSSDCOLKJUSD-DHDCSXOGSA-N 330.359 5.005 30 20 EKED OC1=Nc2cc(F)ccc2[C@@H](/C(O)=N/C[C@@H]2C[C@H]2C2CCCCC2)C1 329344495 QMWQXTLAYJHUJK-JQFCIGGWSA-N 344.430 5.074 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)C1CCCCCC1)C(O)=N2 329379037 PFDHVODGBUAKLG-INIZCTEOSA-N 328.456 5.251 30 20 EKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1c1cccs1)c1ccccc1 435110296 ILYICAZCLAAONY-ZWKOTPCHSA-N 340.492 5.302 30 20 EKED N#Cc1ccccc1S[C@H](C(=O)Nc1ccccc1)c1ccccc1 439705040 HGWJLYKBYVKKHI-FQEVSTJZSA-N 344.439 5.030 30 20 EKED C=CCC[C@@H](NC(=O)c1ccoc1C)c1ccc(C(F)(F)F)cc1 441588762 LWZSUJLSEIBWDU-MRXNPFEDSA-N 337.341 5.044 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(-c2ccco2)nn1C(C)C)c1ccccc1 447860799 JSLRJIXJDLZBRI-QGZVFWFLSA-N 349.434 5.022 30 20 EKED C=CCC(CC=C)C(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 478811391 ICWRLNNDCUMHEF-UHFFFAOYSA-N 349.396 5.090 30 20 EKED C=C(C)[C@@H](NCc1cc(-c2ccccc2)no1)c1ccc(F)c(F)c1 481603606 ZKEKXRQIMGEDDM-HXUWFJFHSA-N 340.373 5.027 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(F)c3ccccc3c2)n1 498063364 WCWGBQBRPSKZOL-HNNXBMFYSA-N 338.407 5.049 30 20 EKED C=C(CN[C@H](c1cccnc1)c1cc2ccccc2o1)c1ccccc1 498413857 MLAYPVMXHLXRCA-HSZRJFAPSA-N 340.426 5.220 30 20 EKED Cc1cc(OCCCC2(C#N)CCOCC2)c(C(C)C)cc1Cl 499912781 KWRZHIGZNVSJFG-UHFFFAOYSA-N 335.875 5.251 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2ccc(C)cc2C)c1 511026328 HLVGFWYXRJVNJJ-QGZVFWFLSA-N 338.451 5.093 30 20 EKED C=CCCC(=O)N(Cc1sccc1C)c1ccc(F)c(Cl)c1 523228277 RZRTWYGXSLFIQE-UHFFFAOYSA-N 337.847 5.348 30 20 EKED CC(C)c1ccc(-c2nc(CN(CC#N)C3CCCC3)cs2)cc1 524594091 FCRCFFZXARQOTI-UHFFFAOYSA-N 339.508 5.202 30 20 EKED CC(C)[C@@H](NCc1ccccc1C#N)c1cccc(C(F)(F)F)c1 538158120 NYRGRWMTXQIULR-GOSISDBHSA-N 332.369 5.064 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1Cc2cccc(C#N)c2C1 593133164 OHGZQXUOSRYVJD-UHFFFAOYSA-N 347.462 5.353 30 20 EKED CC(C)c1ccc(-c2ncc(CN3CCC[C@@H](CC#N)C3)s2)cc1 595611252 IJSMOYIUIPWQSF-INIZCTEOSA-N 339.508 5.059 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 607838397 JJONMVNNHXGICW-AWEZNQCLSA-N 327.390 5.014 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@@H](C#N)C3CCCCC3)cc2)cs1 609676985 JMUOKLKVERDYAP-KUHUBIRLSA-N 339.508 5.242 30 20 EKED CCCCc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611093157 HFRZYHZFSSCGGF-UHFFFAOYSA-N 347.245 5.460 30 20 EKED C=Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 760109848 GUDDVOGABMUIDR-JOCHJYFZSA-N 338.410 5.237 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1cncc2ccccc12 772806565 LZYYWWDHPHRPEP-KTKRTIGZSA-N 336.460 5.193 30 20 EKED COc1c(Cl)cc(N[C@@H](C)c2ccc(C#N)cc2F)cc1Cl 781420263 AVEZAQXGIHHPOW-VIFPVBQESA-N 339.197 5.186 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(C)cc1 792092552 CXJIBRVYXYPLNL-DYESRHJHSA-N 342.442 5.303 30 20 EKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792094794 QWNCBHIURLBRHE-OAQYLSRUSA-N 342.442 5.133 30 20 EKED C=CCC[C@H](NC(=O)c1cc(C2CC2)cnc1Cl)c1ccccc1 793698355 YGQSCECVDOMMFZ-SFHVURJKSA-N 340.854 5.050 30 20 EKED c1ccc(-c2csc(NN=C3CCC[C@@H](c4cccnc4)C3)n2)cc1 799873789 XVAXRVWPNMDOCE-MRXNPFEDSA-N 348.475 5.331 30 20 EKED Cc1ccc(-c2cc(CNc3ccccc3SCCC#N)on2)cc1 172905375 SEQMGLNGZJFABZ-UHFFFAOYSA-N 349.459 5.268 30 20 EKED COc1ccc2cc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)ccc2c1 327312111 VRSSVNCPFMYRTR-HOTGVXAUSA-N 330.431 5.132 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F 410377121 ZVKPQEJLFVLPLS-GJZGRUSLSA-N 325.374 5.112 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc3ccccc23)s1 430621014 CSTSAOUWCCNGDC-LBPRGKRZSA-N 340.473 5.145 30 20 EKED CC(C)(C#N)c1ccccc1COc1cnccc1-c1ccccc1 434759665 WZHFWHAGMXTWEP-UHFFFAOYSA-N 328.415 5.129 30 20 EKED C=CC[C@H]1N(C(=O)Nc2cc3[nH]ccc3cc2C)CCCC1(C)C 445156015 GRZIHJCBDYRSLK-GOSISDBHSA-N 325.456 5.075 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCC#Cc1ccccc1Cl 446991267 WHYNCVSJYZKVFM-HNNXBMFYSA-N 340.879 5.198 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCOC1CCCCC1 475554534 SEWKHALNQOCNDG-UHFFFAOYSA-N 344.499 5.009 30 20 EKED C=CCC1(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)CCC1 478006911 XTKBBCZWEUFMCO-UHFFFAOYSA-N 349.434 5.016 30 20 EKED C/C=C/c1ccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)cc1 497381880 DFGTYFDWJCVXEP-HWKANZROSA-N 333.435 5.035 30 20 EKED Cc1sc(NC(=O)CC(C)(C)C#N)nc1-c1cccc2ccccc12 506520446 ZZZNQEHSYAKAAV-UHFFFAOYSA-N 349.459 5.150 30 20 EKED CC(C)COc1ccccc1NCc1cccc(OCCCC#N)c1 532890627 HILMBCVLONESLO-UHFFFAOYSA-N 338.451 5.016 30 20 EKED C=CCC[C@H](NCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 537129321 PLWROJIGFOZKFL-KRWDZBQOSA-N 338.417 5.632 30 20 EKED COc1ccc(Cl)cc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 550826141 AJJPGDMZZKPIBP-DNVCBOLYSA-N 342.870 5.434 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCc3c1ccc(Cl)c3Cl)CC2 565450196 LGHGGPHRUCCTRC-MSOLQXFVSA-N 343.257 5.129 30 20 EKED N#CC1(CC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)CCCCC1 597172728 BJXHYGVOZXYRSB-FQEVSTJZSA-N 349.478 5.086 30 20 EKED Cc1cc(NC(=O)C[C@H](CC#N)c2ccccc2)cc(C(F)(F)F)c1 619449936 RAHMCXRZGFGDNY-HNNXBMFYSA-N 346.352 5.040 30 20 EKED C=CC[C@H](N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 766020429 PJDDHELVAXUQSY-BEFAXECRSA-N 349.503 5.482 30 20 EKED CC(C)(C)C1C/C(=C\c2cncs2)C(=O)/C(=C/c2cncs2)C1 767718870 YDHKSQLTUBAREV-PWHKKFIBSA-N 344.505 5.092 30 20 EKED C=C(C)[C@@H](NC(=S)Nc1ccccc1CC)c1ccc(F)c(F)c1 774205574 LCOPAMPJKBFCGS-GOSISDBHSA-N 346.446 5.131 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1csc(Cl)c1 787186678 RGFYFMKBVJYFHM-ARJAWSKDSA-N 337.878 5.483 30 20 EKED C#CC[C@H](N[C@@H](c1cccc(OC(C)C)c1)C(F)F)c1ccccc1 788684379 CVYCUKHMAVAVLC-PMACEKPBSA-N 343.417 5.134 30 20 EKED C[C@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC=CCC1 822495247 CLOQNUDHXYUHFY-IRLDBZIGSA-N 330.431 5.027 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3)cc2)c1 844257127 OFOATSVGQVONOD-UHFFFAOYSA-N 344.439 5.269 30 20 EKED C#Cc1cccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)cc2Cl)c1 915339642 BWLLLMAOJIMKNW-GFCCVEGCSA-N 347.245 5.200 30 20 EKED Cc1c(C(=O)/C=C/c2csc(-c3ccccn3)n2)oc2ccccc12 915987630 JDEMMGCPJNWFLR-MDZDMXLPSA-N 346.411 5.156 30 20 EKED CCCCCCCCC(=O)Nc1ccc(Sc2nncs2)cc1 918165895 CCNPBTHSTIFVEF-UHFFFAOYSA-N 349.525 5.378 30 20 EKED CCc1c(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)oc2ccccc12 1776956344 ZUMUQMFDPXHKBW-MDZDMXLPSA-N 348.398 5.206 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2occc2-c2ccccc2)n1 80458040 QLAUDCVXBXBFLL-HNNXBMFYSA-N 336.416 5.017 30 20 EKED CCC[C@H]1CCCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 185198230 FVUCHSYLLCSJAT-HOTGVXAUSA-N 345.512 5.125 30 20 EKED CC(C)[C@H](C)N1Cc2cccc(N[C@H](C)c3ccc(C#N)cc3)c2C1 246440664 UNDSPCAIVBIGSD-SJORKVTESA-N 333.479 5.091 30 20 EKED CC(O)=Nc1ccc(S[C@H](C)/C(O)=N/[C@@H]2CC23CCCCC3)cc1 329122625 RGKPTACKKDDHAG-CXAGYDPISA-N 346.496 5.454 30 20 EKED CC(C)(C#N)CCCCNC1(c2ccc(Cl)c(Cl)c2)CC1 439312045 BGZZGKBCKNRWQN-UHFFFAOYSA-N 325.283 5.292 30 20 EKED CCCc1ccc(-c2ccc(NC(=O)N(C)[C@@H](C)CC#N)cc2)cc1 444396284 JGIHDDZOWDCJHH-INIZCTEOSA-N 335.451 5.072 30 20 EKED CC[C@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1 447533646 YBRCSWNDKKAGGQ-ROUUACIJSA-N 332.369 5.293 30 20 EKED Cc1ccccc1[C@@H](C)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458799535 JMNUZWRJCODPID-WIYYLYMNSA-N 349.478 5.133 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H](c2ccc(Cl)cc2)c2ccsc2)C1 463300687 LCDDBVJHRJKMFP-JEBQAFNWSA-N 330.884 5.163 30 20 EKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Cl 468823076 DROISVXFRISLOS-CYBMUJFWSA-N 344.867 5.295 30 20 EKED Cc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2ccccc2)cc1 470439550 WKLWDFQERLVZHD-MRXNPFEDSA-N 348.475 5.027 30 20 EKED C[C@@H](Oc1ccccc1NC(=O)c1ccc(C#N)s1)c1ccccc1 487025800 CPKVLYXZQPISSW-CQSZACIVSA-N 348.427 5.012 30 20 EKED C=CCC[C@@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccco1 513666059 JANAJNKRXUSPAP-MRXNPFEDSA-N 339.357 5.018 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(Oc2ccncc2)c1 524832027 NOSCUJWMSGIOBZ-UHFFFAOYSA-N 339.439 5.084 30 20 EKED COc1ccc2cc(CN[C@H](CCCC#N)c3ccccc3)ccc2c1 552311981 KQMWXVTZSMBMEJ-HSZRJFAPSA-N 344.458 5.373 30 20 EKED CC(C)(C#N)CCSCc1ccc(Br)c2cccnc12 579756547 FLCHQHUUXQJIAZ-UHFFFAOYSA-N 349.297 5.170 30 20 EKED N#Cc1ccccc1NC(=O)c1ccc(CSc2ccccc2)cc1 598543988 MEJUPNXBZQSMNS-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610361403 COXGFFSELGWBRU-SJORKVTESA-N 334.463 5.053 30 20 EKED CC(C)c1nc2cc(NCc3cccc(OCCCC#N)c3)ccc2o1 610909672 HUXMPDIPNHPBKS-UHFFFAOYSA-N 349.434 5.246 30 20 EKED CCCC1C/C(=C/c2cccnc2C)C(=O)/C(=C\c2cccnc2C)C1 728785234 AMUMEMMKUYIGDV-HHQODBOJSA-N 346.474 5.340 30 20 EKED CCCCCC[C@H](C)NN=C(C)c1sc(-c2cccnc2)nc1C 743450531 LKLZNLDFNVUIKP-AWEZNQCLSA-N 344.528 5.186 30 20 EKED N#Cc1ccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)s1 749308786 CLXJHONATTVPHI-UHFFFAOYSA-N 332.388 5.287 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@@H]1c1cn(C)nc1C 775183485 VROZJBPABJVJBK-FXAWDEMLSA-N 347.547 5.169 30 20 EKED Cc1ccncc1CCC=NN(Cc1ccccc1)c1ccccc1 776722210 NZEUVKAMBGWCNE-UHFFFAOYSA-N 329.447 5.015 30 20 EKED N#C[C@@H](C(=O)CCCc1ccc(Cl)cc1)c1nccc2ccccc12 792094498 ONISNFWXZYJKBG-IBGZPJMESA-N 348.833 5.087 30 20 EKED C=CC[C@H](C(=O)O[C@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798671104 XMGICFGSDBPOOJ-CJNGLKHVSA-N 349.352 5.065 30 20 EKED Cc1ccc(CCCCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 63576018 GGRZAPMQNPBCHU-UHFFFAOYSA-N 348.490 5.017 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)s1 75416191 NELASFPBDHDJQJ-GFCCVEGCSA-N 331.466 5.095 30 20 EKED CCCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1CC1 171380707 KDOPMCACSKBVKD-UHFFFAOYSA-N 349.434 5.065 30 20 EKED N#CCC[C@@H](NCc1ccc(Oc2ccccc2)o1)c1ccccc1 181032217 ONBXCHGHOXGNAM-HXUWFJFHSA-N 332.403 5.207 30 20 EKED Cc1c(C#N)cccc1NC(=O)Nc1ccc(CCC(F)(F)F)cc1 432295317 WBIJBOKIJOKOHJ-UHFFFAOYSA-N 347.340 5.006 30 20 EKED COc1cc(C#N)ccc1CNc1ccc(C(C)(C)C(F)(F)F)cc1 432341243 VILAXBCQSSABFR-UHFFFAOYSA-N 348.368 5.019 30 20 EKED CC(C)(C#N)CCCCSCc1cc(-c2ccc(F)cc2)no1 435887797 DSGOANULGBNURX-UHFFFAOYSA-N 332.444 5.434 30 20 EKED Cc1cccc([C@@H]2CCCCN2C(=O)Nc2cccc(CC#N)c2)c1C 455918828 LOCQSAQTPKAJTO-NRFANRHFSA-N 347.462 5.129 30 20 EKED CCC(CC)[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)c1cccs1 463454550 AUQONLOXHQUMCQ-LIRRHRJNSA-N 340.492 5.017 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCCC1(C)C 467492051 KQISTZJVILDTIS-WMLDXEAASA-N 345.512 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](OCC)C1=CCCC1 476091584 PUOIYVFEYLIMSB-FQEVSTJZSA-N 341.495 5.383 30 20 EKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480809731 YUCRTINFKKFMFE-HNAYVOBHSA-N 349.434 5.003 30 20 EKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@H]1c1ccsc1 486937399 MHOQNIAEXWSKGW-KRWDZBQOSA-N 339.851 5.163 30 20 EKED Cc1c(C#N)cccc1C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 509532238 IQQYUYACZKHTQG-UHFFFAOYSA-N 348.352 5.064 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512624976 LCAJRYXHTUMTRB-LSDHHAIUSA-N 342.483 5.610 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(C(C)C)c1 596669240 COZSUJMFOQYYCF-INIZCTEOSA-N 327.472 5.091 30 20 EKED C[C@H](Nc1ccc(COc2ccccc2)cc1)c1cccc(C#N)c1 600850390 JOHIIUMCNSFQGX-KRWDZBQOSA-N 328.415 5.310 30 20 EKED C[C@H](CC(=O)Nc1ccccc1S[C@@H](C)CC#N)CC(C)(C)C 609427763 JJSLKIZKGDLIQZ-CABCVRRESA-N 332.513 5.482 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1nc(C)cs1 613900155 AIFSNVWRUFGYSI-AWEZNQCLSA-N 328.481 5.046 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccccc2N2CCCCC2)cc1 614052851 NMNKINRAPKIBTG-UHFFFAOYSA-N 333.479 5.090 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 733749073 QUXVVZSVHMILCV-SOFGYWHQSA-N 339.372 5.121 30 20 EKED COCc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1 741849342 WQSWQWXOPRQKLX-VOTSOKGWSA-N 327.232 5.097 30 20 EKED Cc1ccc(-c2nc(/C=C3\CCc4c(O)cccc4C3=O)cs2)cc1 742434531 JJELBFLMDANNJO-RVDMUPIBSA-N 347.439 5.037 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc(F)ccc1F 757475191 PNDMZZQTCACGDF-RQOWECAXSA-N 333.384 5.046 30 20 EKED COc1cccc2cc(C(=O)/C=C\c3ccc(Cl)nc3Cl)oc12 779359810 WHYHQZJKTYIRCJ-ALCCZGGFSA-N 348.185 5.039 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3csc(C(C)C)n3)co2)cc1 787479284 ALAHQUFNLCDFQG-HJWRWDBZSA-N 338.432 5.126 30 20 EKED CC(C)c1ccc(CON=C2CCC3(CC2)OCCO3)c(C(C)C)c1 920401063 SSXIDNSVLDGKAP-UHFFFAOYSA-N 345.483 5.123 30 20 EKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2)cc1 57735881 SBCZFYUUXYONNP-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)c(Cl)c2)c1 113952464 VBEHJFCJNTYGBF-BBRMVZONSA-N 346.833 5.011 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 177764678 JECWQHKVXNATNN-GDBMZVCRSA-N 326.465 5.027 30 20 EKED N#Cc1ccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 213663284 MIKQMZJYZQIZCG-CXUHLZMHSA-N 341.197 5.604 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1nc(C2CCCCC2)cs1 277666374 SHZSNVASCHHIHI-AWEZNQCLSA-N 341.480 5.094 30 20 EKED CC(C)c1nc(CSCc2ccc(-c3ccccc3C#N)cc2)no1 303391056 OUQOTYNWHMULTH-UHFFFAOYSA-N 349.459 5.165 30 20 EKED Cc1c([C@H](/N=C(/O)[C@@H]2CCC(=O)[C@@H](C)C2)C(C)C)oc2ccccc12 328895745 BOCIVRBYJYCBEJ-ZBQZNYHESA-N 341.451 5.400 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)cc2cccnc12)c1ccccc1 353912174 DTUDPSOVEJPBPC-FQEVSTJZSA-N 349.865 5.413 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(-c2ccccn2)c1C 410382242 LPAIPAVDDXERGB-UHFFFAOYSA-N 342.442 5.428 30 20 EKED C[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 429463210 BELZSZICGJOPLJ-QAPCUYQASA-N 349.434 5.003 30 20 EKED Cc1ccnc(Oc2cc(N[C@@H](C)c3cccc(C#N)c3)ccc2C)c1 442792619 OOFRUBCXWWWDDB-KRWDZBQOSA-N 343.430 5.536 30 20 EKED C=CCC1(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)CCC1 478015277 IQXRDXOPIZBFCM-UHFFFAOYSA-N 349.434 5.016 30 20 EKED C[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 510075762 WCJIUWHBOSVWNL-CVEARBPZSA-N 349.434 5.003 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C(CC)CC)[C@@H]1CCCc2cccnc21 511301937 BZITUJGIARTOTQ-QFBILLFUSA-N 328.500 5.079 30 20 EKED C[C@@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)c(F)c1 539609525 JDWWVTFUVUZIMR-SJKOYZFVSA-N 336.332 5.042 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 540705223 FLHGGMOLWMLYCQ-SBUREZEXSA-N 344.433 5.332 30 20 EKED N#CC1(CCCNc2cccc(C3CCCCC3)c2)CCOCC1 600576201 SMZSIYLKWSJZDB-UHFFFAOYSA-N 326.484 5.247 30 20 EKED C[C@H](SCc1csc(Br)c1)c1ccc(C#N)cc1 609825592 HMKOUOABTJHYCC-JTQLQIEISA-N 338.295 5.377 30 20 EKED C[C@H](NC(=O)CC1CCC(c2ccccc2)CC1)c1cccc(C#N)c1 610361350 ADOHVKLEYLXIJP-XPQZIERPSA-N 346.474 5.100 30 20 EKED N#C[C@@H](C(=O)c1cccc(C2CCCC2)c1)c1nc(C2CC2)cs1 659115283 APNNWLHEPYNWHQ-KRWDZBQOSA-N 336.460 5.168 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 727952105 AOZGWUYQDGKZML-CABCVRRESA-N 328.481 5.469 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc3ccccc23)cc1 728694730 HIFHVMVFDWBLSB-QBOMHBFWSA-N 327.383 5.027 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(Cl)cc2)s1)c1cccnc1 730568377 JQSXPIZUAGLOHU-VQHVLOKHSA-N 325.820 5.360 30 20 EKED C[C@@H](CC#N)OC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 733709852 YTHQEORQQNWGDL-ZDUSSCGKSA-N 345.851 5.091 30 20 EKED CC1CCC(=CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 734101042 BWCGQKGHMKDMKR-UGNFMNBCSA-N 344.458 5.417 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(C(F)(F)F)s1 761478626 URSKCWWOBOLZFK-ALCCZGGFSA-N 342.386 5.057 30 20 EKED C[C@H](Nc1ccc(Cl)cc1OC(F)F)c1ccc(C#N)c(F)c1 762785375 FSMNLYPDKDUWJP-VIFPVBQESA-N 340.732 5.125 30 20 EKED CCC(C)(C)c1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1 776171581 UJZXJZPDMXSNGA-KRWDZBQOSA-N 336.479 5.127 30 20 EKED CC[C@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)CC1 783070197 UYONYAAMOIPUIR-DJIMGWMZSA-N 338.476 5.203 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1cnc2ccccc2n1 792102502 FJOOMJXVVCTBQJ-ZWKOTPCHSA-N 349.478 5.049 30 20 EKED CC(C)[C@H]1CC[C@H](C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)CC1 797567030 CMXDLAKLSMFGGC-KKUMJFAQSA-N 332.513 5.079 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(C)cc1 842942411 NYIFLRWYSLLNEZ-WMLDXEAASA-N 338.476 5.089 30 20 EKED CC(CCc1ccco1)=NNc1nc(Cl)c(Cl)cc1Cl 917028128 MJAPZHXIVPDBES-UHFFFAOYSA-N 332.618 5.055 30 20 EKED CCCCCCC(CCCCCC)=NNc1ccccc1C(=O)O 1776030005 BSRWMQFLBBNGOB-UHFFFAOYSA-N 332.488 6.094 30 20 EKED C[C@@H](ON=Cc1ccc(-c2ccc(C(=O)O)cc2)cc1)c1ccccc1 1776083198 RIHKWCNBYKTANG-MRXNPFEDSA-N 345.398 5.164 30 20 EKED CCC(=NNc1cccc(C(=O)O)c1C)C12CC3CC(CC(C3)C1)C2 1776088416 KQNPXXJKFFFTLV-UHFFFAOYSA-N 340.467 5.088 30 20 EKED Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1776127507 VSFVGMWKVQDCAO-VGOFMYFVSA-N 342.394 5.256 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C/c1c(C)cc(C)cc1C 1776783333 QTBCOPODOMEIDT-ZAHGZRRWSA-N 345.527 5.418 30 20 EKED C=CCC[C@H](NCc1csc([C@H](C)OCC)n1)c1ccccc1 180043901 IMRWZQLCYGFCHD-YJBOKZPZSA-N 330.497 5.038 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccccc2)C1 451337541 XREYXRNOALHHCI-IBGZPJMESA-N 348.490 5.004 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1=CCC(C)(C)CC1 455572584 CBSWKARYVPWUHP-CQSZACIVSA-N 328.481 5.156 30 20 EKED Cc1ccnc(Oc2cc(NCc3ccc(F)c(C#N)c3)ccc2C)c1 467765906 BXRHDLQAJUJZPG-UHFFFAOYSA-N 347.393 5.114 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 474697274 KHECOALTYLIMBS-UHFFFAOYSA-N 348.446 5.061 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500737681 ITHNRVZMTQCZOO-UHFFFAOYSA-N 342.398 5.220 30 20 EKED C=C[C@@H](CC(=O)N(CC)Cc1ccc(Cl)s1)c1ccccc1 535334298 WKCPOHUJHYPLEY-AWEZNQCLSA-N 333.884 5.110 30 20 EKED Cc1cc2cc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)oc2cc1C 540149567 VTPRHHTZRDXLPQ-XLIONFOSSA-N 332.447 5.745 30 20 EKED C[C@@H](NCc1ccc(CC#N)cc1)c1ccccc1Oc1ccccc1 541329051 UPECKMNUAWNGGP-GOSISDBHSA-N 342.442 5.396 30 20 EKED Cc1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)sc1C 542942164 KMXDDNUHGWWTDG-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(C)CCCCC1 570246917 COARLUCEASEDGP-HNNXBMFYSA-N 345.512 5.030 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccc(Cl)cc4)o3)CC2)c1 579149014 JDWUNZWXHKQKRC-UHFFFAOYSA-N 348.833 5.251 30 20 EKED N#CCCCCC(=O)N[C@H](c1ccccc1)[C@@H]1CCCc2ccccc21 593998905 RSFAEEUVIWSSRI-FYYLOGMGSA-N 346.474 5.048 30 20 EKED CCC[C@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccccc1 603747583 UHQMTYYZHAOTBH-NRFANRHFSA-N 349.478 5.021 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@@H](C#N)C3CCCCC3)sc2c1 610502087 ZXGVWOHGQCGXBO-AWEZNQCLSA-N 346.883 5.065 30 20 EKED Cc1cc(C#N)ccc1CSCc1nc(-c2ccsc2)oc1C 614394743 NMILWCOSJQYANG-UHFFFAOYSA-N 340.473 5.325 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 734708312 CTASMCVELLJOAV-DLBZAZTESA-N 338.451 5.247 30 20 EKED CC(CCCC(F)(F)F)=NNc1nc(-c2ccccc2)cs1 774349592 LLUQBYSCIAIBJE-UHFFFAOYSA-N 327.375 5.331 30 20 EKED C=CC[C@@H](C(=O)OCc1ncc(-c2ccccc2C)o1)c1ccccc1 778419590 ZPSCKORJJOUKKF-LJQANCHMSA-N 347.414 5.053 30 20 EKED CCCCCCCOc1ccc(/C=C\C(=O)c2ccnc(O)c2)cc1 806556718 YDJAYOOIWOWPET-XFXZXTDPSA-N 339.435 5.033 30 20 EKED C=CCSc1ccccc1NC(=O)CSc1ccccc1C 15819020 QYVUXJGJLVBMQN-UHFFFAOYSA-N 329.490 5.004 30 20 EKED CCCCCC[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 78572885 OCHDTZAYKCULIT-JKSUJKDBSA-N 347.528 5.419 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 90664587 IAPTZIOTMPMNFX-ZWKOTPCHSA-N 344.405 5.374 30 20 EKED C=C(C)[C@H](NCc1ccc(SC)c(OC)c1)c1ccc(F)c(F)c1 187368787 QUQZCUDCYNEGLX-IBGZPJMESA-N 349.446 5.102 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2c(C)cccc12 189889651 YZVWOQZEUXJEQV-UHFFFAOYSA-N 346.474 5.509 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 192755459 ZDEIEXXGHSFAKS-AOMKIAJQSA-N 330.406 5.138 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc3ccccc3c2)cc1 207991921 FVHKHUCKPYYEHB-RQPMMQJISA-N 327.383 5.027 30 20 EKED CCc1nc2c(s1)[C@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340448365 RSTARFZBMXNRDX-IAGOWNOFSA-N 339.508 5.108 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1 456383959 QDKRNYQTFDVJNH-IBGZPJMESA-N 349.902 5.157 30 20 EKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@H]1c1cccs1 461461782 BGHYNNKFTDFPOQ-INIZCTEOSA-N 339.851 5.163 30 20 EKED N#Cc1cc(F)ccc1NCc1ccccc1COCc1ccccc1 462931840 XNKSYALRMGBAOZ-UHFFFAOYSA-N 346.405 5.026 30 20 EKED C=CCOCCCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 463500032 TVBSNBYXVUABBB-UHFFFAOYSA-N 347.817 5.067 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1ccc(Cl)cc1-c1ccccc1)OCC 468287740 HLCNBWZQPICDPS-LJQANCHMSA-N 343.854 5.317 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCCC(C)(C)C#N 488808965 VWVHKYKVRYLWQL-QMHKHESXSA-N 333.541 5.514 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 512534811 VTNPVVNDKXMMSU-INIZCTEOSA-N 349.434 5.147 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc2c(c1)OCCCO2)c1ccccc1 536842113 WGTAMCMSPHQEJY-XLIONFOSSA-N 337.463 5.206 30 20 EKED CC(C)(C#N)c1ccccc1CNC1(c2ccc(Cl)cc2)CCC1 610859438 JDYDBCOFLQPHFG-UHFFFAOYSA-N 338.882 5.310 30 20 EKED C=CCSc1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 681636967 OJUGOZIJXVWVTG-QGZVFWFLSA-N 344.439 5.003 30 20 EKED CCc1nc(C)c(C(C)=NNc2ccc(Cl)cc2Cl)s1 735227821 IMXKYJDBJLDIRP-UHFFFAOYSA-N 328.268 5.157 30 20 EKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 735400694 YJMQXEWLQSINMI-WBVHZDCISA-N 340.492 5.593 30 20 EKED N#Cc1ccc(SCc2cc3ccccc3nc2Cl)c(F)c1 741447551 OEADBEASAWWAKD-UHFFFAOYSA-N 328.799 5.191 30 20 EKED O=C(/C=C\c1cnn(-c2ccccc2)c1)c1cc(Cl)sc1Cl 747195131 TXPLKTJUAJAVQV-SREVYHEPSA-N 349.242 5.137 30 20 EKED C[C@@H](C(=O)OCc1ccccc1C(C)(C)C#N)c1ccc(Cl)s1 768038734 DTXNFYPZLBMAON-GFCCVEGCSA-N 347.867 5.050 30 20 EKED C#CCOc1ccc([C@@H](C)Nc2cccc(-c3nc(C)c(C)o3)c2)cc1 777240900 FDXQHJWNGPGKLN-MRXNPFEDSA-N 346.430 5.144 30 20 EKED COc1ccc(CCC=NOc2ccccc2C(F)(F)F)c(C)c1 777443056 HWRCMEQZJGHWQZ-UHFFFAOYSA-N 337.341 5.020 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccn2)cc1C 819840338 MDVDFVRQTSZMQW-SEYXRHQNSA-N 343.426 5.174 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 829933909 YIDURLMJNSAFSR-QGZVFWFLSA-N 344.524 5.710 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@@H](C)c1ccc(C#N)cc1 919654067 CKRHAICYIYEJTF-KRWDZBQOSA-N 329.488 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(CCC#N)cc1 931063613 ZOMYURLXWMSPDT-UHFFFAOYSA-N 347.462 5.639 30 20 EKED O=C(O)c1ccc(/C=C/C(=O)c2ccc3ccccc3c2)c(Cl)c1 1776131107 HUYQKOYFZGRCJP-MDZDMXLPSA-N 336.774 5.088 30 20 EKED CCN(C(=O)c1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 71868116 LOJWWBCPLIOCSM-GFCCVEGCSA-N 347.245 5.088 30 20 EKED CC(C)c1ccc(NC(=O)N(CCC#N)CC2CC2)c(C(C)C)c1 176847473 LUFZAVPHMDTBLD-UHFFFAOYSA-N 327.472 5.091 30 20 EKED N#CCCCCN[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 178647692 HYHYAGXFKFEWGW-HNNXBMFYSA-N 345.899 5.124 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1cccc(F)c1F 182721768 WKILLAKIPLMWQM-VOTSOKGWSA-N 333.384 5.046 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1cccc(C)c1 189880295 XRJPMHWYFUIFPK-QGZVFWFLSA-N 337.463 5.253 30 20 EKED N#CCCC[C@@H](NCc1ncc(-c2ccccc2)s1)c1ccccc1 353913210 HPCYCYJKQFLMMN-LJQANCHMSA-N 347.487 5.335 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)[C@@H]1C[C@H]1c1cccs1 417322983 XEJRHFPGWLVNQT-FHLIZLRMSA-N 326.465 5.035 30 20 EKED C=CCSc1ccccc1C(=O)N(C)c1ccc(Cl)cc1F 439160765 AEVWRZMFJHRXEI-UHFFFAOYSA-N 335.831 5.034 30 20 EKED N#C[C@H]1CC[C@H](Sc2nnc(-c3ccc(F)cc3)c3ccccc23)C1 450585507 QLWSPORWLIDTSR-BBRMVZONSA-N 349.434 5.220 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C 466440276 FQZUUFYGMZVNMP-VXGBXAGGSA-N 326.267 5.041 30 20 EKED Cc1ccc(-c2nnc([C@H](C)Sc3ccc(C#N)cc3)o2)cc1C 468632031 UWTOZRXAJJNODV-AWEZNQCLSA-N 335.432 5.078 30 20 EKED C=C(C)[C@H](NCc1cc(C)c2ncccc2c1)c1ccc(F)c(F)c1 479424209 NTEZMAPLVDLETA-FQEVSTJZSA-N 338.401 5.228 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C[C@H](C)C#N)C1CC1 513677556 YIQLNLKEIMBQIB-OAHLLOKOSA-N 327.472 5.089 30 20 EKED C[C@H](NCc1ccc(OC2CCCCC2)cc1)c1ccc(C#N)cc1 538395208 GTZBHMJFINODPX-KRWDZBQOSA-N 334.463 5.121 30 20 EKED Cc1ccc(-c2ccsc2C(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610363445 XGUQXXIHWVQOHJ-HNNXBMFYSA-N 346.455 5.086 30 20 EKED C(=NN=C1c2ccccc2-c2ccccc21)c1ccc2ncccc2c1 725797877 LQLZXCNMBHYOPS-UHFFFAOYSA-N 333.394 5.087 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccccc1F 731320674 LIFZGCNEQMHNDF-LBPRGKRZSA-N 345.468 5.029 30 20 EKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1ccc(C#N)cc1 735675702 MJXFSVJGSPFBMI-ZDUSSCGKSA-N 342.851 5.108 30 20 EKED O=C(/C=C/c1c(Cl)ccc(Cl)c1Cl)c1cncc(F)c1 737445049 VKRZFNGAHIOHDN-DAFODLJHSA-N 330.573 5.077 30 20 EKED CCC(C)(CC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 752638622 YYBJDWZAFFYFDK-LJQANCHMSA-N 335.451 5.042 30 20 EKED Cc1ncsc1C(=O)/C=C/c1cnc(-c2ccc(Cl)cc2)s1 789126492 FTXMIADUIOCYIH-VOTSOKGWSA-N 346.864 5.125 30 20 EKED C=CCC(C)(C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 814576343 AVIIUJSQAVEZLB-FQEVSTJZSA-N 347.462 5.066 30 20 EKED N#CC1(CCCC[S@](=O)Cc2cc(Cl)ccc2Cl)CCC1 899392739 VMTWOMUDDZLUAT-NRFANRHFSA-N 344.307 5.106 30 20 EKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1ccc(C(=O)O)cc1 1776012477 AJYMSAYHMVUQCF-UHFFFAOYSA-N 349.434 5.022 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1C(C)(F)F 1776787006 ICQFVRGJMFHEJI-MRXNPFEDSA-N 341.442 5.092 30 20 EKED CCCCCCCC[S@@](=O)Cc1coc(-c2cccs2)n1 190757106 DKUFQGPLIRFTKQ-OAQYLSRUSA-N 325.499 5.012 30 20 EKED CSc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 193905687 YQYKHURYCJGPIO-HNNXBMFYSA-N 326.465 5.264 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1cnc(C(C)(C)C)s1 303795659 RGEVYNUCRRWLFR-CMDGGOBGSA-N 348.537 5.399 30 20 EKED N#Cc1cccc(SCc2csc(-c3ccc(F)cc3)n2)c1 435031961 DJEUGZCMIKCFMR-UHFFFAOYSA-N 326.421 5.113 30 20 EKED C[C@H](Nc1cccc(COc2cccc(F)c2)c1)c1ccc(C#N)cc1 439551358 PHOBRWUEJBLHSZ-INIZCTEOSA-N 346.405 5.449 30 20 EKED C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1 467314439 KYJGHWCSLIBOKE-KRWDZBQOSA-N 349.474 5.308 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCCCC1(C)C 469198291 IYCMOWZAESMWLU-HUUCEWRRSA-N 330.497 5.093 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 474078313 BAKDJCXGLGPIQF-ZDUSSCGKSA-N 333.218 5.019 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1F 478430915 HPEFFDNTKXKRCA-CYBMUJFWSA-N 332.806 5.335 30 20 EKED C=CCOc1cccc(CN[C@@H]2CCSc3ccc(Cl)cc32)c1 518782268 QUZYYUBCMZSCKT-GOSISDBHSA-N 345.895 5.232 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 552161006 KQBGXEXDNASPLH-UHFFFAOYSA-N 345.402 5.054 30 20 EKED CC(C)(C#N)CCCCN1CCC(c2c[nH]c3ccc(F)cc23)CC1 553993625 VPGQJDFXVXXSIO-UHFFFAOYSA-N 341.474 5.206 30 20 EKED C=C[C@H](CC(=O)Nc1cnccc1-c1ccccc1)c1ccccc1 555529708 GTGAKIRIOPCZGM-QGZVFWFLSA-N 328.415 5.047 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1ccccc1SCc1ccco1 610907296 BNUBBMLUHWMMJM-UHFFFAOYSA-N 348.427 5.004 30 20 EKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(F)c(Cl)c1 732626129 YVQNODVNQAURGY-UHFFFAOYSA-N 340.895 5.244 30 20 EKED C=CC[C@@H](NC(=O)N1CCCCC[C@@H]1c1ccccc1)c1ccncc1 734681808 ZMQWUVVBQIPMQK-NHCUHLMSSA-N 349.478 5.026 30 20 EKED C[C@H]1/C(=C\c2ccccc2OCc2cccnc2)C(=O)c2ccccc21 809159612 SLNJZHVJQSXDPW-WMRWHDLOSA-N 341.410 5.044 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@H](C)c1nc2ccccc2[nH]1 919655731 YWZFNUDQUCLZRZ-MRXNPFEDSA-N 344.503 5.016 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2c(F)cc(C(=O)O)cc2F)cc1 1776700068 UMTCXJAHBMKHLV-BCPZQOPPSA-N 344.357 5.073 30 20 EKED CCCCCC1CCC([C@H]2CC[C@@](C#N)(CCCCC)CC2)CC1 2382215032 HFBISKRSUBYSCV-XIFOHQAOSA-N 331.588 7.654 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(Cl)s1 71813549 MIZYJZZFTZSMDZ-AATRIKPKSA-N 349.839 5.560 30 20 EKED C=C(C)[C@H](NCc1cnc(-c2ccco2)s1)c1ccc(F)c(F)c1 193222888 JBOVBMZMHMIVAH-KRWDZBQOSA-N 346.402 5.088 30 20 EKED N#Cc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCCCC2)o1 237668175 NJUOSAMSWAEKOW-UHFFFAOYSA-N 348.368 5.119 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1 255871379 DYUDIGXZQWVPEP-MQGYJPLLSA-N 346.213 5.180 30 20 EKED N#Cc1c(CNc2cccc(C(F)F)c2Cl)cn2ccccc12 447046313 GSFFRJAQXSIIBB-UHFFFAOYSA-N 331.753 5.014 30 20 EKED CC[C@H](C)n1c(SCCCC(C)(C)C#N)nnc1-c1ccccc1 476495937 XHTHCZIVQRHWRS-HNNXBMFYSA-N 342.512 5.338 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1cccc(C(F)(F)F)c1 480871090 ZZCNCEUNDYDEJP-NSHDSACASA-N 338.760 5.081 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 523110740 AYOLSQPNHZEMRW-IRXDYDNUSA-N 334.463 5.053 30 20 EKED C[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)c(F)c1 538508166 ZOUIYZYKDUDWBL-QWRGUYRKSA-N 337.225 5.416 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 538526480 JYNUHBPTKMEGKF-HNNXBMFYSA-N 334.872 5.647 30 20 EKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 559865540 RNGRZZZGKWSXCU-YLJYHZDGSA-N 332.447 5.827 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 578683535 ZAAUCULWZBNFDE-KSFYIVLOSA-N 334.463 5.074 30 20 EKED C=CCOc1ccc(CNc2ccc([C@@H]3CCOC3)cc2)cc1Cl 582110631 DCVRMGBATXMERG-QGZVFWFLSA-N 343.854 5.021 30 20 EKED CC(C)Oc1ccc([C@@H](C)NCc2ccc(CC#N)cc2)cc1Cl 592391484 YFLGNWVNGIHTDM-OAHLLOKOSA-N 342.870 5.044 30 20 EKED COc1ccc([C@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 611438522 AHEUIQSXYYUUCS-UZUQRXQVSA-N 342.442 5.007 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2=CCCCC2)cc1 730170473 FRLJJXPFTXVBEJ-NRFANRHFSA-N 330.431 5.171 30 20 EKED Cc1ccccc1[C@@H](NCc1ccc(N(C)CCC#N)cc1)C(C)(C)C 751152721 NUHHVNAKRDORQN-JOCHJYFZSA-N 349.522 5.222 30 20 EKED CSc1ccc(C(=O)/C=C/c2nc3ccc(F)cc3s2)cc1 761475412 CGDFKDCCTPSYIL-CMDGGOBGSA-N 329.421 5.053 30 20 EKED C#CCOc1ccc([C@@H](C)N[C@H](C)c2csc3ccccc23)cc1 776723685 SCDDSONKDLUUMZ-HZPDHXFCSA-N 335.472 5.325 30 20 EKED CC(C)(C)c1cnc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)s1 790601171 QVHYFMICFIUNCJ-CMDGGOBGSA-N 348.471 5.399 30 20 EKED COc1cccc2cc(C(=O)/C=C/c3ccnc(Cl)c3Cl)oc12 791436089 ZDDZDAJWXIBNAN-AATRIKPKSA-N 348.185 5.039 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)o1 810237613 JDIXQPCSJGGBND-VQHVLOKHSA-N 339.372 5.121 30 20 EKED N#CCCCCCC(=O)O[C@H](c1ccc2ccccc2c1)C(F)(F)F 851584064 WYAMCUQYNAIACQ-GOSISDBHSA-N 349.352 5.460 30 20 EKED C=C1CCC(c2nc(-c3cccnc3Oc3ccccc3)no2)CC1 904457996 LCYDUMVBPAEHKK-UHFFFAOYSA-N 333.391 5.138 30 20 EKED O=C(/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1OC(F)F 916140446 UWFVPJWTXMERJR-GHXNOFRVSA-N 340.325 5.043 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccccc1C#N 172679309 YEFFWQWGZCRIMP-HNNXBMFYSA-N 338.476 5.109 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](CC(F)F)c1ccccc1 421877276 LOILLMWUPKOCSN-UXHICEINSA-N 340.417 5.312 30 20 EKED CCSc1cccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 430621856 KQBBOVGSOUIODI-CQSZACIVSA-N 344.505 5.043 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 466837087 JGVAEKVWOAVYKT-MLGOLLRUSA-N 326.267 5.259 30 20 EKED CCCOc1ccccc1[C@H](CC(C)C)NCc1cccc(C#N)c1 467769369 IGGMDFKPLDUACJ-NRFANRHFSA-N 336.479 5.224 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)C(F)(F)F 475557323 YBDUDTBCXASDKP-AWEZNQCLSA-N 328.378 5.001 30 20 EKED CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1SC[C@@H](C)C#N 475759901 CNLWWGUUFVKGIH-ARFHVFGLSA-N 330.497 5.093 30 20 EKED C=CCC1(C(=O)Nc2ccc(COCc3ccccc3)cc2)CCC1 480024339 YWLDOPWTKVEUSZ-UHFFFAOYSA-N 335.447 5.088 30 20 EKED CCc1ccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 503227626 XEPVYFJPUVVARG-AWEZNQCLSA-N 339.464 5.145 30 20 EKED CCC(CC)[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccs1 512662419 XCKIRJBGDAVTQL-ORAYPTAESA-N 330.472 5.587 30 20 EKED N#CCCCCSc1nc2ccccc2n1CCc1ccccc1 512820807 KODICDUBXJBXEU-UHFFFAOYSA-N 335.476 5.065 30 20 EKED CCc1ccc([C@@H](C)CC(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1 523111257 IBFZWOABKBGRMD-ZWKOTPCHSA-N 348.490 5.224 30 20 EKED C=CCC[C@H](NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 552252712 UNIUUIIASIGBAH-INIZCTEOSA-N 339.357 5.104 30 20 EKED C=CCC(C)(C)c1noc(COC(c2ccccc2)c2ccccc2)n1 560014200 VADWNZJQRVEVRH-UHFFFAOYSA-N 348.446 5.230 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(SCC(F)F)cc1 610829948 SVXUDCXSPSDLLU-UONOGXRCSA-N 346.446 5.327 30 20 EKED N#CCC[C@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccccc1 611337064 LMJQLPOKNWWQBM-ZWKOTPCHSA-N 345.273 5.615 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(OC(C)(C)C)cc1 618805623 OTVAYBAMZSYQQD-BTYIYWSLSA-N 334.463 5.074 30 20 EKED CC[C@H](NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 740000830 REEQZXYYYCFYIL-FQEVSTJZSA-N 332.472 5.528 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)s1 762439676 VPEKARVLPJEBOP-DJWKRKHSSA-N 341.741 5.188 30 20 EKED C#CC[C@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccccc1 774266877 RZEHIYNMBHJGDN-SJCJKPOMSA-N 334.246 5.114 30 20 EKED Cc1c(CNCc2cc(C#N)ccc2F)sc2c(Cl)cccc12 815127574 WUSAJRRHZCDQIS-UHFFFAOYSA-N 344.842 5.164 30 20 EKED Cc1cc(N[C@H](C)CC(C)(C)C#N)ccc1NC(=O)OC(C)(C)C 895471725 YCYSSNQOGBKFAF-CQSZACIVSA-N 331.460 5.082 30 20 EKED Cc1ccc(-c2nnc([C@H](C)SCC3CCC(C#N)CC3)o2)cc1 902565918 MXQBFIFDFNYIQP-FHERZECASA-N 341.480 5.169 30 20 EKED Cc1cccc(Nc2cccc(NC(=O)C3(C#N)CC4(CC4)C3)c2C)c1 925135126 VZMFMVTUWDVMHS-UHFFFAOYSA-N 345.446 5.070 30 20 EKED Cc1ccc(NN=Cc2csc3ccc(C(=O)O)cc23)c(Cl)c1 1776060623 FHXVXDMHMPSGBS-UHFFFAOYSA-N 344.823 5.007 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)(F)F 90665613 SSXJENLEVHMIDD-YOEHRIQHSA-N 348.368 5.281 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 159727951 RWFUQLWCRJZFFM-SFHVURJKSA-N 335.451 5.151 30 20 EKED CCOc1ccc(-c2nc(CSCCCC(C)(C)C#N)co2)cc1 162544401 AMAZYCPQEYGWQD-UHFFFAOYSA-N 344.480 5.303 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccnc2)cc1 181851043 VXKYZGPYZRSBED-IAGOWNOFSA-N 327.431 5.032 30 20 EKED Cc1cc(Cl)c(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1Cl 182178414 MWQGMICOXMGRJJ-UHFFFAOYSA-N 345.229 5.109 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340438979 BEMQFORMJPDVHQ-UXHICEINSA-N 328.406 5.441 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F 410375825 RJKTZTKIGWUFCZ-UHFFFAOYSA-N 337.316 5.215 30 20 EKED Cc1cscc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 439365545 OXUSHBMRVZSKHI-UHFFFAOYSA-N 349.415 5.365 30 20 EKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458801127 MQPBXROWWLYROB-YSIASYRMSA-N 341.499 5.032 30 20 EKED C[C@H](CCCC(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 480163088 VZMYPXDKAIVBNG-SKDRFNHKSA-N 331.275 5.140 30 20 EKED CC(C)(C#N)CCCSCCOc1ccccc1C(F)(F)F 480384072 CLRHVAKGJPNAMY-UHFFFAOYSA-N 331.403 5.147 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(C(=O)C2CCC2)cc1 486205563 SKDQLBWOBPAUIO-UHFFFAOYSA-N 332.447 5.083 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1csc2ccccc12 493971238 KVCKTAQHKLENPA-UHFFFAOYSA-N 349.459 5.215 30 20 EKED N#CCCCOc1cccc(NC2c3ccccc3-c3ccccc32)c1 498755554 ODTXMIJERLPNCN-UHFFFAOYSA-N 340.426 5.551 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(F)c1 500735964 AXDFACWIMAOTRR-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCC[C@@H](NCc1ccc(CC)nc1)c1ccc(C(F)(F)F)cc1 512050002 BEXGTCSWSYDKLY-LJQANCHMSA-N 348.412 5.460 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@@H](C)c2cc(C)ccc2C)c1 523423403 YGSJEFYJSXEVLD-KRWDZBQOSA-N 338.451 5.093 30 20 EKED C=CCC[C@@H](NCc1csc(C2CCCC2)n1)c1ccccc1 538258508 ZFVOYAYKLRTMMQ-LJQANCHMSA-N 326.509 5.598 30 20 EKED CC(C)(C#N)c1ccccc1CNC(C)(C)c1ccc(Cl)cc1 556517096 BDTSCNTUIDZJED-UHFFFAOYSA-N 326.871 5.166 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)cc1 595411454 QEYRKKCMCNICTN-LIRRHRJNSA-N 328.843 5.043 30 20 EKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1(C)C 609376746 IWFQWNPEXYYPOO-HDMKZQKVSA-N 342.508 5.115 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)N[C@@H](C)c1cccc(C#N)c1 610829678 DRIHHCVOHCGXNX-KBPBESRZSA-N 328.843 5.022 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCCC2)cc1)c1nccc2ccccc12 685797243 PZKGOBLJAHDBOA-NRFANRHFSA-N 340.426 5.382 30 20 EKED C=CCOc1ccc(CN[C@H](CC)c2ccccc2OC)cc1Cl 727466025 QPLOSZYECZNCOA-GOSISDBHSA-N 345.870 5.154 30 20 EKED O=C1/C(=C/c2coc(-c3ccccc3)n2)[C@H]2CCCc3cccc1c32 763290644 RROBSYBSGFBJDD-MIQLPHMESA-N 327.383 5.041 30 20 EKED CC1(C)CC[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 768869312 USTUJVLLONQQPR-UXHICEINSA-N 347.462 5.042 30 20 EKED C=CCC[C@@H](NC1CC(C(F)F)C1)c1ccc(C(F)(F)F)cc1 769534313 ZCHOBGZNOLMTDL-PESDSKBTSA-N 333.344 5.346 30 20 EKED O=C(/C=C\c1ccc(OC(F)F)c(Cl)c1)c1cccc(F)c1F 776267895 IOIDDLJSSWURPJ-XQRVVYSFSA-N 344.691 5.116 30 20 EKED CC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCCC1 781452863 YHIZSUHDQXNHBU-GFCCVEGCSA-N 332.856 5.096 30 20 EKED COc1cccc2cc(C(=O)/C=C/c3ncc(C(C)(C)C)s3)oc12 790603452 KYSTVSZGXYXOCT-CMDGGOBGSA-N 341.432 5.092 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 795205940 SCVGMIHLXXZWHU-HXUWFJFHSA-N 343.430 5.046 30 20 EKED Cc1ccccc1-c1nnc(SCCCCC2(C#N)CCC2)o1 901366470 SPMVKRLSBPQXTA-UHFFFAOYSA-N 327.453 5.001 30 20 EKED CCCCc1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916846269 OHGSZMQEVSVHIS-KRWDZBQOSA-N 348.471 5.058 30 20 EKED Oc1ccc2ccccc2c1C=Nc1cccc(COCC2CC2)c1 920833260 KPGVUCNYLXPNAK-UHFFFAOYSA-N 331.415 5.223 30 20 EKED Cc1c(NN=Cc2ccc(C3CCCCC3)cc2)cccc1C(=O)O 1776089650 BJLVWIDKJPQNEM-UHFFFAOYSA-N 336.435 5.187 30 20 EKED Cc1cc(Cl)ccc1NN=Cc1csc2ccc(C(=O)O)cc12 1776104686 UVYCPVMCCIATDE-UHFFFAOYSA-N 344.823 5.007 30 20 EKED C[C@H]1C/C(=C\c2csc3ccc(C(=O)O)cc23)C(=O)c2ccccc21 1776589529 JBACELPZQSPKRK-IGVUGNCQSA-N 348.423 5.373 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2ccc3oc(CC(C)(C)C)nc3c2)CCC1=O 328960637 PNYABZBSRJMQOB-QWHCGFSZSA-N 342.439 5.010 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 466873058 NIJZVJFGQHKSSZ-LBPRGKRZSA-N 329.362 5.033 30 20 EKED CC[C@H](CC#N)NC(=O)Nc1ccc(SC2CCCCC2)cc1C 475013935 NPRIIILCZLQPFX-OAHLLOKOSA-N 345.512 5.234 30 20 EKED C[C@H](NCc1ccc(Cl)cc1C#N)c1ccccc1C(F)(F)F 480886786 SJBFQIGYGWUMHG-NSHDSACASA-N 338.760 5.081 30 20 EKED C=C(C)COc1cc(CN[C@@H](CCC)c2ccccc2)ccc1OC 518768971 XYNPORPHHDPQMY-FQEVSTJZSA-N 339.479 5.281 30 20 EKED C[C@@H](SCc1csc(-c2ccco2)n1)c1ccc(C#N)cc1 522839960 UCBRNBGNWPASRD-GFCCVEGCSA-N 326.446 5.269 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(Oc2ccccn2)cc1 524832556 ZAWZGQXYCVYXRD-UHFFFAOYSA-N 339.439 5.084 30 20 EKED N#Cc1ccc(SCc2c(Cl)ccc3cccnc23)c(F)c1 525503744 WOFQASHCBDLCQQ-UHFFFAOYSA-N 328.799 5.191 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1F 540317824 HILVTOXEWYKEJM-INIZCTEOSA-N 330.406 5.215 30 20 EKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)s1 541626922 JYUCJZLYECXXPX-HNNXBMFYSA-N 332.900 5.444 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2cscc2C#N)cc1)c1ccccc1 572382940 LSRFYAHMBMZBJC-AWEZNQCLSA-N 347.443 5.045 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc2ccccc2s1 584322615 YXCHEWHHSOWMGB-KRWDZBQOSA-N 344.439 5.354 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cccnc2C)CC3)cc1 728787863 UXKNZXNKLJUPPJ-SFQUDFHCSA-N 346.455 5.034 30 20 EKED Cc1ccc(CN(Cc2cc(Cl)ccc2OCC#N)C(C)C)s1 735309670 JLCVNLKKMZTREH-UHFFFAOYSA-N 348.899 5.023 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccc(C)cc1 747197637 KZFUOFVPFAPDJP-RDJZCZTQSA-N 340.492 5.335 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3cnc(-c4ccccc4)nc3)oc2c1 754831156 XELQYVVOZIVGTD-CSKARUKUSA-N 340.382 5.094 30 20 EKED N#Cc1sc(Oc2ccc3c(c2)[nH]c2ccccc23)nc1Cl 804325935 AMEKUFSHTIVGNS-UHFFFAOYSA-N 325.780 5.095 30 20 EKED CCC(CC)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccs1 236682247 DPELSCDOUJZQRR-MGPUTAFESA-N 342.508 5.306 30 20 EKED Cc1ncc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 367803892 SXIRPRLWEXCKGM-LSDHHAIUSA-N 347.487 5.402 30 20 EKED N#CCCCOc1cccc(NCc2csc(Cl)c2Cl)c1 432236616 VTUHYOTVRQTEBK-UHFFFAOYSA-N 341.263 5.350 30 20 EKED CCn1c(SCCCCC(C)(C)C#N)nnc1-c1ccc(C)cc1 436211278 QUOXZLLODTWYEA-UHFFFAOYSA-N 342.512 5.086 30 20 EKED N#CC1CCC(CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 442860434 WQHNKTGYPMSNPT-AFMYVXGZSA-N 338.495 5.133 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2c(C)cccc2SC)CCCC1(C)C 445167923 VWUZPPRDSAQEBT-INIZCTEOSA-N 332.513 5.316 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccoc3)n2)c(Cl)c1 465388372 MWYZWZSZLYAMMA-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C=CCCN(C)[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 467289993 FPZHFFRSNNUGSD-LLVKDONJSA-N 325.239 5.217 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H]1CC=CCC1 475553937 GXEXCJJZWBRKLU-QGZVFWFLSA-N 326.484 5.359 30 20 EKED CC(C)(C)c1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)s1 477199624 ALPJGDJTUDSRSQ-UHFFFAOYSA-N 326.465 5.099 30 20 EKED COc1ccc(CSCCCC(C)(C)C#N)cc1Br 480389667 SRBGZDZMUYXPFS-UHFFFAOYSA-N 342.302 5.021 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Oc2cccnc2)cc1 487994643 QBYXEEMWPFYNIY-IAGOWNOFSA-N 343.430 5.157 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccco1 505059921 CEVORRKEJNABGC-OAQYLSRUSA-N 346.430 5.309 30 20 EKED CCN(Cc1cnc(C2CCCC2)s1)[C@@H](C)c1ccc(C#N)cc1 508604393 MHZQMZMQBDKJEL-HNNXBMFYSA-N 339.508 5.255 30 20 EKED C=CCOc1ccccc1CN[C@H](c1ccc(Cl)cc1)C1CC1 517540092 XBPOIFQMVWXXHQ-FQEVSTJZSA-N 327.855 5.146 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccccc1-c1nc2ccccc2s1 523992491 BRHJIVYEFVLLTR-ZDUSSCGKSA-N 337.448 5.049 30 20 EKED C=C[C@H](CC(=O)N(Cc1ccc(C)s1)C(C)C)c1ccccc1 535363557 BFCUMHCBBQOJRA-QGZVFWFLSA-N 327.493 5.153 30 20 EKED C[C@H](NC(=O)Nc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 541091814 BKSGOYXFXBCIMB-AWEZNQCLSA-N 347.443 5.169 30 20 EKED C=C[C@@H](CC(=O)Nc1ccc(OC)cc1C(F)(F)F)c1ccccc1 550532864 BUSZWIPNYZPXBP-ZDUSSCGKSA-N 349.352 5.012 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 559863922 WDIGLDQRURCISR-JPYJTQIMSA-N 332.491 5.651 30 20 EKED CC[C@@H](N[C@@H](C)c1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1 564039500 IAFDPVLOAYBHEA-XJKSGUPXSA-N 327.497 5.114 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@H](C#N)Cc3ccccc3)o2)cc1 608930215 QNHDQMHOBIFUIK-SFHVURJKSA-N 349.459 5.087 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCSc2ccc(Cl)cc21 618803810 IWTPRLLABKMDCD-ROUUACIJSA-N 340.879 5.026 30 20 EKED C=CCN(C(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C)C(C)C 732705097 PYAIDNPZPGFNNC-GOSISDBHSA-N 328.456 5.044 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3cnc(-c4ccncc4)s3)oc2c1 754823638 DMKAHZUIDDERPK-SNAWJCMRSA-N 346.411 5.156 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H]1CC=C(c2ccc(F)cc2)CC1 780746285 YNHNYBAJKDSCLT-BEFAXECRSA-N 336.410 5.165 30 20 EKED Cc1cc(CCCC(=O)[C@H](C#N)c2nccc3ccccc23)c(C)s1 792093470 JFHKZNZWNBTMRQ-IBGZPJMESA-N 348.471 5.112 30 20 EKED CCCCCCC(CCCCCC)=NNc1ccc(CC(=O)O)cc1 1776083825 BAKPUWLNBGVWOT-UHFFFAOYSA-N 346.515 6.022 30 20 EKED Cc1cc(C)c(C(=O)O)cc1/C=C\C(=O)c1cccc2ccccc12 1776114273 KOQUXBDVRMAYAG-KHPPLWFESA-N 330.383 5.051 30 20 EKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)C(C)(C)CC)c1 1776789189 UGUMIBRXRIBGQL-LJQANCHMSA-N 349.515 5.015 30 20 EKED N#Cc1cccc(NC(=O)c2ccc(CSc3ccccc3)cc2)c1 23681115 YAYBTZHPIMUDQX-UHFFFAOYSA-N 344.439 5.103 30 20 EKED Cc1ccc(C(=O)/C=C/C2=Cc3cc(Cl)cc(Cl)c3OC2)o1 60330737 JSDCVJYTUWXXPJ-ONEGZZNKSA-N 335.186 5.110 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 63962540 LIBYJGYWHLBPBH-CYBMUJFWSA-N 346.352 5.018 30 20 EKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1Cl 191376816 GUZXUGXIDZMTGM-CQSZACIVSA-N 338.794 5.095 30 20 EKED CC(C)(C)Cc1csc(N=C(O)[C@H]2CCC(=O)c3ccccc32)n1 328809559 MCYBBMFRGOIJOI-HNNXBMFYSA-N 342.464 5.080 30 20 EKED Cc1nnc(-c2cccc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)c2)o1 329168466 JCBMPDLEEMCBRZ-BMGDILEWSA-N 339.439 5.240 30 20 EKED Cc1[nH]c2ccc(C/N=C(/O)[C@@H]3CCCc4c(O)cccc43)cc2c1C 330013112 LQQBTPZOVNDKBK-GOSISDBHSA-N 348.446 5.067 30 20 EKED Cc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 431704184 VFNDOLQQHHREJT-SFHVURJKSA-N 341.842 5.205 30 20 EKED C[C@H]1CCC[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 443608790 XOLQXDYOFSWAQS-XHSDSOJGSA-N 345.512 5.029 30 20 EKED C=CCC[C@@H](C(=O)N(CC=C)Cc1cccs1)c1ccccc1 448137245 CXRPRXKBORQAJU-LJQANCHMSA-N 325.477 5.013 30 20 EKED Cc1oc2ccc(NC(=O)C[C@@H](CC#N)c3ccccc3)cc2c1C 476775391 HAQKMHLHCWMKJN-QGZVFWFLSA-N 332.403 5.076 30 20 EKED Cc1ccc([C@@H](NCc2ccc(C#N)cc2C(F)(F)F)C2CC2)cc1 517266936 AMBUHZVVPWOZCP-LJQANCHMSA-N 344.380 5.126 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 519079103 OXVPJJHXFMJBHS-CQSZACIVSA-N 345.826 5.052 30 20 EKED N#Cc1ccc(NCc2ccc(Oc3ccccc3)nc2)cc1Cl 521058116 QWAMADPFDXEBRD-UHFFFAOYSA-N 335.794 5.011 30 20 EKED Cc1ccc2cc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)oc2c1 551214052 ALLUYBQHCZWQPZ-XLIONFOSSA-N 332.447 5.827 30 20 EKED C[C@H](NC1(c2ccc(Cl)cc2)CCC1)c1ccc(C#N)cc1F 579986584 AZWDQVVYOBRSDG-ZDUSSCGKSA-N 328.818 5.081 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC2(CCCC2)CC1 583290096 IMEGTRMODANGCS-UHFFFAOYSA-N 344.458 5.022 30 20 EKED Cc1ccccc1CNc1ccccc1NC(=O)CCCCCC#N 589845403 SONGYLWMFLAIJK-UHFFFAOYSA-N 335.451 5.020 30 20 EKED COc1cc(CS[C@H](C)c2ccc(C#N)cc2)ccc1OC(F)F 609824973 FDQRXNFKVQYNSO-GFCCVEGCSA-N 349.402 5.163 30 20 EKED CSc1c(F)cc(NCc2ccc(C(C)(C)C#N)cc2)cc1F 614057749 AKQIVPBVVBUIJV-UHFFFAOYSA-N 332.419 5.100 30 20 EKED Cc1ccc(N(CCC#N)C(=O)C[C@H](c2ccccc2)C(C)C)cc1 728518876 UXIVMZSTLPAGIO-NRFANRHFSA-N 334.463 5.072 30 20 EKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cccnc1Cl 728699409 UIGWYPXYGFRMED-MDZDMXLPSA-N 340.835 5.063 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)C 729887854 DIRZSCGAKYLVOL-DOTOQJQBSA-N 340.492 5.367 30 20 EKED COc1ccccc1-c1ccc(C(C)=NNc2cccc(C#N)c2)cc1 741456561 CEFULTWBFPNWLQ-UHFFFAOYSA-N 341.414 5.070 30 20 EKED COc1cccc(NN=C(C)c2ccc(-c3ccccc3OC)cc2)c1 741462466 PWGAWNRMJYMJFA-UHFFFAOYSA-N 346.430 5.207 30 20 EKED C#Cc1cccc(N(C(=O)c2cc3cc(C)c(C)cc3o2)C(C)C)c1 742673567 YDJIIZJMIHSFFB-UHFFFAOYSA-N 331.415 5.086 30 20 EKED C=C(C)CCOC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 744300253 UOPFCGVSNBNHLL-UHFFFAOYSA-N 342.247 5.240 30 20 EKED Cc1c(C(=O)/C=C/c2cnc(-c3ccncc3)s2)oc2ccccc12 753142039 NDUGPFAUNZLVFO-VOTSOKGWSA-N 346.411 5.156 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1cccc(SC(F)F)c1 777672669 BNRSVRVZOBFDHX-KRWDZBQOSA-N 330.403 5.362 30 20 EKED CCCCCC[C@](C)(CC)C(=O)Nc1ccccc1O[C@H](C)C#N 780148940 NBVYLMFZOAUWSH-UZLBHIALSA-N 330.472 5.303 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1csc2ccccc12 784345794 CRYPQTUJOVCFLR-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)Cc1cccc(C(F)(F)F)c1 798931577 GFEIIASMUMLSAL-KGLIPLIRSA-N 348.368 5.039 30 20 EKED COc1cc(C)c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1C 815635643 GXQROCLMYCBYHN-WIYYLYMNSA-N 336.479 5.398 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)c1cccnc1 873831354 AASDCIICNAJMJX-CLFYSBASSA-N 325.820 5.360 30 20 EKED CC(=Nn1c2ccccc2c2ccccc21)c1ccc(C(=O)O)cc1C 1776112591 BKBUYZYGYKWIJP-UHFFFAOYSA-N 342.398 5.073 30 20 EKED Cc1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776127634 YVRCEZIHHOGYBX-NTMALXAHSA-N 348.423 5.318 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)c1 1776341450 NWCSNMWAZIFQRZ-VOTSOKGWSA-N 348.851 5.194 30 20 EKED CCCCCCCC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 116028930 JKSJQRLJNGVUHH-HSZRJFAPSA-N 337.529 5.033 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 117456762 ZVSVJTGNHJPHTI-HZPDHXFCSA-N 345.512 5.125 30 20 EKED CC(C)(C#N)CCC[S@@](=O)Cc1ccccc1Oc1ccccc1 177966005 OWFSLRZODKHWDV-XMMPIXPASA-N 341.476 5.058 30 20 EKED CCC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340444715 IPEZLPXSGSIXNJ-VXKWHMMOSA-N 336.479 5.561 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(CN(CC)C2CC2)cc1 410350022 AAIKFBXFNSIPQE-UHFFFAOYSA-N 348.490 5.042 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(C)c1Br 410368739 XJXLORHBBSFDGI-UHFFFAOYSA-N 344.252 5.128 30 20 EKED CCCN(C(=O)Nc1cccc(CC#N)c1)[C@H](CC)c1ccccc1 455917530 JVGUFROFVFGGBW-HXUWFJFHSA-N 335.451 5.148 30 20 EKED Cc1sc(NC(=O)c2cscc2-c2ccccc2)c(C#N)c1C 463069317 KNFYFPQGJUKRNG-UHFFFAOYSA-N 338.457 5.217 30 20 EKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2s1 475753177 GQYYKDFQDLJJGP-CQSZACIVSA-N 348.471 5.193 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1cccc(COC(C)(C)CC)c1C 488907423 FLHHAPZOVQZJKM-GOSISDBHSA-N 344.499 5.273 30 20 EKED C=CCC[C@H](N[C@@H](C)[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 507511411 OCYJIGNHJLWSRY-LESCRADOSA-N 341.417 5.117 30 20 EKED N#Cc1cc(NCc2cnc(-c3ccsc3)s2)ccc1Cl 508633262 WRDAABAGEAGZKR-UHFFFAOYSA-N 331.853 5.009 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1OC(F)F 512648048 LBDGHTYOUNKBPV-SJKOYZFVSA-N 348.368 5.101 30 20 EKED C=C(C)[C@H](CC(=O)Nc1ccccc1SC1CCCC1)OCC 533692004 MTQJRXMDMXMPKF-KRWDZBQOSA-N 333.497 5.031 30 20 EKED COCc1cccc(CNc2cccc(Oc3ccc(C#N)cc3)c2)c1 562581028 FNSCKEWNHBSLRK-UHFFFAOYSA-N 344.414 5.109 30 20 EKED C=CCN(C(=O)c1oc2ccccc2c1CSC)c1ccccc1 603458904 LBAFEUTVQACXOC-UHFFFAOYSA-N 337.444 5.129 30 20 EKED CC(C)(C)c1ccc(Cl)cc1NC(=O)NCC1CCC(C#N)CC1 619804049 WPWZTQQKVAMQJA-UHFFFAOYSA-N 347.890 5.089 30 20 EKED O=C1/C(=C/c2ccc3ncccc3c2)CSc2c(Cl)cccc21 731939760 UNBCEQVHULBKBA-GXDHUFHOSA-N 337.831 5.260 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1CCCCCCC1 741560424 AKUXSEFPHLLPBI-HNNXBMFYSA-N 330.497 5.237 30 20 EKED C=CC[C@H](NCc1ccc(-c2cc(C)cc(C)c2)cc1)c1ccncc1 742370928 BAVKGCDQGJAEBF-DEOSSOPVSA-N 342.486 5.772 30 20 EKED Cc1ncsc1C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl 753712847 VBVWKXBLKQEIDU-GORDUTHDSA-N 331.746 5.020 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cccc(-c2ccccn2)c1 754708699 CBOYGRTXUVNCQL-UHFFFAOYSA-N 342.320 5.180 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)s1 797568833 WSSNUKWSEKCCJH-QKPAOTATSA-N 344.524 5.223 30 20 EKED Cc1c(NC(=O)OC(C)(C)C)cccc1N[C@H](C)CC(C)(C)C#N 895574820 MAUMTUMPFUWKSP-CYBMUJFWSA-N 331.460 5.082 30 20 EKED CC(CCCCCCC(=O)O)=NN[C@@H](C)c1ccc(C(C)C)cc1 1776106003 MZCSUUFJLILARB-KRWDZBQOSA-N 332.488 5.262 30 20 EKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 46441622 JRGPYPXZCIAWLC-LBPRGKRZSA-N 347.226 5.093 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66907372 ILMNRZUJWWPAMA-AWEZNQCLSA-N 325.437 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(Cl)cc1 189886046 VLXNAOOBVVJHGF-UHFFFAOYSA-N 343.854 5.209 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(F)cc1F 189890477 RGUZVBKXIXNMRG-UHFFFAOYSA-N 333.353 5.208 30 20 EKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1ccc(-c2cccnc2)cc1 301451301 ABBMMQVJBYEDLR-ZDUSSCGKSA-N 335.357 5.072 30 20 EKED C=C(C)[C@H](NCc1nc2ccc(F)cc2s1)c1ccc(F)c(F)c1 428879512 HCJNOVMCAZUGPL-SFHVURJKSA-N 348.393 5.121 30 20 EKED CC#CCCCC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 464572167 UTQWOGUYPMFMER-KRWDZBQOSA-N 325.477 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC1CC1)CC1CC1 475544852 IGCRCVDGEVLNDP-UHFFFAOYSA-N 326.484 5.192 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 477508396 HORFPLHFKZQRPH-UHFFFAOYSA-N 332.513 5.460 30 20 EKED CCN(C(=O)C[C@H](c1ccccc1)C(C)C)[C@@H](C)c1ccc(C#N)cc1 482411348 XCLQLLLRTDNMRN-AVRDEDQJSA-N 348.490 5.298 30 20 EKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@@H](CCC#N)c1ccccc1 489003809 ACJBVQYYIHYGIW-LMNJBCLMSA-N 346.474 5.137 30 20 EKED N#CCCSc1ccccc1NC(=O)c1ccc2ccccc2c1 518121210 XHBQWKFAJSVVCN-UHFFFAOYSA-N 332.428 5.098 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)cc1F 518739234 ULDAEEDSILCWSH-LLVKDONJSA-N 348.830 5.126 30 20 EKED CCC[C@H](C)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944686 TYRLJGPIWSWSEU-DLBZAZTESA-N 349.478 5.116 30 20 EKED C=C(C)C[C@H](C)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 577560618 DIZOLPDOCDZXAM-GXFFZTMASA-N 328.309 5.217 30 20 EKED C[C@@H](NC(=O)CCCCCC#N)c1ccccc1Oc1ccccc1 588155576 MYWRMNAOOLWTIF-QGZVFWFLSA-N 336.435 5.130 30 20 EKED CC[C@@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccccc1 609237155 AUASIUQLYFIWQU-QGZVFWFLSA-N 344.867 5.035 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2ccc(F)cc2)s1 618743052 VGTOLIULBINVIP-FQEVSTJZSA-N 348.446 5.203 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618805849 PIHWMCKBOLNPMM-BTYIYWSLSA-N 336.504 5.397 30 20 EKED C=CCC[C@H](NCc1conc1CC)c1ccc(C(F)(F)F)cc1 660204474 MDIUVAHIFBICFR-KRWDZBQOSA-N 338.373 5.053 30 20 EKED C=C[C@H](CC(=O)N(C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 677504624 SGTGFYMUSNVJGZ-MRXNPFEDSA-N 347.380 5.024 30 20 EKED Cc1cccc(C)c1NC(=S)Nc1ccccc1SCCC#N 730953163 QXFOPRFELNKWMF-UHFFFAOYSA-N 341.505 5.118 30 20 EKED CC(C)C[C@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 741110600 JHFOXZZHWFQJTI-PMACEKPBSA-N 342.442 5.241 30 20 EKED N#CCCC[C@H](NC(=S)Nc1ccccc1Cl)c1ccccc1 814211090 ZTYPEXRUDDLSLA-INIZCTEOSA-N 343.883 5.062 30 20 EKED C#CC[C@@H]1CCCN(C(=O)Nc2c(CCC)cccc2C(C)C)C1 831715851 ADOKCNNRDSTDLU-QGZVFWFLSA-N 326.484 5.030 30 20 EKED CC(C)=CCC[C@H](C)CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 842803015 LOAXFLGYXRLFQT-DZGCQCFKSA-N 338.373 5.049 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1ccc(Cl)s1 916135765 PXKXQXCPSOBPIV-SREVYHEPSA-N 331.849 5.421 30 20 EKED COc1ccc(C(=O)/C=C\c2cccc(OC3CCCC3)c2)c(F)c1 917516358 ULAJLFZBYLPIDA-XFXZXTDPSA-N 340.394 5.052 30 20 EKED Cc1c(NN=C2CCCC[C@@H](c3ccccc3)C2)cccc1C(=O)O 1776087618 MJNDRCCAAAHPGO-QGZVFWFLSA-N 336.435 5.209 30 20 EKED N#CCC[C@@H](Nc1nc(-c2ccc(F)cc2)cs1)c1ccccc1 301790098 NJMIUVMGNWPHLH-QGZVFWFLSA-N 337.423 5.406 30 20 EKED C=CCOc1cccc(NC(=O)N(Cc2ccccc2)[C@H](C)CC)c1 303640755 BDCJOABHCYTWTG-QGZVFWFLSA-N 338.451 5.084 30 20 EKED C[C@H](CC#N)NC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 433819355 PMECGGZCUUDHQA-LLVKDONJSA-N 348.233 5.084 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(C(C)(F)F)c1 444935811 HBPWIVSBGIBTRH-UHFFFAOYSA-N 348.368 5.158 30 20 EKED Cc1cc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCC3)cc1C 510320549 FMORUTAYWXKWKW-UHFFFAOYSA-N 344.867 5.021 30 20 EKED Cc1cccc([C@H](NCC2CCC(C#N)CC2)c2cccc(F)c2)c1 510944079 LYTXOLSOZCOQSZ-IRZJEQJZSA-N 336.454 5.143 30 20 EKED C=CCC[C@@H](NCc1cccc(NC(=O)[C@H](C)CC)c1)c1ccco1 513678535 OQMZHHJBEZYANH-VQIMIIECSA-N 340.467 5.061 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc2ccccc2c1OC(F)F 514684018 HGIYOGBCVPFYKF-AWEZNQCLSA-N 346.421 5.422 30 20 EKED CCCCN(C(=O)NCC(C)(C)CCC#N)[C@H](CC)c1ccccc1 558083643 PFBDWHDIKKHWBE-LJQANCHMSA-N 343.515 5.279 30 20 EKED Cc1sc(NC(=O)C(C)(C)c2ccc3ccccc3c2)c(C#N)c1C 610220524 HJMXFWYFTNZLED-UHFFFAOYSA-N 348.471 5.306 30 20 EKED C#Cc1cccc(N(C(=O)c2cc(SC)ccc2Cl)C(C)C)c1 728247755 PMEGJMWQSLOHTI-UHFFFAOYSA-N 343.879 5.098 30 20 EKED C[C@H](SCc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C#N)cc1 735675308 DOWHZCSIJFVQMB-NSHDSACASA-N 332.812 5.114 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(C)cc1 739142848 LGMPBVSFBSQZHD-YLJYHZDGSA-N 342.442 5.303 30 20 EKED Fc1ccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)o2)cc1 754712377 NQUAWVIZEKJOIU-UHFFFAOYSA-N 349.283 5.517 30 20 EKED CCC(CC)[C@H](C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 762042706 WQJOEUVUPSEROD-GWCFXTLKSA-N 334.872 5.198 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2ccc(C#N)o2)cc1 794375302 QXJLTTKZSUBDTG-AWEZNQCLSA-N 348.427 5.257 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)nc2ccccc12)c1ccccc1 814658284 AMSGCNFBWQRMAR-IBGZPJMESA-N 349.865 5.413 30 20 EKED CC(C)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776372482 WFTKLATXPUBUEX-LDADJPATSA-N 334.415 5.111 30 20 EKED Cc1ccc(F)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 66037471 PCOXVSUMAWXOMA-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1C#N 184448018 KJRDKARFVJCYME-ZDUSSCGKSA-N 341.867 5.218 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 191239883 PCYMPBABIYRKFB-ZDUSSCGKSA-N 344.867 5.153 30 20 EKED Cc1ccc(-c2nc(CSCCCCC(C)(C)C#N)co2)cc1 435879208 BJYQDHHROXNPES-UHFFFAOYSA-N 328.481 5.603 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1ccc(Cl)cc1)c1cccc(C#N)c1 443146439 OWKMPHZKKCCODI-QWHCGFSZSA-N 344.867 5.033 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 474521935 PYRNRGOTXSCKQE-UHFFFAOYSA-N 332.856 5.170 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCC[C@@H]1C 475552542 WILLPOSRFONLCH-LPHOPBHVSA-N 328.500 5.581 30 20 EKED C[C@@H](Nc1cccc(Cl)c1OCC(F)F)c1ccc(C#N)cc1 487499356 HKYYXEVVTOGLKD-LLVKDONJSA-N 336.769 5.029 30 20 EKED C=C(C)CN(CC)C(=O)C(CC)(CC)Cc1nc2ccccc2s1 509698157 FZBFFRBBFXAFIO-UHFFFAOYSA-N 344.524 5.070 30 20 EKED C[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 509704573 PUCHZLOHXHWSBJ-CVEARBPZSA-N 349.434 5.003 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1F 512632017 VWLZQMFIMJHDLT-XCLFUZPHSA-N 326.390 5.028 30 20 EKED Cc1cc(C)c(C#N)c(S[C@H](C)c2ccc(OC(F)F)cc2)n1 513270984 HVEXUNDKXDSSFU-GFCCVEGCSA-N 334.391 5.025 30 20 EKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 559865537 RNGRZZZGKWSXCU-XLIONFOSSA-N 332.447 5.827 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Oc1ccccc1Cl 588832681 VQXSVFWPHJEIIB-UHFFFAOYSA-N 342.826 5.545 30 20 EKED Cc1csc(NC(=O)c2sc3cccc(C)c3c2Cl)c1C#N 589034454 HNXPTVKIALOXPR-UHFFFAOYSA-N 346.864 5.357 30 20 EKED C=CCCCCS[C@H](C)C(=O)Nc1ccccc1C(F)(F)F 591400990 IKEGUEFSVJDMQQ-GFCCVEGCSA-N 331.403 5.122 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 605912744 BXRGPJLZTYOMOB-UHFFFAOYSA-N 340.492 5.576 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1F)c1cc2c(ccc3ccccc32)o1 611438482 VNONYAMDRDPLQM-CQSZACIVSA-N 344.389 5.448 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cccc(Cl)c2C)c1 727285478 WIXAPZLFIOTYHK-UHFFFAOYSA-N 346.883 5.412 30 20 EKED COc1cc(/C=C2/C(=O)c3ccsc3S[C@H]2C)ccc1SC 742436232 HNZSPFDLYOSZBW-XNFYSYIQSA-N 348.514 5.239 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1c[nH]c2cc(Cl)ccc12 920068347 MRRTUGWVVFODAQ-YWEYNIOJSA-N 332.790 5.266 30 20 EKED O=C(O)c1cc(NN=C2CC(c3ccc(Cl)cc3)C2)ccc1Cl 1776033624 KBDLWWGUHUYQAR-UHFFFAOYSA-N 349.217 5.037 30 20 EKED COc1ccc2cc(C(=O)/C=C/c3ccc(O)c(Cl)c3)ccc2c1 60132448 RCSXBWOQSJQMFE-KRXBUXKQSA-N 338.790 5.104 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 90001039 CPOIXHAOCMLSAQ-NRFANRHFSA-N 347.462 5.245 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(OCC)cc1)c1ccccc1 125778214 HKYWUSYMQDSSSI-AVRDEDQJSA-N 349.474 5.109 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)c1nccs1 191491278 PAVICWIJWYNSRY-MRXNPFEDSA-N 343.496 5.268 30 20 EKED CC1(Cc2noc(C3CCC(/N=C(/O)C(C)(C)C)CC3)n2)CCCC1 329635670 XYHKVQDVDSBHHD-UHFFFAOYSA-N 347.503 5.221 30 20 EKED N#CCC[C@H](N[C@H]1CCCc2c1[nH]c1ccccc21)c1ccccc1 343732106 WEIZWGCACKMRPN-FPOVZHCZSA-N 329.447 5.180 30 20 EKED CCSCc1ccccc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 434558540 KVFIYRRVTSQQSZ-HNNXBMFYSA-N 344.505 5.010 30 20 EKED C=C(C)[C@H]1OCC[C@@H]1CNC(=O)Nc1ccc(C(C)C)cc1C(C)C 436314869 YZSDSAZIWNVDGU-YLJYHZDGSA-N 344.499 5.036 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 437657770 MOCJPBSVFRYHLB-NHCUHLMSSA-N 347.462 5.114 30 20 EKED CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 438049979 LPWMQLNZQMURMA-ZNMIVQPWSA-N 333.501 5.027 30 20 EKED CC[C@H](c1ccccc1)c1nnc(SCc2ccc(C#N)c(C)c2)o1 447286998 LUIJCHDEPXWNIU-GOSISDBHSA-N 349.459 5.084 30 20 EKED CCN(c1ccccc1)c1ccc(CNCc2cccc(C#N)c2)cc1 462676296 CHGMWSZFRLLLCD-UHFFFAOYSA-N 341.458 5.006 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCCC[C@@H]1C 476087665 BRSBNYYOYULHRS-QFBILLFUSA-N 329.484 5.072 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)cc1OCCC 510096236 ZBHLJZCASDQPDH-UHFFFAOYSA-N 344.480 5.065 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 536836618 BUYJIEZFOFYKJM-CXAGYDPISA-N 333.262 5.689 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccccc1 537950399 VTNYFKIAYANONB-CVDCTZTESA-N 345.490 5.290 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(Cl)c1Cl 538210361 GSTQLOHFNLNBBF-ZDUSSCGKSA-N 347.289 5.645 30 20 EKED N#C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(Cl)cc1 585718054 XHWGPSBEMWCIIT-OALUTQOASA-N 328.818 5.175 30 20 EKED Cc1ccccc1NC(=S)N(Cc1ccccc1C#N)C1CCCC1 747705821 KBGPNYDIQOXMJH-UHFFFAOYSA-N 349.503 5.008 30 20 EKED Cc1c(C(=O)/C=C/c2csc(Cl)c2Cl)cnn1C(C)C 761485820 IZURMLYFRXXMLN-SNAWJCMRSA-N 329.252 5.037 30 20 EKED CC[C@H](Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(C#N)cc1 774378431 ABZQUFYBLCKBRU-HSQYWUDLSA-N 331.463 5.110 30 20 EKED CCCCCCCC[S@](=O)Cc1csc(C2CCCC2)n1 790140316 RVRROSOUIMWBFV-NRFANRHFSA-N 327.559 5.410 30 20 EKED CC(C)[C@H]1CC[C@H](C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)CC1 797567036 CMXDLAKLSMFGGC-RBSFLKMASA-N 332.513 5.079 30 20 EKED Cc1cccc(C(C)C)c1NN=Cc1c(C(C)C)nn(C)c1Cl 812233312 WAZBEIZSYZHCLL-UHFFFAOYSA-N 332.879 5.075 30 20 EKED FC(F)Oc1ccc(NN=C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 853299095 JHUDJUDKAVBERM-GHMZBOCLSA-N 336.304 5.054 30 20 EKED C[C@@H](Nc1cccc(F)c1C(C)(F)F)c1ccc(OCC#N)cc1 866605507 OMQPEWPYOBMPMW-GFCCVEGCSA-N 334.341 5.013 30 20 EKED CC(C)[C@@H](N[C@@H](C)c1cc(C#N)ccn1)c1ccc(C(F)(F)F)cc1 902884332 FIOOHUMWKZJYES-SCLBCKFNSA-N 347.384 5.020 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cc1 916135242 NRYPIVHOAQWNSI-LUAWRHEFSA-N 333.774 5.368 30 20 EKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 917509885 GWVISVQKMGBPFS-OJNOIJSXSA-N 344.414 5.015 30 20 EKED C=C(C)COc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 9823745 YEQGTTZKEZNIAL-UHFFFAOYSA-N 336.218 5.201 30 20 EKED CCCCCCNC(=O)c1ccccc1Sc1ccccc1C#N 27090195 DKDYOXCYPFKPBS-UHFFFAOYSA-N 338.476 5.020 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)c1ccccc1 108981763 ZADSBAJNUZFUTQ-CVEARBPZSA-N 338.476 5.213 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCCC(C)(C)C#N 177117981 HGDRLWCHKAWVBP-YBTHPKLGSA-N 332.296 5.133 30 20 EKED C[C@H](CCSc1ccccc1)SCCCC1(C#N)CCOCC1 281754943 FVLPSFWKHKRFLV-QGZVFWFLSA-N 349.565 5.391 30 20 EKED C=CCC[C@H](NC(=O)Nc1cccc(COCC)c1)c1ccccc1 435604642 PXBQUQCXUXSKLQ-FQEVSTJZSA-N 338.451 5.052 30 20 EKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1cccc(C#N)c1 442896328 CGRFMNPAJRWSBD-LLVKDONJSA-N 332.350 5.302 30 20 EKED Cc1[nH]c2ccccc2c1C1CCN(CCCCC(C)(C)C#N)CC1 444593391 RLHOTSRBUSJQQW-UHFFFAOYSA-N 337.511 5.376 30 20 EKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)CCCCC(C)(C)C#N 444594167 GYZLQFHWMGNMGG-CQSZACIVSA-N 326.406 5.418 30 20 EKED Cc1cccc([C@@H]2CCCCN2C(=O)[C@@H](C)c2cccc(C#N)c2)c1C 462180459 MGTURVKZQYVLDG-AVRDEDQJSA-N 346.474 5.032 30 20 EKED C[C@@H](Sc1nc(C(F)(F)F)ccc1C#N)c1ccc(F)c(F)c1 488765113 MIJRCYJLTADMOP-MRVPVSSYSA-N 344.308 5.104 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1cc(Cl)ccc1OC 531695220 BCSJMWDBPNDCNQ-UGSOOPFHSA-N 328.843 5.022 30 20 EKED C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)c(F)c1 537406835 JKZISSMKPYGEFP-APPDUMDISA-N 346.858 5.238 30 20 EKED N#CC1(CCCSCc2cccc3ccccc23)CCOCC1 541881121 PCWHTPXWFLUKQS-UHFFFAOYSA-N 325.477 5.174 30 20 EKED N#CCCCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 588828655 PDHQDENLOWGJLI-UHFFFAOYSA-N 349.459 5.435 30 20 EKED N#C[C@H](C(=O)c1cccc(Cl)c1)c1nc2cc(Cl)ccc2s1 613403084 MCKCAJGGVDABEE-GFCCVEGCSA-N 347.226 5.093 30 20 EKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)C1CC(F)(F)C1 628342916 UCTSVSNHDDVCNU-MRVPVSSYSA-N 341.286 5.063 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1F 734981683 RXINFMAFNGWXBS-KRXBUXKQSA-N 338.350 5.045 30 20 EKED O=C(/C=C/c1ccc(-n2cccn2)cc1)c1cccc(Cl)c1Cl 734982168 YECGFUFFRDPORY-JXMROGBWSA-N 343.213 5.075 30 20 EKED CC[C@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)CC1 783070203 UYONYAAMOIPUIR-XIRDDKMYSA-N 338.476 5.203 30 20 EKED C[C@H](CCC#N)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 787487960 MOQZCEKYICWXOB-SECBINFHSA-N 341.914 5.101 30 20 EKED C=CC(C)(C)CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 889765739 HPVXVGICXVHBFD-UHFFFAOYSA-N 338.835 5.203 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cc2cc(Cl)ccc2o1 916130367 QYDALHJVCONVCL-DAXSKMNVSA-N 333.774 5.531 30 20 EKED O=C(/C(=C\c1ccccc1)c1nc2ccccc2s1)c1ccccc1 6227349 FXZGIAFCYKFCDE-OBGWFSINSA-N 341.435 5.720 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccccc1C(F)(F)F 212897343 PGOYEQLVYFCLQH-NTMALXAHSA-N 327.305 5.150 30 20 EKED CC(C)c1cccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c1 329996503 OZIFWNAZAQIZLJ-UHFFFAOYSA-N 328.456 5.323 30 20 EKED COc1ccc2c(c1)[C@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340451728 OVIYIDKYQYQJCR-FCHUYYIVSA-N 334.463 5.097 30 20 EKED C[C@H](SCCCC1(C#N)CCOCC1)c1ccc2c(c1)CCC2 419581830 DNDSNEQRIBHLDF-INIZCTEOSA-N 329.509 5.070 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](CC(F)F)c1ccccc1 421877282 LOILLMWUPKOCSN-WOJBJXKFSA-N 340.417 5.312 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cccc(C(F)F)c1)c1ccccc1 432854939 SZMXNBGVKVIFLQ-QGZVFWFLSA-N 343.377 5.181 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCCC1(C)C 467468486 OOUZSGGOJGPMCJ-PBHICJAKSA-N 345.512 5.029 30 20 EKED CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H]1CCc2ccccc21 475386770 JXPGJKSWVLPXPU-NRFANRHFSA-N 346.474 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(F)F)CC1 475551173 JVEJYXCDHQXCSD-UHFFFAOYSA-N 336.426 5.048 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c2ccccc12 483971965 DWVGMZMRGVZFJB-UHFFFAOYSA-N 347.433 6.083 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(C(F)(F)F)nc1C)c1ccccc1 512410441 GVWYFHSCPVDMES-HNNXBMFYSA-N 348.368 5.097 30 20 EKED C[C@@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1F 512646757 CWPJFCNUISMQCG-BFUOFWGJSA-N 328.406 5.274 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(C#N)c1 530464568 ZGWOFBDWTFBHSU-UHFFFAOYSA-N 340.854 5.540 30 20 EKED CN(Cc1ccc(C#N)s1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 537724975 JEJJYQAJTDVXCS-CQSZACIVSA-N 344.789 5.009 30 20 EKED CCCc1cccc(C(C)C)c1NCCCC1(C#N)CCOCC1 538610797 ZMFPTPDMBCONNB-UHFFFAOYSA-N 328.500 5.275 30 20 EKED C=CCC[C@H](N[C@H](C)c1nc2c(s1)CCCC2)c1ccccc1 540147089 OVBZMCOARVDDJR-WBVHZDCISA-N 326.509 5.380 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1 591504543 MXDYGPARSSUPSL-XLIONFOSSA-N 344.499 5.212 30 20 EKED N#Cc1ccccc1CNc1cccc(Cl)c1SCC(F)F 609915278 IFOUEGHYOLGLFV-UHFFFAOYSA-N 338.810 5.181 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cccc(Br)c1 610830284 KAOCDGQRPZVATR-SCLBCKFNSA-N 343.268 5.123 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc2oc(C3CC3)nc2c1 611468619 CUKHVPRZJBQIMU-SFHVURJKSA-N 329.403 5.066 30 20 EKED C[C@H](CC#N)OC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 733710585 CUJAZCZWZNHMFR-DYVFJYSZSA-N 345.851 5.019 30 20 EKED CCCCCCCCCC(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1 735791682 BJHILPLTPCNRSK-INIZCTEOSA-N 325.456 5.188 30 20 EKED FC(F)Oc1ccc(NCCCCC(F)(F)F)c(OC(F)F)c1 751561612 MKGVDOSHPRAIFU-UHFFFAOYSA-N 349.246 5.034 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)CCC2 762625755 PVTAJCBPBSPWHS-SBUREZEXSA-N 348.490 5.268 30 20 EKED C#CC[C@@H](NCc1csc(Nc2ccccc2C)n1)c1ccccc1 775399715 IXFKFVIUICSTKW-HXUWFJFHSA-N 347.487 5.049 30 20 EKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 784834107 URYIEFWKQMDXKC-KBPBESRZSA-N 347.409 5.214 30 20 EKED CC1=C(C)C[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)CC1 842688364 FONAGVXQXLMEKS-IRXDYDNUSA-N 336.460 5.123 30 20 EKED O=C(/C=C\c1ccc(-n2cccn2)cc1)c1ccc(Cl)cc1Cl 884003391 PPVYLRBXBJLROL-WTKPLQERSA-N 343.213 5.075 30 20 EKED CCCCCCCCC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 920232916 XWRLCERKMGFEEL-PZJWPPBQSA-N 331.500 5.021 30 20 EKED N#C[C@@H](C(=O)c1ccsc1)c1nc(-c2ccc(Cl)cc2)cs1 41514768 WJUODQVRTPSENZ-ZDUSSCGKSA-N 344.848 5.015 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(Cl)s1 48984811 IKJHJMIGCRQYHJ-OWOJBTEDSA-N 337.878 5.483 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(C(C)(C)C)cc2)cc1 208013459 BMTGTWAKTIYNPT-VFXTVZEFSA-N 333.431 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(n1)CCCC2 476091615 SANDYZCQPWAKLD-UHFFFAOYSA-N 334.463 5.065 30 20 EKED CC(C)(C)c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487289144 URGKFMHPTDKPOT-FQEVSTJZSA-N 334.463 5.149 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 506211354 FYMDYNXFRMUHEE-LJQANCHMSA-N 342.870 5.037 30 20 EKED CC[C@H](SCCCC1(C#N)CCOCC1)c1ccc(F)cc1F 507713316 JCYPRPJIOFLWED-KRWDZBQOSA-N 339.451 5.250 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCCCC(C)(C)C#N)c1 531902791 ILFNOJRTJJBDTA-UHFFFAOYSA-N 330.419 5.391 30 20 EKED C=CCCCS[C@@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 609803845 DIIRNXFRKXAVON-NSHDSACASA-N 346.477 5.417 30 20 EKED CC(C)[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 728764514 RYYQEQFJZPTEOR-VQTJNVASSA-N 342.442 5.241 30 20 EKED CCCCCCCCC(=O)N1CCC(Oc2ccc(C)cc2)CC1 735015844 ASWGRAIGARYYAT-UHFFFAOYSA-N 331.500 5.115 30 20 EKED CCCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2s1 735204191 RCPHCIZQHSENNC-GJZGRUSLSA-N 328.481 5.469 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc3ccc(C)cc3o2)c1 756043716 UHMUHQGZWMLOON-VQIMIIECSA-N 348.446 5.273 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccc(SC(C)(C)C)cc2)cc1 770557829 KAPCFSPOOJFBTD-OAHLLOKOSA-N 340.492 5.480 30 20 EKED C[C@@H](CC(C)(C)C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 773984060 QDCPVNJQXGZUBD-CMPLNLGQSA-N 334.872 5.198 30 20 EKED CC(C)(C)SCCSCc1cc(Cl)ccc1OCC#N 783550651 IGUSMUJKGISKMU-UHFFFAOYSA-N 329.918 5.007 30 20 EKED C=CC[C@H](N[C@H]1CCCc2c1[nH]c1ccc(C)cc21)c1ccncc1 808697121 WIXIIPVHKNJLCT-FPOVZHCZSA-N 331.463 5.156 30 20 EKED C[C@@H](Nc1ccc(OCc2ccccc2F)cc1)c1cccc(C#N)c1 864008782 OYWSXPVLWGJNOM-MRXNPFEDSA-N 346.405 5.449 30 20 EKED COc1ccc(CNc2ccccc2S[C@H](C)CC#N)cc1Cl 179211076 RTLATOVYFFSHJG-CYBMUJFWSA-N 346.883 5.355 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccco1)C(C)C 276416784 MZZVQTZEICRSHF-UHFFFAOYSA-N 340.467 5.574 30 20 EKED C=CCC[C@H](N[C@H]1CCCc2n[nH]cc21)c1ccc(C(F)(F)F)cc1 353626026 WYGKXFXSZRULCK-IRXDYDNUSA-N 349.400 5.103 30 20 EKED N#CC1(CCSCc2ncc(Br)s2)CCCCC1 419476133 PHAOGPHOZLUUDM-UHFFFAOYSA-N 345.331 5.003 30 20 EKED Cc1c(NCc2ccccc2C(C)(C)C#N)cccc1-c1ncco1 427423852 HTFGCJUZCLYJNW-UHFFFAOYSA-N 331.419 5.063 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(C(C)(F)F)c1 440642218 CNRSHBXHINHCOR-UHFFFAOYSA-N 333.403 5.329 30 20 EKED CC(C)CN(C(=O)c1ccc2ccccc2c1)c1ccc(C#N)cc1 499315200 DKQFWFUBEOTOCV-UHFFFAOYSA-N 328.415 5.014 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 537948151 ZORFTFSJADMDDX-KDOFPFPSSA-N 334.385 5.459 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(CC#N)cc1 542526040 PCKWKJQDLNYGOL-NRFANRHFSA-N 346.499 5.196 30 20 EKED CCN(C(=O)c1ccc(-c2ccccc2)o1)[C@@H](C)c1ccc(C#N)cc1 543150719 JZGHSBNPCIFRRN-INIZCTEOSA-N 344.414 5.042 30 20 EKED Cc1ccccc1C(NCc1cc(C#N)ccc1F)c1ccccc1C 545473005 RNHSBTUFIRNWCN-UHFFFAOYSA-N 344.433 5.193 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(OC(C)C)cc1C 548258745 FLFFJFPZOPTGMZ-UHFFFAOYSA-N 341.476 5.313 30 20 EKED CCCCOc1ccc([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 585765163 VSLSREGUSKSECR-AOMKIAJQSA-N 334.463 5.075 30 20 EKED C[C@H](Sc1ccc(Cl)cc1C#N)c1nnc(-c2ccccc2)o1 610655280 XZBGPZJHDWKRKB-NSHDSACASA-N 341.823 5.115 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1Cl 618808039 YRPIXYZIMGNJJR-GTNSWQLSSA-N 331.246 5.203 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 618984888 KKSDITFAOXVWJB-GUYJKWIASA-N 330.884 5.116 30 20 EKED C=C[C@@H](CC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 677567425 YYPVNXQTZICYNX-IBGZPJMESA-N 349.449 5.191 30 20 EKED O=C1/C(=C/c2nc(-c3ccccc3)cs2)CSc2ccccc21 727975206 BRFKTALHCSMQGM-GXDHUFHOSA-N 335.453 5.182 30 20 EKED O=C(/C=C\c1ccc(OC(F)F)c(Cl)c1)c1ccc(F)cc1F 731489387 FINIXKJBUMFQBK-KTAJNNJTSA-N 344.691 5.116 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093198 OKOPMZRKAKOMAP-FQEVSTJZSA-N 349.478 5.432 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1c(F)cccc1Cl 809158689 CCUUSLZJWXWQKQ-MDZDMXLPSA-N 327.742 5.030 30 20 EKED CC(C)N(Cc1ccc(O[C@@H](C)C#N)cc1)[C@H](C)c1ccsc1 817415916 AFRHCYUPQIETGY-JKSUJKDBSA-N 328.481 5.011 30 20 EKED C[C@H](C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc2ccccc2c1 842941095 NKVROLNEOJXGAB-UGSOOPFHSA-N 346.455 5.154 30 20 EKED C[C@H](Nc1cc(C#N)ccc1C(F)(F)F)c1c(F)cccc1F 864002224 TWOMGPODZLBICI-VIFPVBQESA-N 326.268 5.028 30 20 EKED Cc1nc(-c2ccc(N=Cc3cc4ccccc4nc3O)cc2)cs1 912781051 QZVMMGWNKIVZLB-UHFFFAOYSA-N 345.427 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCc1cccs1 191516199 BDKZRKHHIPHDPG-UHFFFAOYSA-N 342.508 5.306 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CC1CCCCCC1 426263866 AUJSUJOAGPKUIT-OAHLLOKOSA-N 330.497 5.380 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(Cl)cc1F)c1ccccc1 432503440 FKZZINFBYPVBSM-MRXNPFEDSA-N 345.805 5.036 30 20 EKED COc1ccc(-c2nc(CSCCCCC(C)(C)C#N)co2)cc1 435889740 VVNYAHJUWMBUCL-UHFFFAOYSA-N 344.480 5.303 30 20 EKED COc1ccc(OC)c(CN(CCCCC(C)(C)C#N)C(C)(C)C)c1 444652321 IYIOKLJSXIEDHW-UHFFFAOYSA-N 346.515 5.024 30 20 EKED N#CCc1ccc(NC(=O)CCCCCc2cccs2)c(Cl)c1 452652884 YSHFPXUBINZWRA-UHFFFAOYSA-N 346.883 5.209 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1 474083875 QFUYJWBWDTXTIH-UHFFFAOYSA-N 333.218 5.047 30 20 EKED Cc1cccc([C@@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)c1C 476167581 SRIIYECMCYHHIQ-IRLDBZIGSA-N 346.474 5.055 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 505029094 LFGOXYRBHJENKO-APWZRJJASA-N 338.451 5.403 30 20 EKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1c(F)cccc1F 507622624 UUDZVUZYOMLSDG-FPPRHVDESA-N 340.417 5.020 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC1CCCC1 510875934 BFMKZKXSMSCDPW-CABCVRRESA-N 330.497 5.236 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 517445100 HAWFVQMYMOSPLS-UHFFFAOYSA-N 328.799 5.011 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H]1CCCC[C@H]1C 519423849 GKAHRTFMUIAGAI-OAGGEKHMSA-N 330.497 5.093 30 20 EKED CC(C)(C#N)CCCN[C@H](c1ccccc1)c1cccc(Cl)c1 532159696 XCLGXZIPNNQMKS-LJQANCHMSA-N 326.871 5.349 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1cccc(C)c1C)c1ccccc1 534665220 SDFFSFSPGUUYKM-SIKLNZKXSA-N 333.475 5.327 30 20 EKED C=C[C@@H](CC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1 535397995 UWJSZVHKFWYAGI-QFBILLFUSA-N 339.866 5.016 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3cccs3)o2)n1 543974854 PVUDCQHUBZMSAR-NSHDSACASA-N 342.445 5.078 30 20 EKED CC1(C#N)CCC(N[C@@H](c2ccc(F)cc2)c2cccs2)CC1 573195472 MYUDQBSLZTYZKX-AVAKVYKDSA-N 328.456 5.039 30 20 EKED N#C[C@H](Sc1nc2ccccc2n1C(F)F)c1ccc(Cl)cc1 619863642 GNEBHQFGXGMRHH-AWEZNQCLSA-N 349.793 5.442 30 20 EKED C=CCC[C@H](NCc1cccc(OCc2ccccn2)c1)c1ccco1 671741304 LSKLOUNWUIBEMP-NRFANRHFSA-N 348.446 5.051 30 20 EKED C#Cc1cccc(N(CC)C(=S)Nc2ccc(Cl)c(Cl)c2)c1 728447669 MDPOPLFSQGLQSG-UHFFFAOYSA-N 349.286 5.198 30 20 EKED Cc1ccccc1-c1noc([C@H](C)ON=Cc2ccc(C(C)C)cc2)n1 744445517 QJJJYTAHWXGSKD-INIZCTEOSA-N 349.434 5.280 30 20 EKED C=CCC[C@@H](NCc1ccccc1O)c1ccc(C(F)(F)F)cc1 749839683 GBRWXQJFXQTONR-QGZVFWFLSA-N 335.369 5.208 30 20 EKED CC(=NNc1ccc(OC(F)F)cc1)c1sc(C(C)C)nc1C 751133720 QZCCXQSVRYQJLH-UHFFFAOYSA-N 339.411 5.012 30 20 EKED CC(C)c1ccc(C=NOCc2ncc(-c3cccs3)o2)cc1 760415727 BQJVYWWHEFMRNS-UHFFFAOYSA-N 326.421 5.077 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2cccs2)cc1 766117160 LZYGHXRMGOGECQ-OAHLLOKOSA-N 334.444 5.318 30 20 EKED CCCCCCCCCC(=O)Nc1cccc(NC(=O)N(C)C)c1C 791916308 ZWKDKBGKUUWSAR-UHFFFAOYSA-N 347.503 5.168 30 20 EKED CC(/C=C/C(=O)c1cncc(F)c1)=C\c1cccc(C(F)(F)F)c1 806573860 UTZCBYIYWLSMHC-DVIJZSFDSA-N 335.300 5.082 30 20 EKED C=CC[C@@H](NC[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 809621195 WVWFUDCPSWIMEZ-KBXCAEBGSA-N 334.385 5.111 30 20 EKED CC(C)(C#N)[C@H]1CCCC1=NNc1nc(Cl)c(Cl)cc1Cl 814740841 ALNKCISXJUQNPK-QMMMGPOBSA-N 345.661 5.160 30 20 EKED C=CC[C@]1(C(=O)O)CCCN([C@H](CC(C)C)c2ccc(CC)cc2)C1 1776154462 BEUCZJZDYQQDEW-IRLDBZIGSA-N 343.511 5.079 30 20 EKED CCN(C(=O)Nc1cccc2ccccc12)[C@H](C)c1ccc(C#N)cc1 51474092 CMYITDCALCYEOG-MRXNPFEDSA-N 343.430 5.326 30 20 EKED C[C@H](Sc1nnc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 118177301 DWUFZQHXZBBFKC-NSHDSACASA-N 341.823 5.115 30 20 EKED C[C@@H](Sc1nnc(-c2ccc(Cl)s2)o1)c1cccc(C#N)c1 189849989 HTVXBENPFMXIQR-SECBINFHSA-N 347.852 5.176 30 20 EKED C/N=C(/O)c1cccc(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)c1C 328767648 HRLBGMZJDPIFBK-HRCADAONSA-N 328.456 5.124 30 20 EKED N#Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)c(Cl)c1 430362503 FAUAOCYKURGYRJ-ZWKOTPCHSA-N 346.817 5.107 30 20 EKED Cc1sc2ncnc(S[C@@H](C)c3cccc(C#N)c3)c2c1C 442901041 IXXFUUJFGPVBJW-LBPRGKRZSA-N 325.462 5.033 30 20 EKED C[C@H](Sc1ccc(C#N)cn1)c1ncc(-c2ccc(Cl)cc2)o1 443517444 DQMNLIKMJVROAP-NSHDSACASA-N 341.823 5.115 30 20 EKED CC(C)c1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 443909067 QBAABHUFVLGGOS-UHFFFAOYSA-N 345.446 5.321 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 455240531 FDPOKUMZZBYLFO-RAUXBKROSA-N 338.495 5.048 30 20 EKED CC(C)C[C@]1(C)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458857034 ZJDNMRJKYRGDBA-FPOVZHCZSA-N 341.499 5.032 30 20 EKED Cc1ccccc1COc1cccc(NCc2ccc(C#N)cc2)c1 484693551 GPFFXNVBWCJZNG-UHFFFAOYSA-N 328.415 5.058 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(C)cc1Br)c1ccccc1 487631127 HYHAFHUIXLNCAI-HNNXBMFYSA-N 344.252 5.056 30 20 EKED C[C@@H](SCc1coc(-c2cccc(F)c2)n1)c1ccc(C#N)cc1 522841710 LQWJKAYOMFNRCB-CYBMUJFWSA-N 338.407 5.347 30 20 EKED Cc1c(Cl)cnc(N[C@H](C)c2ccc(-c3cccnc3)cc2)c1C#N 541350192 VDYNSPPSRUYTLZ-CQSZACIVSA-N 348.837 5.150 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4)s3)CC2)c1 551576004 COQWRSFSAMAOKU-UHFFFAOYSA-N 330.456 5.066 30 20 EKED N#CCCC[C@@H](N[C@H]1CCCc2ccc(Cl)cc21)c1ccccc1 580175143 LFTUTJDNRWICRR-RTWAWAEBSA-N 338.882 5.742 30 20 EKED COc1ccc2cc([C@@H](C)SCc3ccnc(C#N)c3)ccc2c1 610954352 IZRPGOKDSAXNDO-CQSZACIVSA-N 334.444 5.109 30 20 EKED Cc1cc2c(cc1C)[C@H](NCc1ccc(C#N)c(Cl)c1)CCS2 619754723 IZLKAVCJYNZQTR-GOSISDBHSA-N 342.895 5.155 30 20 EKED COc1ccc2cc(C(=O)/C=C\c3ccnc4ccccc34)ccc2c1 731835615 KUWILSQHWDMRIS-LUAWRHEFSA-N 339.394 5.293 30 20 EKED C#CCN(C(=O)c1ccc(-c2ccccc2Cl)o1)C1CCCCC1 743689657 ANLOYCHAXRZJQF-UHFFFAOYSA-N 341.838 5.008 30 20 EKED O=C(/C=C\c1nc(Cl)cs1)c1ccc(N2CCCCCC2)cc1 759075210 JYIMBJVVLFKCJQ-KTKRTIGZSA-N 346.883 5.073 30 20 EKED CCCCCCC[S@@](=O)Cc1coc(-c2ccc(Cl)cc2)n1 764454165 UBNYHHPYFGUGQE-JOCHJYFZSA-N 339.888 5.214 30 20 EKED C=CC[C@@H](N[C@H](C)c1cc(Cl)c(Cl)cc1O)c1ccncc1 774185485 CAMZWADOFDXACA-BDJLRTHQSA-N 337.250 5.062 30 20 EKED Cc1nc(-c2ccc(N[C@@H](C)c3ccc(OCC#N)cc3)cc2)oc1C 777653125 RREFVOSLRYIWKV-HNNXBMFYSA-N 347.418 5.034 30 20 EKED CC(=NN(c1ccccc1)c1ccccc1)c1cnn(C(C)C)c1C 787143793 CEECJIKMQQSRQX-UHFFFAOYSA-N 332.451 5.335 30 20 EKED CCCCCCCC[S@@](=O)Cc1cc(-c2cccs2)on1 790140226 QIRRAEHMSJNBSW-OAQYLSRUSA-N 325.499 5.012 30 20 EKED N#Cc1sc(N2CCCC[C@H]2c2cccc(Cl)c2)nc1Cl 804660869 FKCYKWFXHAWLIY-LBPRGKRZSA-N 338.263 5.053 30 20 EKED N#CCCc1ccc(N[C@H]2CCCc3ncc(C(F)(F)F)cc32)cc1 903293541 KUVCNDAXRBWRIK-SFHVURJKSA-N 345.368 5.046 30 20 EKED N#Cc1c(NC(=O)c2ccccc2Cl)sc2c1CCCCCC2 5679120 FTFBWKAOPPUBHE-UHFFFAOYSA-N 344.867 5.184 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2nc3ccc(Cl)cc3o2)cc1 60705780 KSZRNSANPOFXPU-AWEZNQCLSA-N 328.824 5.017 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1 80838678 MFCPGOPLBLXDNP-LEWJYISDSA-N 346.474 5.547 30 20 EKED N#CCCC[C@H](NCc1csc(Br)c1)c1ccccc1 353913736 JBRXXBNVVNUOPU-HNNXBMFYSA-N 349.297 5.035 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2ccccc2)[nH]1 476152630 OHGOXDBUEWKFIS-UHFFFAOYSA-N 344.458 5.786 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1nc(-c2ccccc2)no1 476156919 QSFLAGVKBPDOQA-KGLIPLIRSA-N 335.432 5.164 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 497476561 ZBAJWZIXXPVDIK-SFHVURJKSA-N 341.842 5.073 30 20 EKED CC(C)(C)c1cnc(COc2ccc(-c3ccc(C#N)cc3)cc2)o1 497661184 NYWXWIPIINWQEH-UHFFFAOYSA-N 332.403 5.090 30 20 EKED CC(C)(CCC#N)CNc1cccc(COc2ccc(F)cc2)c1 512526808 JURUUULQSKSPAQ-UHFFFAOYSA-N 326.415 5.147 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1c[nH]c2cccc(Cl)c12 512779022 MSEMITQUBVVMBJ-UHFFFAOYSA-N 338.838 5.121 30 20 EKED CN(Cc1ccc2ccccc2c1)C(=O)Nc1ccc(C#N)c(Cl)c1 514509197 NREFKFJKCZPLEU-UHFFFAOYSA-N 349.821 5.029 30 20 EKED CSc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1F 539628201 DQLPFQBNSYLHHE-AWEZNQCLSA-N 344.455 5.403 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(-c2ccccc2)c1)c1ccccc1 553691350 YQXMUOAABBXUPZ-OAQYLSRUSA-N 340.426 5.380 30 20 EKED N#Cc1csc(CNc2ccnc(Oc3ccccc3Cl)c2)c1 562912631 PBOQZTLATWRABR-UHFFFAOYSA-N 341.823 5.073 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NC1c2ccccc2-c2ccccc21 580765640 BBYZOEOCAXOUHB-HSZRJFAPSA-N 336.438 5.295 30 20 EKED C[C@@H](Nc1cccc(C(F)F)c1C#N)c1ccc(OC(F)F)cc1 582330813 MREXWDRMEYUPIX-SNVBAGLBSA-N 338.304 5.270 30 20 EKED N#C[C@H](C(=O)c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 592973967 MELVOQAKVSIEPT-MRXNPFEDSA-N 346.386 5.079 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc2cnccc12 604467563 MCACKWRPKGATHF-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C[C@@H](Oc1ccc(-c2ccc(C#N)cc2)cc1)c1nc(C(C)(C)C)no1 609850277 JNQOTYKFABYUDD-CQSZACIVSA-N 347.418 5.046 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(OC(F)(F)F)cc1 740765185 RPOYAAYVAZBOMN-KTKRTIGZSA-N 343.304 5.030 30 20 EKED CO[C@@H](C/N=C\c1c(O)ccc2ccccc12)c1ccc(Cl)cc1 741755260 AKKYBWAIMLDRPH-YOYPMJMESA-N 339.822 5.005 30 20 EKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1cccc(-c2ccncc2)c1 741840885 GQCZUJPOVPXOCY-WAYWQWQTSA-N 343.357 5.530 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2cccc(F)c2)s1 750907982 ZZTSEZIKVUDPFE-FNORWQNLSA-N 329.421 5.215 30 20 EKED N#Cc1ccc(/C=C(\Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764431069 ABLLJKOHFLYEHI-QPEQYQDCSA-N 348.711 5.455 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(-c2cccs2)cc1)c1ccncc1 766019570 MNSUEZDOTADXNI-OXJNMPFZSA-N 334.488 5.778 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1cncc3ccccc13)C2=O 772803954 AJDALOSNFKWHEH-XNTDXEJSSA-N 331.440 5.169 30 20 EKED C=CCCOCCCCC(=O)Nc1ccc2c(c1)oc1ccccc12 775659132 XYGMQJIBNSCNMK-UHFFFAOYSA-N 337.419 5.288 30 20 EKED O=C(/C=C/c1scnc1C1CC1)c1ccc(SC(F)F)cc1 782324523 CYCWJYOYNMCIIN-BQYQJAHWSA-N 337.416 5.231 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCCCCC1 836386629 QDWYGJKLLADXRU-INIZCTEOSA-N 345.512 5.126 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 839436126 SNKJODORCDZTJQ-ZBFHGGJFSA-N 346.352 5.019 30 20 EKED COc1ccc2cc(C(=O)/C=C/c3ccc4ncccc4c3)ccc2c1 916136941 HDMSKCOFZXQYDZ-VZUCSPMQSA-N 339.394 5.293 30 20 EKED CC(CCCCc1ccccc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776034660 RXBQZKKEUPXIKU-UHFFFAOYSA-N 344.842 5.239 30 20 EKED C[C@@H]1CCc2nc(N=C(O)c3scnc3C3CCCC3)sc2C1 329787003 QXLRPQFNRNNFKP-SNVBAGLBSA-N 347.509 5.018 30 20 EKED CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@H]3C2)c1 330123232 ANWLFFSAQSBHMT-MELADBBJSA-N 334.847 5.221 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@H](N[C@@H](CCC#N)c2ccccc2)C1 343435402 BHRXMMCEIBJVCZ-HKBOAZHASA-N 333.479 5.051 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H](CC)c3ccc(C#N)cc3)oc12 447518367 NWAVLVXHWWVHMJ-BEFAXECRSA-N 348.446 5.505 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)c(C)c1 460080184 VJQVMQCDUALDMD-MGPUTAFESA-N 342.508 5.298 30 20 EKED C=C(C)C[C@H](C)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 464573052 XBVPDQXGUAQBHX-FXAWDEMLSA-N 346.474 5.018 30 20 EKED CCc1ccc2occ(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2c1 552072498 MTFDZSQLSMKGTL-AWEZNQCLSA-N 338.432 5.065 30 20 EKED N#CCCC[C@@H](NC1CC(c2cccc(Cl)c2)C1)c1ccccc1 559864066 RKNOGQJJPLRRCS-DQVLVPHSSA-N 338.882 5.611 30 20 EKED Cc1ccc(Sc2ccc(NC[C@@H](C#N)CCC#N)cc2)c(C)c1 581149814 KLHXSSROFAYNRU-QGZVFWFLSA-N 335.476 5.310 30 20 EKED C=CCCCSc1nnc(-c2cccs2)n1Cc1ccccc1 605075782 LLYJBFDKAAQTNL-UHFFFAOYSA-N 341.505 5.113 30 20 EKED C[C@H](Oc1ccccc1NCc1ccc(C#N)cc1)c1ccccc1 609671254 WOJSZIUCKIPQAQ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED CCC(=NNc1cnnc2ccccc12)c1ccc(Cl)c(Cl)c1 733748429 WUTCWZPAEQECCJ-UHFFFAOYSA-N 345.233 5.163 30 20 EKED CC(C)(CCC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 754523314 FDTCYGCFDBGHBA-LJQANCHMSA-N 342.442 5.169 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](F)CC1CCCCC1 793460022 GGNVDZMRBCJBAF-HOCLYGCPSA-N 348.487 5.185 30 20 EKED C[C@@H](C(=O)OCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 798784437 ARIMNCYRVLWTBH-CYBMUJFWSA-N 341.373 5.072 30 20 EKED CCOc1ccc(/C=C/C(=O)c2cccc3ccccc23)cc1OC 916134836 JYHCNCVNMGRZRR-ACCUITESSA-N 332.399 5.143 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)CC(C)(C)C 917027077 VUQQEGLSFKUEJL-HOCLYGCPSA-N 340.492 5.449 30 20 EKED CCCCCCCCCN(C)C(=O)Nc1ccc(NC(C)=O)c(C)c1 918542570 VGKGRPDUZXASMQ-UHFFFAOYSA-N 347.503 5.168 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C(C)(C)C)cc1 1776784296 PUZSUFAUCIDMMV-LJQANCHMSA-N 333.516 5.278 30 20 EKED CCCCCCCCCCNc1nc2ccccc2c(C)c1C(=O)O 1776787755 NHRSGIVECVHJIQ-UHFFFAOYSA-N 342.483 5.794 30 20 EKED O=C(/C=C\c1ccc(C(=O)O)s1)c1ccc(C2CCCCC2)cc1 1777569657 BOYCGJNFBMFPJG-BENRWUELSA-N 340.444 5.390 30 20 EKED C=CCN(C(=O)c1cc(C)cc(C)c1)c1nc(-c2ccccc2)cs1 3558692 OEHGWQGZPMPYOV-UHFFFAOYSA-N 348.471 5.260 30 20 EKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCC(C)(C)CCC#N 92138885 NQPDPYAQPZBDPW-UHFFFAOYSA-N 331.460 5.084 30 20 EKED N#CCC[C@H](NCc1ccc(-c2ccc(F)cc2)o1)c1ccccc1 178755939 USFWIUMDWSOFIU-FQEVSTJZSA-N 334.394 5.220 30 20 EKED CCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(F)cc1F 181893821 DDMRKFYORJEPQD-VBKZILBWSA-N 344.405 5.059 30 20 EKED N#CCCCCSc1ncnc2cc(-c3ccc(F)cc3)sc12 195544723 UHINMINNLLMJEQ-UHFFFAOYSA-N 343.452 5.283 30 20 EKED N#Cc1ccc(F)c(CSc2ncc(C(F)(F)F)cc2Cl)c1 217460076 XAPNFOFHAJBPDF-UHFFFAOYSA-N 346.736 5.057 30 20 EKED N#CCCCOc1cccc(N[C@H](c2ccc(Cl)cc2)C2CC2)c1 324414395 WSLGIHPKUAIRTO-FQEVSTJZSA-N 340.854 5.586 30 20 EKED C[C@@H](CCC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 352173789 GIAREYFKLDMNMU-RXVVDRJESA-N 334.463 5.122 30 20 EKED CCC[C@@H]1[C@H](C)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458801128 MQPBXROWWLYROB-YZGWKJHDSA-N 341.499 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1Cc2ccccc2C1 475557899 FTRXNPSTZAIYAW-UHFFFAOYSA-N 348.490 5.075 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1ccc(C#N)c(F)c1 479514287 VYOXIHFAOPQFJM-UHFFFAOYSA-N 344.436 5.156 30 20 EKED N#Cc1cc(Cl)ccc1CN[C@@H](c1ccc(Cl)cc1)C1CC1 480867531 NNLTVSASBOFWDE-GOSISDBHSA-N 331.246 5.106 30 20 EKED CC[C@@](C)(C#N)C(=O)N[C@@H](C)c1ccccc1-c1ccc(Cl)cc1 513295148 FBGOEAZDOAMSJI-XOBRGWDASA-N 340.854 5.124 30 20 EKED N#Cc1ccc(CNc2cccc(CSCc3ccccc3)c2)o1 537731790 ZTNFQLQTRWWJAF-UHFFFAOYSA-N 334.444 5.197 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2occc2s1 609860111 LWAHTFXWMZQGAX-LLVKDONJSA-N 342.445 5.141 30 20 EKED Cc1cccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 613407086 IDDZQUILLRZWGN-CQSZACIVSA-N 340.835 5.057 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)cc1Cl 619746983 XJWYPWGSNXYLKK-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C=CCN(C(=O)Nc1cc(C)ccc1SCC(F)(F)F)C(C)C 737026146 HYUNWGNAHGQTBX-UHFFFAOYSA-N 346.418 5.078 30 20 EKED CC(=NNc1cc(F)c(F)cc1F)c1ccc(-c2ccncc2)cc1 745203142 FKAVCRKORFZFBK-UHFFFAOYSA-N 341.336 5.002 30 20 EKED C[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccc(OCC#N)cc1 769785440 BKRZONPXXZDVIQ-MRXNPFEDSA-N 348.471 5.168 30 20 EKED CC(C)(C)C1CCC(CC(=O)[C@@H](C#N)c2cnc3ccccc3n2)CC1 792111085 QGIATMHJXPKILI-JCYILVPMSA-N 349.478 5.049 30 20 EKED CC[C@H](C#N)[C@@H](OC(=O)c1sccc1C(F)F)c1cccs1 873550499 CGNJZNXZFJGJCN-BXKDBHETSA-N 341.404 5.195 30 20 EKED CSc1ccc(C(=O)/C=C\c2cc(Br)cs2)cc1 916133513 UYNDCUVMTRKAMQ-SREVYHEPSA-N 339.279 5.129 30 20 EKED O=C1/C(=C\c2cccs2)CCOc2c1ccc(Cl)c2Cl 921138608 UXXGEAJIVPKKHW-HJWRWDBZSA-N 325.216 5.104 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccccc3F)cc2)cc1 1776131345 OYJUEDSEMCSNJR-VGOFMYFVSA-N 346.357 5.087 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)c2ccc3ccccc3c2)n1 84695991 XAIBETWTKWQCOH-KBXCAEBGSA-N 348.471 5.400 30 20 EKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)c(Cl)cc1F 129004699 ASZSOVNEHJXHAE-UHFFFAOYSA-N 348.830 5.046 30 20 EKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 151709922 GUDACISLQGKTDJ-UWJYYQICSA-N 347.462 5.066 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2ccncc2)cc1 153700104 GUIWQFRFMFTCHZ-DLBZAZTESA-N 327.431 5.032 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1O 186150862 CUQGPFFAXWMUHG-IIBYNOLFSA-N 330.431 5.241 30 20 EKED C[C@@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCCCC(C)(C)C#N 278365160 XIDVVKAWWRHDFO-QKVFXAPYSA-N 346.323 5.523 30 20 EKED C[C@@H]1C(=O)CC[C@@H](C(O)=Nc2ccc3ccc(Cl)cc3n2)C1(C)C 328657329 OTRMKTFIEMCDOC-RISCZKNCSA-N 344.842 5.118 30 20 EKED C[C@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)C1CCCC1 425457490 KUBZRXBEEBKDGF-LJQANCHMSA-N 340.511 5.093 30 20 EKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(C#N)c1 442776762 CMWJTOTUYKPSTO-INIZCTEOSA-N 339.398 5.395 30 20 EKED CN(Cc1ccccc1C(C)(C)C#N)[C@H]1CCCC[C@H]1C(F)(F)F 463446321 WSALVCSIQGVLRY-SJORKVTESA-N 338.417 5.041 30 20 EKED CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1S[C@@H](C)CC#N 475773873 NCPWCNBQTNDXIU-ARFHVFGLSA-N 330.497 5.236 30 20 EKED N#Cc1ccc(F)c(CNc2cccc(COC3CCCCC3)c2)c1 486115630 ACBHOONVKHVEEL-UHFFFAOYSA-N 338.426 5.159 30 20 EKED N#Cc1c(F)cccc1Sc1nnc(-c2ccc3ccccc3c2)o1 506858141 WNYRGKWVIMLUFN-UHFFFAOYSA-N 347.374 5.052 30 20 EKED C[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 509704576 PUCHZLOHXHWSBJ-JKSUJKDBSA-N 349.434 5.003 30 20 EKED CC(C)c1ccc(-c2csc(NC(=O)[C@H](C)C#N)n2)c(C(C)C)c1 530816107 YOYHLEYPSVMJLP-CYBMUJFWSA-N 341.480 5.155 30 20 EKED Cc1coc(-c2ccc(C)c(NCc3ccc(Cl)cc3C#N)c2)n1 558721196 JDTYHYFPBLXPCS-UHFFFAOYSA-N 337.810 5.096 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)CCCCC#N 593973972 XUBBEXBUFDGGNN-UHFFFAOYSA-N 330.497 5.442 30 20 EKED N#CC1(c2ccc(CNc3ccc(F)c(C(F)(F)F)c3)cc2)CC1 600848784 JZZISYACFVSATQ-UHFFFAOYSA-N 334.316 5.012 30 20 EKED C[C@H](NC(=O)Nc1ccccc1-c1cccs1)c1cccc(C#N)c1 610318109 IUUMLFBTENNNOT-AWEZNQCLSA-N 347.443 5.169 30 20 EKED CC[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1nc(C)cs1 729641790 XSYOFSLHTYZXSV-CCXXMQEHSA-N 329.252 5.034 30 20 EKED CCCCCCCC(=O)c1ccc(OC(=O)C2(C#N)CCCC2)cc1 746026019 XTHGAJYLIHQCNA-UHFFFAOYSA-N 341.451 5.219 30 20 EKED CCc1oc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 760366194 VAFWSUXFLMPNND-IBGZPJMESA-N 344.414 5.058 30 20 EKED C=CC[C@@H](N[C@H](CC)c1ccc(Cl)cc1Cl)c1ccncc1 766021470 TYGVHYJFZUZZJF-QZTJIDSGSA-N 335.278 5.747 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(Br)c(F)c1)c1ccccc1 773114976 LMGWCKDSJFHUAK-FZKQIMNGSA-N 346.243 5.003 30 20 EKED Cc1cncc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)c1 789149077 UVZYHGNQGMKXRR-VOTSOKGWSA-N 340.835 5.063 30 20 EKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792096526 PKPDTDQCUHGLBD-QIXNEVBVSA-N 346.817 5.168 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2cc3ccccc3o2)c(C(F)(F)F)c1 811685615 XQNXGFGYEWUFJS-FPLPWBNLSA-N 341.288 5.219 30 20 EKED CCCCCCCOc1ccc(CNC(C)(C)C[C@@H](C)C(=O)O)cc1 1776787838 AKPUWQUEAXZXNY-QGZVFWFLSA-N 349.515 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccccn1 191441075 QLRSYDVVZLPMBX-MRXNPFEDSA-N 337.467 5.158 30 20 EKED CC(C)c1cc(C(=O)Nc2ccc(C#N)cc2Cl)c2ccccc2n1 430353431 MAYVNPRIXSBUQD-UHFFFAOYSA-N 349.821 5.136 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1cccc(C#N)c1 435041300 IPWVUQZMNRCEDP-GJZGRUSLSA-N 338.476 5.191 30 20 EKED CC(C)c1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 437554606 GTQGTUFNLQODRE-SFTDATJTSA-N 347.462 5.114 30 20 EKED C[C@@H](SCc1csc(-c2ccoc2)n1)c1cccc(C#N)c1 443134443 ANUBJRTVDRYSQJ-GFCCVEGCSA-N 326.446 5.269 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2c1O[C@H](C)C2 451328741 IRCDHCTXXXYZLK-OAHLLOKOSA-N 335.447 5.114 30 20 EKED C[C@@H](CC(C)(C)C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 454769463 UACUYBDVVONWPB-UONOGXRCSA-N 333.501 5.027 30 20 EKED C=C(C)[C@@H](N[C@H]1CCCc2nc(CC)sc21)c1ccc(F)c(F)c1 480661958 SXHPLDZQGHCJKW-FUHWJXTLSA-N 348.462 5.268 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1F)C1CC1 505058231 RIQLWNQYDZKHPM-UHFFFAOYSA-N 338.426 5.141 30 20 EKED C[C@H](CC(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccccc1 515689503 HTNAQBAZQDZWQI-OAHLLOKOSA-N 346.455 5.419 30 20 EKED CC(C)(C#N)CCCNc1cc(Cl)ccc1OCC(F)(F)F 531649192 UYMIUKWORCYFAS-UHFFFAOYSA-N 334.769 5.023 30 20 EKED N#CCC[C@H](N[C@@H]1CCc2c(Cl)cc(Cl)cc21)c1ccccc1 537946751 RXYWDCLQWDQNEE-RBUKOAKNSA-N 345.273 5.615 30 20 EKED CCN(C(=O)CC/C=C/c1ccccc1)c1ccc(C#N)c(Cl)c1 538072902 XVEFUPOIHDVHFV-UXBLZVDNSA-N 338.838 5.058 30 20 EKED CC(C)COc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 540148534 SASNIUDWLLJKDW-AVRDEDQJSA-N 336.479 5.417 30 20 EKED C=CCCOCCCCC(=O)Nc1cc(Cl)c(C)cc1Cl 540610415 GXSJUHLMLFWAHJ-UHFFFAOYSA-N 330.255 5.003 30 20 EKED C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1 540838920 JWGWENSURUFIAI-AWEZNQCLSA-N 329.403 5.264 30 20 EKED N#CCCC[C@H](NCc1ccc(CC(F)(F)F)cc1)c1ccccc1 601123804 KEHUYYWWKXYGGC-IBGZPJMESA-N 346.396 5.316 30 20 EKED CCCn1c(C)cc(C(=O)CS[C@H](C)c2ccc(C#N)cc2)c1C 609826119 UOPHYMYXPRCELO-MRXNPFEDSA-N 340.492 5.064 30 20 EKED CC(C)(C)c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611093110 DWQSVLWRRASMKZ-UHFFFAOYSA-N 347.245 5.415 30 20 EKED CN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1-c1ccccc1 612462478 UBNNBDYURNQLQV-UHFFFAOYSA-N 346.817 5.155 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)C1CCCCC1 730420153 AKIDYTQDRQFLMU-WFASDCNBSA-N 344.455 5.218 30 20 EKED N#CCOc1cc(F)ccc1NCc1ccc(-c2ccsc2)cc1 766770301 UYQVQLIHPUOHGU-UHFFFAOYSA-N 338.407 5.069 30 20 EKED C=C(C)C[C@H](C)C(=O)OCC(=O)Nc1c(C(C)C)cccc1C(C)C 767704256 XDQPLWMEEZFURX-INIZCTEOSA-N 345.483 5.017 30 20 EKED C[C@H](Oc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 794719836 JGTLVDIZXWKWQO-AWEZNQCLSA-N 338.407 5.045 30 20 EKED Cc1ccc(-c2csc(CNc3ccccc3O[C@H](C)C#N)n2)cc1 795257779 UWUQCVRFIIEVNH-OAHLLOKOSA-N 349.459 5.022 30 20 EKED CC(C)(CC(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1)C(F)(F)F 796513697 ZEDNRNNCIVNJFE-UHFFFAOYSA-N 347.336 5.109 30 20 EKED CCCCCCCOc1ccc(/C=C/C(=O)c2ccnc(O)c2)cc1 806556717 YDJAYOOIWOWPET-FMIVXFBMSA-N 339.435 5.033 30 20 EKED Cc1cccnc1[C@@H](NCc1ccccc1C(C)(C)C#N)C(C)(C)C 934288861 DKVDKIPOHBIXKX-HXUWFJFHSA-N 335.495 5.068 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc(F)cc1 1776131674 YNDMOPHMKSBOGG-VGOFMYFVSA-N 346.357 5.087 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776339691 NCZWDTZMOGWIAH-WEVVVXLNSA-N 348.398 5.226 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1csc2ccccc12 1776784445 OHZKZLXXUALPSC-INIZCTEOSA-N 333.497 5.195 30 20 EKED Cc1ccccc1[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)C(C)(C)C 175986911 QZPUJITXCJWBAK-UWJYYQICSA-N 336.479 5.163 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1csc(-c2cccs2)n1 303430501 DLUKAZKBEGZTDE-UHFFFAOYSA-N 346.521 5.080 30 20 EKED CC(O)=Nc1cccc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329024506 UWSFMHPYTRXGPH-QTLCSOKXSA-N 342.483 5.919 30 20 EKED N#CC1(CSCc2nc(-c3c(F)cccc3F)cs2)CCC1 419466168 SCWQGQCFCCFLBT-UHFFFAOYSA-N 336.432 5.015 30 20 EKED Cc1c(Cl)cccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432468485 IYBWBOFTKDJIMA-SFHVURJKSA-N 341.842 5.205 30 20 EKED Cc1oc(-c2ccccc2)nc1CN[C@@H](CCCC#N)c1ccccc1 433023841 UDFXOJPQGPRJSE-FQEVSTJZSA-N 345.446 5.175 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 433928844 CTFDFKKBELTKGX-CQSZACIVSA-N 334.444 5.084 30 20 EKED CC(C)(NCc1ccc(C#N)cc1Cl)c1cccc(Cl)c1F 439420499 JIFOPZLJKMMVDM-UHFFFAOYSA-N 337.225 5.029 30 20 EKED CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458798805 IPUZUCDRYVRJBT-SXLOBPIMSA-N 341.499 5.032 30 20 EKED C[C@H](C1CCCCC1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458840005 MXTVQEGBLMXKNN-XLIONFOSSA-N 341.499 5.032 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1cc(F)ccc1C#N 469003652 PLBXMXUDDZOMDF-UHFFFAOYSA-N 344.436 5.156 30 20 EKED Cc1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1F 480869409 XVRIFYAQAIIDBQ-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(C#N)c1 500771842 NUIYGAKOERKRFW-SFHVURJKSA-N 341.842 5.073 30 20 EKED N#CC1(CCCS[C@H]2CCc3ccc(Cl)cc32)CCOCC1 512378411 PKUWEZOTXFXERG-KRWDZBQOSA-N 335.900 5.161 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 519426020 DDTPJVFSKHFZNW-HNNXBMFYSA-N 338.476 5.314 30 20 EKED CC(C)c1ccoc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 574539505 ZBBXFRHUCMGVOU-GFCCVEGCSA-N 344.823 5.156 30 20 EKED N#Cc1ccccc1CN[C@@H](c1c(Cl)cccc1Cl)C1CC1 576387669 QLNXFQFNKFHPFF-GOSISDBHSA-N 331.246 5.106 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2C)CC1 601182583 WUNJTGPSDPQAEA-UHFFFAOYSA-N 336.435 5.217 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610356320 OVFBRSWVFHEYFW-UTKZUKDTSA-N 349.478 5.014 30 20 EKED C[C@@H](CC1CCOCC1)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611871375 ATGLLHQIOQKOQV-ZWKOTPCHSA-N 348.490 5.081 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2cccc(COC(C)(C)C)c2C)C1 666256716 SVDRCNXKFCUIGE-KRWDZBQOSA-N 344.499 5.130 30 20 EKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)Cc2c(Cl)cccc21 727975179 QSZMQECJRLXGLR-RAXLEYEMSA-N 337.831 5.286 30 20 EKED CC(=C/c1ccccc1)/C=C/C(=O)c1cccc(-c2ccncc2)c1 741471175 XCMXHRMGLJPQJF-CBIRDDJDSA-N 325.411 5.591 30 20 EKED CSc1ccc(C(=O)/C=C\c2ccc(OC(F)F)cc2)cc1F 741847213 LXUVLKOSIVHNIP-YWEYNIOJSA-N 338.350 5.045 30 20 EKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1ccc2c(c1)COC2 742434310 FOQMCMWWPWWTMK-CMDGGOBGSA-N 332.424 5.341 30 20 EKED CC(=NNc1cccc2ccccc12)c1cnn(-c2ccccc2)c1C 747060238 MCWYZUNETHOCFG-UHFFFAOYSA-N 340.430 5.170 30 20 EKED CC(C)Oc1ccc(NCc2ccccc2C(C)(C)C#N)c(F)c1 767810296 KSBCCDJXHSCEMG-UHFFFAOYSA-N 326.415 5.026 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccc(C)cc2)C2CCC2)c1 779033772 ZNUYENODOIEVTM-JTHBVZDNSA-N 348.490 5.307 30 20 EKED CC(/C=C\C(=O)c1ccnc(F)c1)=C/c1cccc(C(F)(F)F)c1 806574406 ONXAUAHCQHPINH-ZGCJARKRSA-N 335.300 5.082 30 20 EKED C[C@H](CNc1ccccc1O[C@H](C)C#N)c1ccc(C(F)(F)F)cc1 809636735 CPORABCZYYEQQJ-ZIAGYGMSSA-N 348.368 5.212 30 20 EKED C[C@@H](c1ccc(CNc2ccccc2O[C@H](C)C#N)cc1)C(F)(F)F 834571279 POUCIPWOMZLYJD-KGLIPLIRSA-N 348.368 5.255 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1sccc1CC#N 875590180 PHQMNPPKUGFXFR-UHFFFAOYSA-N 326.465 5.142 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)CCCCC#N)s2)cc1 134212218 MPUSIVXIBKZJFH-INIZCTEOSA-N 327.497 5.114 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccc3nc(C4CC4)sc3c2)cc1 178205097 SODFFBPPFOIQTQ-CYBMUJFWSA-N 349.459 5.077 30 20 EKED CC[C@@H](c1ccc(F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303767067 PYAJLHPJNBVLKT-LBPRGKRZSA-N 343.286 5.094 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)C1CCC(C(F)(F)F)CC1 354559900 CEQBXFSABDCECI-RYKRPPSOSA-N 338.417 5.378 30 20 EKED CC1(C#N)CCC(N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 449298159 GEPIHBGHVCZSCS-RSWLEGOBSA-N 336.401 5.013 30 20 EKED N#Cc1ccc(C(=O)Nc2ccccc2Sc2ccccc2)s1 486634691 YCCWDGUFIHHXMG-UHFFFAOYSA-N 336.441 5.023 30 20 EKED N#CCc1ccc(NCc2c(OC(F)F)ccc3ccccc23)cc1 513593942 JLCNOXGPLJJLMR-UHFFFAOYSA-N 338.357 5.119 30 20 EKED N#Cc1ccc(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)cc1 524264660 XTFSMKFJHCZQQD-UHFFFAOYSA-N 349.393 5.026 30 20 EKED C=C(CC)CSCc1csc(-c2cccc(OC)c2OC)n1 539094244 SLIJKROUUQDOTB-UHFFFAOYSA-N 335.494 5.027 30 20 EKED Cc1ccccc1-c1cnc(CN[C@H](CCCC#N)c2ccccc2)o1 576896137 NQCZFPXHIWCCSO-HXUWFJFHSA-N 345.446 5.175 30 20 EKED CC(C)(C)OCc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1 611475505 BYGLRGSCCFMVQR-NRFANRHFSA-N 334.463 5.363 30 20 EKED N#Cc1ccc(CN[C@H](c2cccs2)C2CCCC2)cc1Cl 619754526 CGJDJFSNTJKUKL-SFHVURJKSA-N 330.884 5.294 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 619755319 XCQRBGUSCZASBR-LLVKDONJSA-N 338.760 5.081 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744037708 CCYYXIFULJZTFA-ZIAGYGMSSA-N 347.409 5.214 30 20 EKED C=C[C@H](CC(=O)O[C@H](c1ccccc1)c1ccncc1)c1ccccc1 759275682 MEYRBQPYVLSITD-WZONZLPQSA-N 343.426 5.074 30 20 EKED CC1(C)CCC(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)CC1 768766673 UORKNRSSJKTGJT-INIZCTEOSA-N 338.476 5.203 30 20 EKED Cc1ncsc1C(=O)/C=C\c1cnc(-c2ccc(Cl)cc2)s1 789126488 FTXMIADUIOCYIH-SREVYHEPSA-N 346.864 5.125 30 20 EKED COc1cc(C(=O)/C=C/c2ncc(C(C)(C)C)s2)ccc1SC 790599676 APSDSZJWFGEEHK-VQHVLOKHSA-N 347.505 5.067 30 20 EKED C[C@@H](Nc1ccccc1SCc1ccccc1)c1cccc(C#N)c1 863996820 HDYMBNLKXPQGCR-QGZVFWFLSA-N 344.483 6.024 30 20 EKED C[C@H](Nc1ccc(Br)cc1Cl)c1cccc(C#N)c1 37252959 UEEZQHQNMUANBD-JTQLQIEISA-N 335.632 5.147 30 20 EKED Cc1ccc(Cl)cc1NC(=O)Nc1ccccc1SCCC#N 122195718 DDJQBEXFDLHDEZ-UHFFFAOYSA-N 345.855 5.298 30 20 EKED CCC[C@H]1CCCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 185198263 FVUCHSYLLCSJAT-CVEARBPZSA-N 345.512 5.125 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C)n(C2CCCCC2)n1 410345680 DFDGHIFPLSSYOD-UHFFFAOYSA-N 337.467 5.068 30 20 EKED C=CCCc1ccccc1NC(=O)c1oc(-c2ccccc2)nc1C 410391445 IBMTZGXUQALYDO-UHFFFAOYSA-N 332.403 5.021 30 20 EKED N#CCC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1Cl 428725296 OQDJITJXYSCZNE-UHFFFAOYSA-N 339.609 5.166 30 20 EKED C=CC[C@@H]1N(C(=O)c2cnc(-c3ccsc3)s2)CCCC1(C)C 470285435 ILVBEODETRGHEF-HNNXBMFYSA-N 346.521 5.079 30 20 EKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCCC1 487387195 INYMMXOKPTVIBV-FXAWDEMLSA-N 326.484 5.144 30 20 EKED N#CC1(CCCS[C@@H]2CCc3c(Cl)cccc32)CCOCC1 510084390 JWNPPMUXDYUKCB-QGZVFWFLSA-N 335.900 5.161 30 20 EKED CCC(CC)[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccs1 512662417 XCKIRJBGDAVTQL-BFUOFWGJSA-N 330.472 5.587 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1F 512668772 WOAREHQSZDWJHR-GAJHUEQPSA-N 344.433 5.332 30 20 EKED C=CCC[C@@H](N[C@@H](C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 526982208 WFQGAVJMNIBYPP-KBXCAEBGSA-N 341.417 5.117 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)ccc1OC 531695218 BCSJMWDBPNDCNQ-FZKQIMNGSA-N 328.843 5.022 30 20 EKED C=CCCNc1ccc(Oc2nncc3ccccc23)c(Cl)c1 532769128 JDHIKMBMVMKSDK-UHFFFAOYSA-N 325.799 5.064 30 20 EKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2cccc(C#N)c2)cc1 536164033 UYPWQKKCNJFEQN-HXUWFJFHSA-N 333.435 5.051 30 20 EKED N#Cc1ccc(CN2CCC(Sc3ccc(Cl)cc3)CC2)s1 536664850 ZBAYZDDUTDIDSA-UHFFFAOYSA-N 348.924 5.030 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)CCC(C)(C)C#N)s2)cc1 538467406 FBEHJTYOEFGRBD-INIZCTEOSA-N 341.524 5.360 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2ccncc2)cc1 539609091 DCQWSWSRXBOKAW-JKSUJKDBSA-N 345.421 5.171 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CCC(C)(C)C 542551727 UYDJUEYRMBIAHQ-GJZGRUSLSA-N 332.513 5.482 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1Cl 552956749 OJSNTHDVCSIGPP-HXPMCKFVSA-N 328.818 5.079 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H]1CCc2sc(Cl)cc21 573352951 NYMKOLFIWXOQBA-SJORKVTESA-N 342.895 5.318 30 20 EKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cc(F)ccc1F 614179197 KBMKAIQIAMHUGY-LJQANCHMSA-N 328.406 5.007 30 20 EKED C[C@H]1CC(=NNc2nc3ccccc3s2)c2ccsc2S1 743418726 HRXHAFOVOQMZDV-VIFPVBQESA-N 331.491 5.058 30 20 EKED COc1cc2c(cc1NCc1cccc(C#N)c1)oc1ccccc12 754424070 HIIDNVBYCAMAOX-UHFFFAOYSA-N 328.371 5.078 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccc(Br)cc1)c1ccncc1 766020946 RPSJFHOZOASQDU-MSOLQXFVSA-N 345.284 5.202 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1 766022952 SZYCFFUQUNNPGH-AVRDEDQJSA-N 335.495 5.040 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)C1CCCCC1)c1ccc(OCC#N)cc1 776159134 IDBPJOLJWOUIPO-JPYJTQIMSA-N 348.490 5.561 30 20 EKED O=C1/C(=C/c2cnc(C3CCC3)s2)CCc2[nH]c3ccccc3c21 781550946 DEHIVKLMVPJOKH-JLHYYAGUSA-N 334.444 5.104 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3ccsc3Cl)c2)s1 790967139 DNAANNRRNHTUFN-UHFFFAOYSA-N 344.892 5.291 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792096841 SJZBYVBEILXFPD-RNUYOQPASA-N 346.817 5.168 30 20 EKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc(Cl)c1 795980197 CFBHUSMNGNJUDU-WMLDXEAASA-N 327.811 5.032 30 20 EKED CC[C@H](C#N)[C@H](OC(=O)c1cscc1C(F)F)c1cccs1 893272146 JGYFWFXJRRVYRO-RNCFNFMXSA-N 341.404 5.195 30 20 EKED C[C@]1(CCNC(CCC(F)(F)F)CCC(F)(F)F)CC1(F)F 926706004 QPRDQGLSAOOOCM-JTQLQIEISA-N 341.286 5.065 30 20 EKED O=C(/C=C/c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)cc1 59404718 HKQYQSLDDIPJJQ-IZZDOVSWSA-N 335.384 5.219 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCS[C@H](C(C)C)C1 191507349 UPKKBLAIAJPKDM-SFHVURJKSA-N 346.540 5.144 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCc1cccs1 264508513 STZOTEBUIILFAC-AWEZNQCLSA-N 344.505 5.104 30 20 EKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 467610638 LVQITKFVGCZZDF-MAUKXSAKSA-N 349.434 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C[C@H](C)C1 475564972 VATQBBRXVJOGRP-SJORKVTESA-N 328.500 5.438 30 20 EKED Cc1ccc(OCc2nc3ccccc3n2CCCC(C)(C)C#N)cc1 476497148 WUWSCLCDFZYWPL-UHFFFAOYSA-N 347.462 5.254 30 20 EKED C=CC[C@H](C(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccccc1 477562372 VWBIQUBVSSIWAM-NRFANRHFSA-N 342.442 5.355 30 20 EKED C=CCC[C@H](C(=O)Nc1ccccc1OCC(F)F)c1ccccc1 489714225 YIORWJPTUNVCQF-INIZCTEOSA-N 345.389 5.019 30 20 EKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccc(C#N)cc2)c1 522755338 FXCCUPKGXSLGLN-HXUWFJFHSA-N 333.435 5.016 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N(CC1CCC1)[C@H](C)c1ccccc1 531320006 TZXAMUCQDILADE-QGZVFWFLSA-N 347.462 5.262 30 20 EKED C=C(C)COc1cccc(NC(=O)N(CC)Cc2ccccc2C)c1 589740348 SEEQGKNQRRVZJB-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C[C@H]1C[C@@H](NC2(c3ccc(C#N)cc3)CCC2)c2ccsc2S1 594514710 KYNPRACERDSDOL-SUMWQHHRSA-N 340.517 5.214 30 20 EKED N#CC1(CC(=O)Nc2ccc(CNc3ccccc3)cc2)CCCCC1 598690637 QSMGHRXZTYGZGN-UHFFFAOYSA-N 347.462 5.101 30 20 EKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 656688952 MPHGZGUFMOOORM-SNVBAGLBSA-N 345.302 5.530 30 20 EKED CC(C)c1nc(C#N)c(NN=C2CCC[C@@H]2c2ccc(Cl)cc2)o1 741461162 XGNRPZUGSRKQJP-CQSZACIVSA-N 342.830 5.059 30 20 EKED CCC[C@@H](CC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744766315 NLZGWWJTKRTZBH-UYAOXDASSA-N 335.451 5.042 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)s1 754689038 DQLYWNJMXRKKGR-XQRVVYSFSA-N 341.741 5.188 30 20 EKED C=CC[C@H](N[C@@H]1CCCc2c1sc1ccccc21)c1ccncc1 766023032 ZPXCXTMIESUXDA-RBUKOAKNSA-N 334.488 5.581 30 20 EKED CC(C)(C#N)CCCOC(=O)c1c(Cl)ccc(Cl)c1Cl 779798734 NNKRPBWPEHXPPP-UHFFFAOYSA-N 334.630 5.134 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CCC(C)C)c2ccoc2)c1 796815415 DMGAGIYVXHDZMH-FPOVZHCZSA-N 340.467 5.228 30 20 EKED C=CC[C@H](OC(=O)c1oc(C)nc1C)c1ccc(Cl)c(Cl)c1 797555519 XDHCLVGTRUUOFQ-AWEZNQCLSA-N 340.206 5.072 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2ccccc2Cl)o1 915988205 SBJNZMQHPJYMGE-VURMDHGXSA-N 329.808 5.261 30 20 EKED CCCCCCCC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1 936020025 FBDVEROQXQSNES-INIZCTEOSA-N 344.524 5.363 30 20 EKED C=CCc1ccccc1/C=C(\CCC(=O)O)c1nc2ccccc2s1 1776125031 VPSXRZUOIJQVJH-SAPNQHFASA-N 349.455 5.430 30 20 EKED Cc1nc(SCc2cc(C#N)ccc2F)n(C2CCCCC2)c1C 10870844 HBHPFLSRIPZCSV-UHFFFAOYSA-N 343.471 5.308 30 20 EKED O=C(/C=C\c1ccc(/C=C\C(=O)c2ccccc2)cc1)c1ccccc1 32224560 ISDFLLZGOWAGAF-IQRFGFHNSA-N 338.406 5.479 30 20 EKED CCOc1cc(C#N)ccc1OCc1csc(C2CCCCC2)n1 60804528 UUIPLBLJGURCPA-UHFFFAOYSA-N 342.464 5.040 30 20 EKED C[C@@H](Nc1cc(Cl)ccc1OC(F)(F)F)c1cccc(C#N)c1 328000379 NSJRFXNVRNXLII-SNVBAGLBSA-N 340.732 5.283 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)[nH]1 328797902 WESITVSBTPABHJ-BRWVUGGUSA-N 337.467 5.580 30 20 EKED CC(C)c1ccc2occ(/C(O)=N/[C@H]3CCOC4(CCCC4)C3)c2c1 329390629 RIYYKHZBXWQDIG-INIZCTEOSA-N 341.451 5.353 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340443161 FLNJWOBEIHTEHJ-UXHICEINSA-N 326.871 5.816 30 20 EKED N#CCCC[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccccc1 352192329 LSOZNLPKRQEOIA-IFMALSPDSA-N 346.474 5.048 30 20 EKED C[C@H](N[C@H](C)c1cncc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 367799522 GLCDURRJABVGET-JKSUJKDBSA-N 345.421 5.171 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 438649721 VUPWWHHQUBCHCT-UHFFFAOYSA-N 331.485 5.024 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 439446983 RDDXPFRLCUAIMJ-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCCC[C@H]1CC 476149449 NLYPBPGBKDUUSS-XLIONFOSSA-N 343.511 5.462 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(-c2ccccc2F)o1 541173918 SZJYHLKNXAGRLZ-UHFFFAOYSA-N 344.798 5.298 30 20 EKED N#CC1(c2cccc(-c3csc(C(F)(F)F)c3)c2)CCOCC1 598929363 BZWNCVYMDGQQTM-UHFFFAOYSA-N 337.366 5.006 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)CCCc2ccc(Cl)cc2)cc1 603757515 MKACPASBQAPPQU-UHFFFAOYSA-N 340.854 5.103 30 20 EKED Cc1ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c(F)c1 609986010 PKCIHOUHJIOQNC-UHFFFAOYSA-N 345.377 5.002 30 20 EKED CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 610140515 HWFRGFYNCFKKEI-LJQANCHMSA-N 341.499 5.310 30 20 EKED N#C[C@H](C(=O)CCCC1CCCCC1)c1nc2cc(F)ccc2s1 730422060 SNPACYOBEWPWAT-OAHLLOKOSA-N 344.455 5.362 30 20 EKED O=C(/C=C\c1cccc(OCC(F)(F)F)c1)c1ccccc1Cl 733081335 VMCYLWGAAKYPRE-HJWRWDBZSA-N 340.728 5.177 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C\C1CCCCC1 735440108 DFYVHKAJYBMQRW-SSCKCOOKSA-N 328.481 5.013 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc2ccccc2n1 756518015 ASLDQBOLMHMBTB-KANFNMMFSA-N 332.447 5.018 30 20 EKED CC(C)[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 792102491 FJOOMJXVVCTBQJ-MSOLQXFVSA-N 349.478 5.049 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)s1 915087219 RLQSIPKUFPKCRF-HXUWFJFHSA-N 346.455 5.273 30 20 EKED Cc1c(NN=C2CCC[C@@H]2c2ccc(Cl)cc2)cccc1C(=O)O 1776087121 JNDDZYGEBKGQOI-MRXNPFEDSA-N 342.826 5.082 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1coc2ccccc12 113053352 AMYQBGWHLPXRLW-ZDUSSCGKSA-N 336.416 5.079 30 20 EKED CSc1ccccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 171819236 XTYTWJFQPBWACF-CYBMUJFWSA-N 342.489 5.055 30 20 EKED Cc1cccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)C(C)(C)C)c1 237583551 OVSABUCBEDJQAN-DYESRHJHSA-N 336.479 5.163 30 20 EKED N#CCCC[C@H](NCc1cnc(-c2ccccc2)s1)c1ccccc1 353917910 VYWGDNSLOTUVIE-FQEVSTJZSA-N 347.487 5.335 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@]1(F)c1ccccc1 413745836 JQJXVNUGSQEVCS-KNQAVFIVSA-N 337.438 5.362 30 20 EKED CSc1ccc2ncnc(N[C@H](CCCC#N)c3ccccc3)c2c1 431498092 YHXDCVANCMIDBO-GOSISDBHSA-N 348.475 5.199 30 20 EKED C=CCCC[C@H](C)Sc1nnc(COc2ccc(Cl)cc2)o1 462362202 ALIFKZNTXUJWLK-LBPRGKRZSA-N 338.860 5.139 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 466435092 WHVYBEKLMJVDAG-GFCCVEGCSA-N 333.353 5.312 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(SC)c1C 469936796 VOFOZKVKOKQKIR-UHFFFAOYSA-N 340.492 5.327 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccccc1 476080277 OFRZEFDHEHUFCN-INIZCTEOSA-N 339.504 5.658 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 486667983 XCSJJSKCKIBUFZ-QGZVFWFLSA-N 347.418 5.067 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)CC(F)F 505035396 MIDFRGPFCMYJKU-UHFFFAOYSA-N 344.405 5.104 30 20 EKED N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nccc2ccccc12 518847530 QKSBMBHBWBUQHU-NRFANRHFSA-N 338.410 5.292 30 20 EKED C=CCC[C@H](NC1CCSCC1)c1ccc(C(F)(F)F)cc1 539051307 DYTIZVYTIZMGER-INIZCTEOSA-N 329.431 5.198 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccc([C@H]3CCOC3)cc2)CC1 573629249 DASKIBBEMXMUSK-BVVFMGSASA-N 346.474 5.007 30 20 EKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c(C)s1 603996415 OUPPGXXXNAVLEW-UHFFFAOYSA-N 344.505 5.209 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 604906953 GPILISZQTFCKTO-SJORKVTESA-N 338.451 5.221 30 20 EKED C=CCCCCCN(C)C(=O)c1occc1CSc1ccccc1 606816737 LEALACCISDJZIH-UHFFFAOYSA-N 343.492 5.390 30 20 EKED CCCC(=O)Nc1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1C 614056082 FXPBIINLPCFNMF-UHFFFAOYSA-N 349.478 5.147 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 619755320 XCQRBGUSCZASBR-NSHDSACASA-N 338.760 5.081 30 20 EKED Clc1cccc(C=NOCc2cc(-c3ccccc3)on2)c1Cl 727484734 UDDBNXBYFZQLFY-UHFFFAOYSA-N 347.201 5.199 30 20 EKED O=C1/C(=C\c2ccc(OC(F)F)c(Cl)c2)CCc2sccc21 731489549 HPMKPIBEYBIHGZ-YFHOEESVSA-N 340.778 5.215 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cc(Cl)sc1Cl 740764909 KGOGREFZYRMPAZ-AATRIKPKSA-N 334.227 5.499 30 20 EKED CC(=NOCc1csc(C2CCCC2)n1)c1cc2ccccc2o1 746353081 OSIDVRBKVOECFR-UHFFFAOYSA-N 340.448 5.488 30 20 EKED CC(/C=C\C(=O)c1sccc1Br)=C\c1ccccc1 750904196 GQDWZUNDRSMDMM-OFALOCIGSA-N 333.250 5.353 30 20 EKED CC(C)C[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 765590225 JXNOOZOEJHDXIE-WFASDCNBSA-N 346.883 5.322 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1ccc(O)c(Cl)c1 768753952 ABKFZBXGHZBKSR-HJWRWDBZSA-N 341.819 5.065 30 20 EKED CCCCCCN(C(=O)CC(C)(C)C#N)c1nc2ccccc2s1 781864006 NKOZNXZBRFTJMJ-UHFFFAOYSA-N 343.496 5.149 30 20 EKED COc1cc(C)c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1C 815635642 GXQROCLMYCBYHN-RXVVDRJESA-N 336.479 5.398 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1cccc(Br)c1 834675872 LTIOLOJSLVMIQE-GQCTYLIASA-N 327.630 5.060 30 20 EKED C[C@@H](Nc1ccc(F)cc1C(C)(F)F)c1ccc(OCC#N)cc1 866604505 XFHBWNTYEVWGNE-GFCCVEGCSA-N 334.341 5.013 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CCCC2)cc1Cl 46861727 OLVLFTRKYJBYTE-GOSISDBHSA-N 338.838 5.124 30 20 EKED COc1cc(C(=O)/C=C/c2ccc(SC)cc2)ccc1SC 60245382 HLEUFCMVTHRZJV-UXBLZVDNSA-N 330.474 5.035 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 90665315 RMNNZEQQVHNHPW-RHSMWYFYSA-N 327.497 5.271 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1noc2c1CCCCC2 189896908 CORCMJPNHIXRIW-UHFFFAOYSA-N 338.451 5.048 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)C[C@H](C)C#N 264064700 LSKHNSIXIPLBEF-CQSZACIVSA-N 345.512 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc([C@H](C)N)cc1 415582893 PYDKZBPWYGNYTC-HNNXBMFYSA-N 337.467 5.202 30 20 EKED CC(C)(C)[C@H]1CN(C(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc21 470303474 NNVRKUMLEIFTJW-IBGZPJMESA-N 344.458 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C[C@@H](C)C1 475564968 VATQBBRXVJOGRP-IAGOWNOFSA-N 328.500 5.438 30 20 EKED C(#Cc1ccccc1)CSc1nnc(-c2cccc3ccccc23)o1 478734570 VWDIDFSGYKNPSS-UHFFFAOYSA-N 342.423 5.034 30 20 EKED C=CCOc1ccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)cc1 518804023 ZQTBMPACQNPAHY-HSZRJFAPSA-N 347.433 5.270 30 20 EKED Cc1csc(NC(=O)Cc2cc3c(ccc4ccccc43)o2)c1C#N 564190274 LJGVRROAIJKXFY-UHFFFAOYSA-N 346.411 5.009 30 20 EKED CCCN(C(=O)CCCCCC#N)[C@H](C)c1cc2ccccc2o1 588305623 ZAVJGQOUSWHBLC-MRXNPFEDSA-N 326.440 5.206 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(Sc2ccccc2)cc1C 591501920 FGAHFKNALXPEOR-UHFFFAOYSA-N 340.492 5.576 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CCC(C)(C)C 609929967 QVJSNLGKEZZVRK-HUUCEWRRSA-N 347.528 5.275 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1cccc2ccccc12 750898995 BPJBCHXJNODOBC-YOQPPOADSA-N 329.355 5.200 30 20 EKED O=C(/C=C/c1cccnc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750911032 WXMMOOQKMOGYKF-ONEGZZNKSA-N 345.242 5.015 30 20 EKED CCCOc1ccc(NCc2ccc(O[C@H](C)C#N)cc2)cc1Cl 770490014 ZNGPOPJVQUWLJJ-CQSZACIVSA-N 344.842 5.032 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccc(C)cc2)C2CCC2)c1 779033767 ZNUYENODOIEVTM-FYYLOGMGSA-N 348.490 5.307 30 20 EKED N#CCCSc1ccccc1NC(=O)/C(F)=C/C1CCCCC1 798245850 QPCHFHLFSCHVNX-SQFISAMPSA-N 332.444 5.065 30 20 EKED CCCCCCCCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 915104077 JTDQTVJNBVSBGI-AWEZNQCLSA-N 347.409 5.358 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CCCCC3)n2)cc1 916650303 BSEDVKUHHLGJDA-KRWDZBQOSA-N 338.476 5.265 30 20 EKED Cc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c(C)c1 1776133375 VIHDYZDMJHTOPF-QPJJXVBHSA-N 336.412 5.112 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1 1776697229 BIUVXIAZZNKXJG-YLSINNKHSA-N 342.822 5.448 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(F)ccc2o1 189894788 KVYBXKJGVOCXDB-UHFFFAOYSA-N 337.394 5.676 30 20 EKED O/C(CC/C(O)=N\C1CCCC1)=N\[C@@H]1CC[C@H](c2ccc(F)cc2)C1 329940099 UFKIRICDSKDEAA-MAUKXSAKSA-N 346.446 5.098 30 20 EKED N#Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)c(Cl)c1 430366088 HBIDJMZYKPDJDO-ZWKOTPCHSA-N 346.817 5.107 30 20 EKED C[C@H](S[C@H](C)c1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 443142522 PPVHQDISROMLLX-LSDHHAIUSA-N 334.444 5.769 30 20 EKED CC(C)CN(CCCCC(C)(C)C#N)[C@@H]1CCCc2cccnc21 444683536 HIVBQCJJCBWJSE-LJQANCHMSA-N 327.516 5.137 30 20 EKED C=CC[C@H]1N(C(=O)Nc2ccccc2CSC)CCCC1(C)C 445120325 URTHXKQILPKQPC-QGZVFWFLSA-N 332.513 5.148 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(SCc2ccc(C#N)c(C)c2)o1 447287001 LUIJCHDEPXWNIU-SFHVURJKSA-N 349.459 5.084 30 20 EKED C=C(C)[C@H](N[C@@H](CC)c1ccc(C#N)cc1)c1ccc(F)c(F)c1 447593446 SAPGDSAKUYFXIG-PMACEKPBSA-N 326.390 5.195 30 20 EKED N#CCCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 458809263 AGAVQXVNCYCLPG-HKBOAZHASA-N 345.446 5.023 30 20 EKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477488996 YOBWZXTYTNTHHG-UHFFFAOYSA-N 349.478 5.178 30 20 EKED COc1ccc(Cl)c(CNc2ccccc2S[C@H](C)CC#N)c1 479481594 QNLJCIQNNKMRGU-CYBMUJFWSA-N 346.883 5.355 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1 487182698 CHWKGBCBPBRBQP-KCLUMXDGSA-N 338.495 5.144 30 20 EKED Cc1ccc(Oc2ccccc2)c(NC(=O)c2ccc(CC#N)cc2)c1 534723818 UDFJEPAYTJYFSZ-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C[C@H](Nc1ccc(CN2CCCC[C@@H]2C)cc1)c1ccc(C#N)cc1 540700885 NUNKQPXSJZFPHL-ROUUACIJSA-N 333.479 5.106 30 20 EKED CCc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 550826414 DZNXLEVCDJCRMW-DYESRHJHSA-N 346.474 6.081 30 20 EKED C=CCOc1cccc(CNc2ccc(Oc3cccnc3)cc2)c1 558128091 AHGCMFLVWLBXFG-UHFFFAOYSA-N 332.403 5.051 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccccc1 580175142 LFTUTJDNRWICRR-NHCUHLMSSA-N 338.882 5.742 30 20 EKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1 609825589 HBIRADOALWVQFQ-STQMWFEESA-N 344.867 5.033 30 20 EKED Cc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1C 740010775 IDAYFLPXMUWKAD-UHFFFAOYSA-N 332.472 5.193 30 20 EKED COCc1ccc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cc1 741847376 FVKCAPIAJUBOMM-VURMDHGXSA-N 326.779 5.129 30 20 EKED C=CC[C@@H](N[C@H](CC)c1cc(Cl)ccc1OC)c1ccncc1 766021825 UVVLNHKGDLUTTI-QZTJIDSGSA-N 330.859 5.102 30 20 EKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccccc1Cl 915980933 DLEQXKNCDOHCCF-JXMROGBWSA-N 349.817 5.210 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NC[C@H]1CCC(F)(F)C1 926343932 HWIQWPRKEVQZBV-VIFPVBQESA-N 341.286 5.065 30 20 EKED CC1(C)C(=NNc2ccc(Cl)c(C(=O)O)c2)C[C@@H]1c1ccccc1 1776033695 SRVJDVLYEXGAQN-OAHLLOKOSA-N 342.826 5.020 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C2CCC2)cc1 1776784323 VTUXLMBQGKBQHD-FQEVSTJZSA-N 331.500 5.248 30 20 EKED N#Cc1ccc(OCc2coc(-c3ccc(Cl)cc3)n2)c(Cl)c1 25801294 QUPGUIVKFCGONL-UHFFFAOYSA-N 345.185 5.099 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](CC)c2c(C)noc2C)cc1 90886208 VTYFCMTXSSYSBJ-SCLBCKFNSA-N 348.874 5.225 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cnn(C(C)(C)C)c1C)c1ccc(F)c(F)c1 191507798 DSSNSNVHCFJYCL-BFUOFWGJSA-N 347.453 5.193 30 20 EKED N#Cc1csc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)c1 237787847 NNXMTVAOIVYNDR-SFHVURJKSA-N 330.884 5.294 30 20 EKED CC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(OC)cc1 360822284 PPRAOJZHXQZAKG-FCHUYYIVSA-N 334.463 5.075 30 20 EKED C=CC[C@H](C(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccccc1 427529442 WIFXGZFFDRFGNZ-QAPCUYQASA-N 337.467 5.030 30 20 EKED Cc1cccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 437492490 CKERADNOFPWFED-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CC(=O)c1ccc2cc(Oc3nc(C)c(C#N)cc3Cl)ccc2c1 461946442 GWGRTXHCLDKANE-UHFFFAOYSA-N 336.778 5.063 30 20 EKED CC(C)[C@H]1C[C@@H](NC(=O)C[C@H](CC#N)c2ccccc2)c2ccccc21 477125797 IXZOSZDRQCDLJF-VLCRHTCISA-N 346.474 5.075 30 20 EKED C=C[C@@H](CC(=O)Nc1cnn(C(CC)CC)c1CC)c1ccccc1 482686181 GKVWZPQVKFHQMC-INIZCTEOSA-N 339.483 5.105 30 20 EKED Cc1ccc(CCCCC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487504867 SQTLVWPOSJOODC-QFIPXVFZSA-N 348.490 5.259 30 20 EKED CC[C@H](C)[C@H](NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499604511 DPMMVQAFYCNPDV-LPHOPBHVSA-N 348.918 5.117 30 20 EKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1F 512664952 CHJXOLWIDQLDKS-PXAZEXFGSA-N 336.332 5.042 30 20 EKED CCN(C(=O)c1cc2ccccc2s1)c1ccc(C#N)c(Cl)c1 533673904 MZTQVILMGAUYDM-UHFFFAOYSA-N 340.835 5.093 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 534693761 ZDPKTNLKRIDYQK-KRWDZBQOSA-N 344.414 5.172 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccccc1C#N 542522937 OKIDTHQRZFEUSP-FQEVSTJZSA-N 332.472 5.002 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(F)c1Cl 552460712 PKMREHSMPAJEQX-GFCCVEGCSA-N 334.847 5.485 30 20 EKED Cc1ccc(-c2ccc(CN[C@H](CCCC#N)c3ccccc3)o2)cc1 562855082 DCAJCOJCBTWTAR-JOCHJYFZSA-N 344.458 5.780 30 20 EKED C[C@H]1CCN(C(=O)CCCCCC#N)c2cc(Cl)ccc2S1 588887627 MBVDTOYFAAFDPU-ZDUSSCGKSA-N 336.888 5.031 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)[C@H](C)CC#N)c(C(F)(F)F)c1 598807092 DEKUDGHICNNDNE-MNOVXSKESA-N 344.402 5.084 30 20 EKED N#Cc1nnc2ccccc2c1Oc1ccc2oc3ccccc3c2c1 610128524 VZSZXFBGOBPZSC-UHFFFAOYSA-N 337.338 5.193 30 20 EKED CCc1ccc(-c2nc(CN[C@@H](C)c3cccc(C#N)c3)cs2)cc1 611386702 RYSJSIMRNHWQIT-HNNXBMFYSA-N 347.487 5.095 30 20 EKED CCCN(Cc1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2cccnc21 614215631 OFYUBDCKXUDIOQ-NRFANRHFSA-N 347.506 5.172 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1cc(-c2ccccc2)cs1 618741621 HRUILZWRWDCZME-NRFANRHFSA-N 330.456 5.064 30 20 EKED C#Cc1cccc(NC(=S)N(CCCC)[C@H](C)c2ccccc2)c1 726484097 CLVDKNIUASCFAB-QGZVFWFLSA-N 336.504 5.228 30 20 EKED C[C@H](CC#N)Sc1ccccc1N=Cc1cc(Cl)ccc1O 731320235 XHMQVRAAZBUAGF-GFCCVEGCSA-N 330.840 5.190 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)Cc2cc(Cl)ccc21 742436344 APJHCTFHAJYIOX-GHXNOFRVSA-N 343.860 5.347 30 20 EKED CCC[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 764563264 XMHCVZGFMSQKDV-STQMWFEESA-N 334.872 5.198 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1cccc(C(F)(F)F)c1 772800740 AWVLMUDOLOTSHK-CMDGGOBGSA-N 327.305 5.150 30 20 EKED CC(=NOCc1c(C)noc1C)c1ccc(-c2ccc(F)cc2)s1 917403122 QCPJFYLELSGLTN-UHFFFAOYSA-N 344.411 5.100 30 20 EKED Cc1ccccc1[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 932392992 SSKCRCLJNNIOMF-HZPDHXFCSA-N 338.476 5.132 30 20 EKED O=C(O)c1cc(/C=C\C(=O)c2cccc3ccccc23)sc1Cl 1776114152 HMOHSBWWMBIUNB-HJWRWDBZSA-N 342.803 5.149 30 20 EKED CC(C)[C@H](NCc1cc(C#N)cs1)c1ccc(C(F)(F)F)cc1 130359232 FRNUYSWMVSUMHN-INIZCTEOSA-N 338.398 5.125 30 20 EKED C=CCCc1ccccc1NC(=O)C1CCC(C(F)(F)F)CC1 410348643 ZKYWFZOELZQQEQ-UHFFFAOYSA-N 325.374 5.112 30 20 EKED C[C@H](c1ccc(CSCc2nc(C#N)cs2)cc1)C(F)(F)F 419518684 OAHBTYZPSWZQHT-SNVBAGLBSA-N 342.411 5.114 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1c(C)n[nH]c1C 522051757 OHYLKIBQDKSXNG-AWEZNQCLSA-N 339.483 5.011 30 20 EKED C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)c(F)c1 540711024 RXOVQOHFIYWRIG-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc2ncccc2c1 546729182 MGAIEAFQWKJHFY-OAHLLOKOSA-N 333.460 5.241 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1cccc(OCc2ccccc2)c1 562045165 VNMSVUZEFWMTHN-GOSISDBHSA-N 336.479 5.246 30 20 EKED C[C@H](NCc1ccc2sccc2c1)c1ccc(C#N)cc1Cl 584082830 LZJAMJDMROACDE-LBPRGKRZSA-N 326.852 5.277 30 20 EKED Cc1cccc(COc2ccc([C@@H](C)Nc3ncccc3C#N)cc2)c1 609040323 WGFCAZQCGFUMGM-QGZVFWFLSA-N 343.430 5.014 30 20 EKED C[C@H](SCc1sccc1Br)c1ccc(C#N)cc1 609825815 VBUMTAFIVWILLV-JTQLQIEISA-N 338.295 5.377 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)cc1 727264763 ZYXVFUPAGHMSEA-YWEYNIOJSA-N 335.712 5.127 30 20 EKED COc1cccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)c1 732713582 HTMKDGFBSGROEC-CSKARUKUSA-N 345.398 5.087 30 20 EKED N#Cc1ccc(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 749783243 GQNBGEFUFPCYIR-UHFFFAOYSA-N 340.386 5.155 30 20 EKED CC(=NNc1cncc(Cl)n1)c1ccc(SC2CCCC2)cc1 914695095 DZPKSMWALRQVEE-UHFFFAOYSA-N 346.887 5.001 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C)c(C2CC2)c1 1776783972 BWHAJTZEYJBHBD-IBGZPJMESA-N 331.500 5.166 30 20 EKED N#C[C@@H](C(=O)C1CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 46443492 JVUUMVYJFZIOGH-HNNXBMFYSA-N 344.867 5.220 30 20 EKED N#Cc1ccnc(SC(c2ccc(F)cc2)c2ccc(F)cc2)c1 71918305 OTHHRVNCJZXPIN-UHFFFAOYSA-N 338.382 5.113 30 20 EKED COc1ccc2cc([C@H](C)N[C@@H](CCC#N)c3ccccc3)ccc2c1 90665693 YKRUXWGNILMACI-SBUREZEXSA-N 344.458 5.544 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1c(C)noc1CC 191464602 ZUSXVOKZCPWDBE-UHFFFAOYSA-N 327.428 5.041 30 20 EKED Cc1ccc([C@@H](NCc2cccc(C#N)c2)c2ccccc2)c(C)c1 327358953 HKLLWCRAOBZSQD-QHCPKHFHSA-N 326.443 5.054 30 20 EKED C[C@@H]1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)c2ccccc21 356760955 GJSWZEPWTSSDAJ-MJGOQNOKSA-N 332.447 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn([C@@H](C)CC)c1C 359847954 GPWGFCKOJVYBHO-HNNXBMFYSA-N 339.483 5.267 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCC(C)(C)C1 432073114 BLONMWUOYGLJML-HUUCEWRRSA-N 345.512 5.123 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)N[C@@H](CCC#N)c1ccccc1 438836175 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336.479 5.745 30 20 EKED C=CCOc1cccc(CN[C@@H](C)c2cccc(Cl)c2Cl)c1 605166465 RNIZQOAOCYMHHF-ZDUSSCGKSA-N 336.262 5.409 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCC[C@@H](C)C1 609438550 JZFSYVFDIIOTII-PMPSAXMXSA-N 345.512 5.029 30 20 EKED C[C@@H](SCc1csc(-c2ccoc2)n1)c1ccc(C#N)cc1 609825781 TUPGJVYEOIVOTL-GFCCVEGCSA-N 326.446 5.269 30 20 EKED CC[C@@H](NCc1ccc(C#N)cc1F)c1ccc2cc(OC)ccc2c1 610812791 RJXUSDCKZGUBSA-JOCHJYFZSA-N 348.421 5.100 30 20 EKED C#CCCOc1ccc(CN[C@H](CC)c2ccc(Cl)s2)cc1 734003679 SNYDKSUBLOHYAM-MRXNPFEDSA-N 333.884 5.045 30 20 EKED C=CC[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccncc1 734680473 SYUGRSXOHOLZHL-NRFANRHFSA-N 343.430 5.188 30 20 EKED N#Cc1ccc(Cl)cc1N1CCC(c2cc3ccccc3[nH]2)CC1 736285863 AYSWKRWCNOFLAX-UHFFFAOYSA-N 335.838 5.077 30 20 EKED O=C(/C=C\c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccsc1 749105832 YSUGZOGCNMXINL-SREVYHEPSA-N 349.242 5.137 30 20 EKED O=C(/C=C\c1cncc2ccccc12)c1ccc(SC(F)F)cc1 772807014 OSSJHPLIGLZSLO-YFHOEESVSA-N 341.382 5.446 30 20 EKED 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CC(C)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@H](C)c1ccsc1 421694160 UJPFASSSLZMHNW-AEFFLSMTSA-N 340.492 5.134 30 20 EKED C=CCOCCCC(=O)Nc1ccc(Sc2ccccc2)cc1C 463150954 NSSORDUYRJOWOS-UHFFFAOYSA-N 341.476 5.068 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 466837085 JGVAEKVWOAVYKT-BLLLJJGKSA-N 326.267 5.259 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(Cl)cc1F 471134734 YSICWJKSVJBGRM-UHFFFAOYSA-N 332.806 5.089 30 20 EKED C=C(C)CN(C)[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 481289629 VBJVBMJVUAOLNL-LLVKDONJSA-N 325.239 5.217 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(C)(C)C)cc1 520479057 GXXZGWDKHCTBAW-UHFFFAOYSA-N 349.478 5.298 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(CSC)c1 547620824 GJUXKXDXOCWDPH-UHFFFAOYSA-N 329.490 5.080 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cncs1)c1ccc(C(F)(F)F)cc1 557274815 ZIWRYSPWQHVJJQ-WFASDCNBSA-N 340.414 5.520 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)C1CCCCC1 609378150 SLMCKQPUJIVINK-HZPDHXFCSA-N 344.524 5.483 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)CS[C@@H](C)c1ccc(C#N)cc1 609825566 FWPSBUYHJRQGRC-AWEZNQCLSA-N 334.444 5.025 30 20 EKED Cc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c(Cl)c1 611093311 XSIMGRFXMJYZLO-UHFFFAOYSA-N 339.609 5.079 30 20 EKED CCc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1CC 611407626 ZWTXIONUYFZRHF-UHFFFAOYSA-N 347.245 5.242 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 611465507 WDGOGRIHKGACQD-VXGBXAGGSA-N 336.332 5.128 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC)c1ccc(Cl)cc1 612299127 HZHSQMJQFXMTQB-QGZVFWFLSA-N 348.899 5.250 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C2CC2)[nH]c1C1CC1 626633828 MBHTWRVEHXUZIN-UHFFFAOYSA-N 348.490 5.874 30 20 EKED C=C[C@H](CC(=O)N1CC2(CC=CC2)[C@@H]1c1ccccc1)c1ccccc1 649154762 UMDFZTGAGBNVEB-XXBNENTESA-N 343.470 5.266 30 20 EKED CCCCCCCCCC(=O)N1CC[C@H](c2ccccc2OC)C1 737745131 GZRZIZQVICIBCZ-SFHVURJKSA-N 331.500 5.152 30 20 EKED C=CC[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccncc1 766022499 WJMXBQPARISACH-IAGOWNOFSA-N 330.884 5.179 30 20 EKED C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)c(F)c1 777588039 DEWXILIZMLVULC-LBPRGKRZSA-N 336.332 5.365 30 20 EKED Clc1cccc(Cl)c1NN=Cc1conc1Cc1ccccc1 814872378 VLWDLJBPRKIFSE-UHFFFAOYSA-N 346.217 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCOC2(CCCC2)C1 907676881 MNPONCQFQMODOO-SFHVURJKSA-N 341.495 5.216 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(Cl)s1 189912449 PJMZBQXOXSWWGC-ZDUSSCGKSA-N 347.911 5.996 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 195656655 AJUWKVARFSIERM-AWEZNQCLSA-N 348.368 5.561 30 20 EKED C=CCOc1ccc(/C=C(/Cl)c2nc3ccccc3o2)cc1OC 213717441 CMGIZMAWKITJJF-SDNWHVSQSA-N 341.794 5.138 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1ccc(Oc2ccccc2)cc1 237560976 PLNNCUMFACEVJY-HNNXBMFYSA-N 334.444 5.263 30 20 EKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccc(C#N)cc2Cl)c1 426122404 IDPOXLAYQUHYBX-CQSZACIVSA-N 341.842 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCC(C)(C)C1 432581285 WOAAWYLUTOAFAD-QGZVFWFLSA-N 328.500 5.581 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1cc(F)c(Cl)cc1Cl 442867232 KWABJVZTNCKCMZ-UNXYVOJBSA-N 329.246 5.113 30 20 EKED CCc1ccc([C@H](C)CC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487176308 LHPXIDTXNDRNPM-XMSQKQJNSA-N 348.490 5.294 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(-c2cccnc2)cc1 512614416 VQPBEEZQMLACPC-HOTGVXAUSA-N 345.421 5.171 30 20 EKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(Cl)c1 540347509 WZHGMTDVAKISBJ-IBGZPJMESA-N 326.871 5.382 30 20 EKED C=CCCCCCN(C)[C@H](C)c1nnc(-c2ccccc2F)s1 582619629 QUMPWWSMWMBDRN-CQSZACIVSA-N 333.476 5.083 30 20 EKED N#Cc1c(Cl)cccc1NCc1ccnc(Oc2ccccc2)c1 603859857 ASLLHOUKLWVFLO-UHFFFAOYSA-N 335.794 5.011 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(OCc2ccccc2)cc1 728695948 ISTIWCBIFSPOQQ-RAXLEYEMSA-N 349.817 5.210 30 20 EKED Cc1ccc(C(=O)/C=C/c2c(-c3ccccc3)nn(C)c2Cl)s1 734752550 GHELTZBQJXVMIX-MDZDMXLPSA-N 342.851 5.007 30 20 EKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccsc2)cc1OC 749101548 HGWDUAOOSNCUAD-PLNGDYQASA-N 336.840 5.095 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC(C)C)c2ccccc2)c1 749129386 QRAAZEQZXVWHMA-UNMCSNQZSA-N 336.479 5.245 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(Cl)c1 750683401 SVCUQPJBVFDSRO-RMHQSFGDSA-N 346.817 5.168 30 20 EKED CCC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCC1 752635331 FLQDSUSXPJXDIF-HXUWFJFHSA-N 347.462 5.044 30 20 EKED C[C@@H](Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1Cl 760214844 AAILLZOIHBHKHK-SNVBAGLBSA-N 339.197 5.208 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(N2CCCCCC2)cc1 766348819 BPTVLGNONKJKSV-RTBURBONSA-N 347.506 5.350 30 20 EKED O=C(/C=C\c1cc(F)c(F)cc1F)c1cccc(-c2ccncc2)c1 767728285 DKXIFTBCWKBGFM-PLNGDYQASA-N 339.316 5.062 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccncc2CC)cc1 774475872 HLJNYGUKRLGCMQ-HZPDHXFCSA-N 344.886 5.187 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCCC[C@H]1c1noc(C)n1 775490086 VISIYRUVALONET-WMZOPIPTSA-N 349.519 5.208 30 20 EKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccccc1-c1ccccc1 781070645 OELHTJKLNAQNHI-FQEVSTJZSA-N 338.451 5.263 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2cccc(-c3cccnc3)c2)c(Cl)c1 788360291 HYNZAYMLPKBRJX-VQHVLOKHSA-N 344.801 5.170 30 20 EKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1Cl 795984464 YHCQUEICGBSNPU-ZBFHGGJFSA-N 327.811 5.032 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CCc2ccc(C(F)F)cc2)n1 870224772 KMXBBDCVLAKDEG-CQSZACIVSA-N 348.418 5.013 30 20 EKED O=C(Nc1cccc(C=NNc2ccccc2)c1)c1ccccc1Cl 916245873 HRPPXDHEVZFXTB-UHFFFAOYSA-N 349.821 5.038 30 20 EKED CCSc1ccc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 180541610 SDCDLJXFVPSIGH-CVEARBPZSA-N 340.492 5.113 30 20 EKED CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 185223442 XLUHYFYPDSIJBU-HZPDHXFCSA-N 345.512 5.267 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc2c(c1)CCC2 189897110 RKHYXXWQNSDMLJ-UHFFFAOYSA-N 349.474 5.045 30 20 EKED C[C@@H]1C(=O)CC[C@H](C(O)=Nc2ccc3ccc(Cl)cc3n2)C1(C)C 328657327 OTRMKTFIEMCDOC-BXUZGUMPSA-N 344.842 5.118 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(C3CCC3)cc2)s1 430592803 HYNWOJMEQZFXSG-INIZCTEOSA-N 338.476 5.198 30 20 EKED Cc1cc2nnc(SCCCCC(C)(C)C#N)n2c2ccccc12 436138752 CEFDZJVEULVWJE-UHFFFAOYSA-N 338.480 5.003 30 20 EKED C=C(C)[C@H](NC(=O)Nc1ccsc1Cl)c1ccc(F)c(F)c1 446570147 WYWQTCCZMZDKJM-ZDUSSCGKSA-N 342.798 5.119 30 20 EKED CC(C)CC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 465248184 BAFQEJWHQDZAKM-OAHLLOKOSA-N 345.512 5.029 30 20 EKED C=CC[C@@H]1N(C(=O)CCCCC(=O)c2ccccc2)CCCC1(C)C 470298337 PVQXRJHPVRQKMI-FQEVSTJZSA-N 341.495 5.023 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)CC(F)(F)F 475555405 LTNCOUNLMAPFFX-CQSZACIVSA-N 342.405 5.391 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c2ncccc12 485744513 VLFSRTHPLWIUKQ-UHFFFAOYSA-N 334.444 5.074 30 20 EKED CC(C)Sc1ccc([C@@H](C)Nc2ncc(C#N)cc2Cl)cc1 505575648 BUFQWSJIAYJDTR-GFCCVEGCSA-N 331.872 5.280 30 20 EKED CC(C)(C#N)CCCN[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 537108255 LAWURERBGQVWHD-FQEVSTJZSA-N 342.433 5.168 30 20 EKED CCCCOc1ccc([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 585765166 VSLSREGUSKSECR-ZHRRBRCNSA-N 334.463 5.075 30 20 EKED Cc1oc(-c2cccs2)nc1CSc1ccc(C#N)cc1F 610165805 UTJWVDXVZSIDCW-UHFFFAOYSA-N 330.409 5.015 30 20 EKED C[C@H](NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 610356810 APPPDTUPTJJRQY-JXFKEZNVSA-N 349.478 5.096 30 20 EKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 613290340 CYMWJGHDUBVIPP-OAQYLSRUSA-N 348.405 5.392 30 20 EKED C#Cc1cccc(NC(=S)N(CC)[C@@H](C)c2cc3ccccc3o2)c1 726475876 SNYSMZUUDLTTBE-HNNXBMFYSA-N 348.471 5.194 30 20 EKED Cc1ccc(F)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 727086743 SPYKQIHCUKQALI-FQEVSTJZSA-N 344.389 5.042 30 20 EKED C[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)CC(C)(C)C1 727629220 PJDXFBJQMLEPNA-RYRKJORJSA-N 334.463 5.264 30 20 EKED C[C@@H](CC#N)OC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 733709771 NNPURLNTNTZQMM-LURJTMIESA-N 348.638 5.320 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1cccc(-c2ccncc2)c1 741469009 ITUWENWGPSSPEH-CMDGGOBGSA-N 336.394 5.193 30 20 EKED CC(=NOCc1nc(C)c(C)o1)c1ccc(-c2ccc(F)cc2)s1 749674138 IYGGQZGOGHGOAE-UHFFFAOYSA-N 344.411 5.100 30 20 EKED Oc1ccc2ccccc2c1/C=N/[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 753996986 ZNOCLJUFCKMQMM-SEXXXUADSA-N 349.405 5.024 30 20 EKED Cc1ncsc1/C=C1\CCc2c(Cl)sc(Cl)c2C1=O 760265006 PMHSDDHBDMGUCW-QPJJXVBHSA-N 330.261 5.032 30 20 EKED CCOc1c(Cl)cc(N[C@H](C)c2cccc(C#N)c2)cc1Cl 864008926 JPZMEMHHTIODPT-LLVKDONJSA-N 335.234 5.437 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)o1 912859488 YADAZTCUSBTRDN-VURMDHGXSA-N 339.372 5.121 30 20 EKED CC(=NNc1ccnc2cc(Cl)ccc12)c1c(F)cccc1F 916269309 FVBNKBJQHKRUMG-UHFFFAOYSA-N 331.753 5.003 30 20 EKED C=CCN(C(=O)Nc1ccc(Oc2cccc(F)c2)cc1)C(C)C 918051345 WNIXZYUUDHPVNO-UHFFFAOYSA-N 328.387 5.046 30 20 EKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2ccc(C(C)(C)C)cc2)CC1 1776167916 AYGLFJLUIVOKMJ-KRWDZBQOSA-N 343.511 5.178 30 20 EKED C=C(C)CN(CC)C(=S)Nc1ccc(Oc2ccccc2)cc1 16187978 JHYPTKZLLLYCNY-UHFFFAOYSA-N 326.465 5.074 30 20 EKED CC(C)c1noc([C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 60127432 NWFIOHGKPGOFKA-AWEZNQCLSA-N 348.406 5.030 30 20 EKED CCN(C(=O)Nc1ccccc1C(C)C)[C@@H](C)c1ccc(C#N)cc1 118789611 DJSXIPGXBQGTED-INIZCTEOSA-N 335.451 5.297 30 20 EKED Cc1cc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)o1 176171014 STKZYBRZDKETJD-UHFFFAOYSA-N 346.386 5.121 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@@H](CCC#N)c1ccccc1 191037839 SEJHNNBZLQEMRP-SFHVURJKSA-N 332.369 5.149 30 20 EKED CCCc1ccccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 329967470 SOFJXPTXUXBTNP-UHFFFAOYSA-N 328.456 5.152 30 20 EKED CC(C)(C#N)CCCCN1CCCC[C@H]1c1nc2ccccc2o1 375401439 DOMFCGWPYVRNJT-KRWDZBQOSA-N 325.456 5.075 30 20 EKED CCOc1cccc2cc([C@@H](C)NCCCCC(C)(C)C#N)oc12 444685841 PZTRJBWCAVPOJI-OAHLLOKOSA-N 328.456 5.202 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H]2CCCC[C@H]21 475548569 CFNGITMPNSUQKO-PWIZWCRZSA-N 340.511 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccc(C)cc1 476168170 WLMBMDIDGMSGKB-GOSISDBHSA-N 335.491 5.664 30 20 EKED COc1cc(Cl)ccc1CNc1ccccc1S[C@H](C)CC#N 480150258 YQNHNXGMAJEFHN-CYBMUJFWSA-N 346.883 5.355 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1C(C)(C)C 484975482 VWNHMIHSGNISOJ-UHFFFAOYSA-N 328.500 5.584 30 20 EKED C=CCCc1ccccc1NC(=O)CCC(=O)c1ccc(Cl)cc1 504272883 XXFJRVFSZBCQOT-UHFFFAOYSA-N 341.838 5.060 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512624974 LCAJRYXHTUMTRB-GJZGRUSLSA-N 342.483 5.610 30 20 EKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)(C)C 521812580 YXZPOXYAYKQFLY-BBRMVZONSA-N 333.501 5.027 30 20 EKED N#CCC[C@@H](N[C@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593606416 FHLNWGHLRPQCOA-SJORKVTESA-N 328.818 5.101 30 20 EKED C=CCCCCCN(C)C(=O)N[C@H](CC)c1ccc(Cl)s1 606979999 RHDDJKFHFOIBIT-CYBMUJFWSA-N 328.909 5.240 30 20 EKED C=CCOc1ccccc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741472086 FDDCCRCPJBSOIU-ZHACJKMWSA-N 341.410 5.210 30 20 EKED C=CC[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccncc1 766022495 WJMXBQPARISACH-DLBZAZTESA-N 330.884 5.179 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1cccc(-c2ccccc2)c1 773030862 WHCRDNVOLQXBLP-INIZCTEOSA-N 330.406 5.215 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(C)cc1 792092553 CXJIBRVYXYPLNL-LAUBAEHRSA-N 342.442 5.303 30 20 EKED CC(/C=C\C(=O)c1ccc(Cl)nc1)=C\c1ccccc1OC(F)F 811692432 FTEJOVHTRQZXPF-DEOFSOSHSA-N 349.764 5.179 30 20 EKED C=CCN(Cc1ccccc1)C(=S)Nc1ccc(CCCC)cc1 914601814 VFYDEXMAHICWJG-UHFFFAOYSA-N 338.520 5.414 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1csc2ccccc12 1776034511 KCLWENZCPCYTRK-UHFFFAOYSA-N 344.823 5.089 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1csc2ccccc12 1776784446 OHZKZLXXUALPSC-MRXNPFEDSA-N 333.497 5.195 30 20 EKED COc1cccc(/C=C/C(=O)c2cc3ccccc3o2)c1OC(C)C 7745024 MZMUJRGXGJACBM-VAWYXSNFSA-N 336.387 5.125 30 20 EKED C=C[C@@H](CC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 126342851 MIFPRJBHRCDNHV-HNNXBMFYSA-N 347.380 5.480 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1OC 189893935 GRQNUQZXSMIKHY-UHFFFAOYSA-N 343.854 5.453 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 195656653 AJUWKVARFSIERM-CQSZACIVSA-N 348.368 5.561 30 20 EKED CC(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1 329944510 FHTXUAOYQQGCSY-ACBHZAAOSA-N 342.483 5.266 30 20 EKED N#CCCC[C@H](N[C@@H]1CCC[C@H](c2cccnc2)C1)c1ccccc1 340440787 CTGYCODLRZWUAS-NNWRFLSQSA-N 333.479 5.133 30 20 EKED Cc1cc(C)cc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431925659 KYUOXAYPFMEUKO-RXVVDRJESA-N 349.478 5.099 30 20 EKED Cc1oc(-c2ccsc2)nc1CS[C@H](C)c1cccc(C#N)c1 443147352 RHCCKHJIESPGJI-CYBMUJFWSA-N 340.473 5.578 30 20 EKED CC[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 447534449 XJMICEZNNMMZKU-FZKQIMNGSA-N 332.369 5.379 30 20 EKED N#CCSCCCSc1ccc(Cl)c(C(F)(F)F)c1 466626598 QDYMLZUNVOHFIO-UHFFFAOYSA-N 325.808 5.098 30 20 EKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(Cl)cc1C#N 480585867 XKPKXNUQZOXFOO-GFCCVEGCSA-N 341.867 5.014 30 20 EKED CCN(Cc1ccccc1C(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 497619311 RUVNMJCQHPQXHU-AWEZNQCLSA-N 332.369 5.160 30 20 EKED CCN(Cc1cccc(-c2cccnc2)c1)[C@@H](C)c1ccc(C#N)cc1 508603766 KVSXUPXLWCQFSD-SFHVURJKSA-N 341.458 5.203 30 20 EKED CCN(C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 510423828 HTHIGAORSUYRMA-GFCCVEGCSA-N 347.245 5.022 30 20 EKED C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 535654422 FFLGMJCHLIBPAR-HOTGVXAUSA-N 349.434 5.003 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCCC(C)(C)C#N 544486446 HMMHLFRQUQUOFX-GFCCVEGCSA-N 347.915 5.362 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(-c2ccncc2)c(C)c1)c1ccccc1 553241897 AIUMUCDLJIPXNX-JOCHJYFZSA-N 342.442 5.355 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccsc4)cc3)CC2)c1 560171078 FQIOFOJMDAUEDZ-UHFFFAOYSA-N 330.456 5.066 30 20 EKED C[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1Cl 584201802 LVCGMYFBVIASKX-LKFCYVNXSA-N 337.275 5.265 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 620567950 ZADWVMSUTPEEHE-AWEZNQCLSA-N 345.826 5.052 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 739144423 XMRXUCJMPYWXPZ-OXQOHEQNSA-N 342.442 5.167 30 20 EKED COc1ccc(/C=C2/C(=O)c3ccsc3S[C@H]2C)cc1Cl 742436962 PCRSSOQJEJNCNX-SZUMLMDFSA-N 336.865 5.171 30 20 EKED COCCCOc1cccc(/C=C\C(=O)c2ccc3ccccc3c2)c1 746340834 TYHALHNHNXYEAJ-RAXLEYEMSA-N 346.426 5.151 30 20 EKED CCOc1cc(/C=C\C(=O)c2oc3ccccc3c2C)ccc1OC 747137809 ABTPVZHGEWZGDX-LUAWRHEFSA-N 336.387 5.045 30 20 EKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1cccc2ccccc12 753136302 VAUMYDOKKAFDMX-VAWYXSNFSA-N 342.423 5.254 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3csc(-c4ccccn4)n3)oc2c1 754826730 WTAZJKUXHUEHPE-BQYQJAHWSA-N 346.411 5.156 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2C=CCCC2)cc1 777520842 SUKZRRRWCPJHHW-UWJYYQICSA-N 330.431 5.027 30 20 EKED N#C[C@H](C(=O)c1cc2cccc(Cl)c2o1)c1ccc2ccccc2n1 783068219 IAGXZVQPYSAPGT-AWEZNQCLSA-N 346.773 5.124 30 20 EKED C=CCN(Cc1cccs1)Cc1ccc(Cl)nc1C(F)(F)F 787148740 XCBIDAAANBYUNX-UHFFFAOYSA-N 346.805 5.004 30 20 EKED C=CCC[C@H](N[C@H]1COCc2cccc(Cl)c21)c1ccccc1 788668481 BEETZKNOYOSAPH-OALUTQOASA-N 327.855 5.208 30 20 EKED CC(=NNc1c(Cl)cc(F)cc1Cl)c1coc(C(C)C)n1 799482408 LTQNDTREVONSKB-UHFFFAOYSA-N 330.190 5.080 30 20 EKED CC(=NNc1c(C)cccc1C(C)C)c1cnn(C(C)(C)C)c1C 812233557 ZJPRKZPJUZZKNR-UHFFFAOYSA-N 326.488 5.214 30 20 EKED C#CCCCSC1=NC(=O)/C(=C/c2csc3ccccc23)S1 814770943 IMLFCOKTPRVTSJ-GDNBJRDFSA-N 343.498 5.018 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCC[C@H](CC#N)C1 820738349 XIZXLECDADEPDB-OAHLLOKOSA-N 345.512 5.043 30 20 EKED CN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCCCCC1 838604099 NYICZXQLEMEWOJ-FQEVSTJZSA-N 341.499 5.176 30 20 EKED C=C(C)CNC(=S)N(Cc1ccc(C)s1)c1ccc(CC)cc1 915120480 AXNJMRCTIZTVKA-UHFFFAOYSA-N 344.549 5.076 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776700115 ZOWULIDSTHZSCA-FPAJZGIOSA-N 347.414 5.276 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C/c1c(C)cc(C)cc1C 1776783332 QTBCOPODOMEIDT-XETPZZHUSA-N 345.527 5.418 30 20 EKED CCc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776968911 MUCKJARCPCYANP-GHXNOFRVSA-N 346.382 5.103 30 20 EKED CCCCCCCC(=O)N1CCC(c2nc3ccccc3s2)CC1 104983210 DXNBROGDIGXKOA-UHFFFAOYSA-N 344.524 5.363 30 20 EKED CC[C@@H](CC(=O)Nc1ccccc1SCCC#N)c1ccccc1 108199254 VHHFAUURCPAUSV-INIZCTEOSA-N 338.476 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1Cl 189897588 XBKOBPGOZAGCDO-UHFFFAOYSA-N 348.273 6.098 30 20 EKED CC(C)COc1ccccc1[C@@H](CC(C)C)NCc1ccc(C#N)o1 236659880 PARIQUSKYBHUEY-HXUWFJFHSA-N 340.467 5.063 30 20 EKED C[C@@H](S[C@H](C)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 443144524 QAPROSWKONJUIF-ZIAGYGMSSA-N 335.432 5.164 30 20 EKED CC(C)c1nc(CNc2cccc(Oc3ccc(C#N)cc3)c2)cs1 444398784 KEZCMDSQYBEHET-UHFFFAOYSA-N 349.459 5.543 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1cc2[nH]ccc2cc1C 444974808 JICFMLUEJKEYEC-UHFFFAOYSA-N 325.456 5.077 30 20 EKED Cc1ccc2sc(C(=O)N(C)c3cc(Cl)ccc3C#N)cc2c1 464273168 RCSHPJAQSPGKNK-UHFFFAOYSA-N 340.835 5.011 30 20 EKED Cc1c(F)cccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 465277843 YLUVPYNPJOBKCG-UHFFFAOYSA-N 345.377 5.002 30 20 EKED CC/C=C\CCSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 467304490 FSMIEOJUMQJJLA-XVWMLYKFSA-N 348.537 5.109 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c2ccc(C)cc2c1C 476799785 QQWXKRZOJVWOHU-UHFFFAOYSA-N 346.474 5.889 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(F)c1C 481214303 KWWKLWFNVOTOLK-UHFFFAOYSA-N 338.835 5.069 30 20 EKED N#CCC[C@H](NC(=O)Nc1ccc(C2CCC2)cc1)c1ccccc1 489785444 YNXZMUMXJOKUQG-FQEVSTJZSA-N 333.435 5.121 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1F 512614952 XTFAXCHVATUVER-QRQCRPRQSA-N 348.396 5.277 30 20 EKED C=CCN(CC(F)(F)F)C(=O)c1oc2c(ccc3ccccc32)c1C 520167788 ZFRIXEWULHTLMR-UHFFFAOYSA-N 347.336 5.085 30 20 EKED N#Cc1ccccc1SCc1nc2ccccc2c2ccccc12 525758116 FLXXJBBECIXDAM-UHFFFAOYSA-N 326.424 5.552 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1Cl)c1ccccc1 534624815 VBNIYAHRBWPJKO-OXQOHEQNSA-N 339.866 5.363 30 20 EKED CCO[C@@H](C)c1nc(CSc2cccc(Cl)c2C#N)cs1 536733848 FGSVYETVEUVMDF-JTQLQIEISA-N 338.885 5.058 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2ccc3ncccc3c2)cc1 540202829 GEMKHHNQBDXQCR-UHFFFAOYSA-N 349.437 5.063 30 20 EKED Cc1ccc(CNCc2ccc(C#N)s2)c(Oc2ccccc2)c1 540619370 ZYKUCRFUMOUIJP-UHFFFAOYSA-N 334.444 5.010 30 20 EKED C=CCC(C)(C)c1noc(-c2c(-c3cccc(Cl)c3)noc2C)n1 560024113 KHFCJCRDIMCRJE-UHFFFAOYSA-N 343.814 5.207 30 20 EKED C=CCCOCCCCC(=O)Nc1cc(Cl)ccc1C(F)(F)F 584197165 YEDCNJKMBFHVPU-UHFFFAOYSA-N 349.780 5.060 30 20 EKED N#CCC1(CSCc2nc(-c3c(F)cccc3F)cs2)CC1 596368238 XONVJZLSVGHPNB-UHFFFAOYSA-N 336.432 5.015 30 20 EKED N#CCCC[C@H](NCc1ccsc1C(F)(F)F)c1ccccc1 600171460 VMSXAVSROFHMGA-HNNXBMFYSA-N 338.398 5.292 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H]2CCCC[C@@]21C 626534387 JJBAPPHXVHYJEP-UWJYYQICSA-N 326.484 5.335 30 20 EKED CCc1ccc2occ(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2c1 671745979 CRCYXWWLZSSZEJ-QGZVFWFLSA-N 340.382 5.033 30 20 EKED O=C1/C(=C/c2csc(-c3cccs3)n2)CSc2ccccc21 728439550 MOHKMCLOYSPXCG-DHZHZOJOSA-N 341.482 5.244 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(SC2CCCC2)cc1 742431287 GTYDMNKNFYLDQV-KHPPLWFESA-N 329.490 5.382 30 20 EKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036522 BAZASYABAILDRS-DOTOQJQBSA-N 340.492 5.593 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cccc(-c2ccccn2)c1 747694476 YCPQHWLECIJEQE-QXMHVHEDSA-N 345.446 5.039 30 20 EKED CC(C)c1cccc(NC(=S)N[C@H](CCC#N)c2ccccc2)c1 747707717 AYDPIUIMNKBMFL-LJQANCHMSA-N 337.492 5.141 30 20 EKED C=C[C@H](Cc1nc(-c2cccc(C(F)F)c2)no1)c1ccccc1 771515997 VXJLTFYRZDUXCZ-CYBMUJFWSA-N 326.346 5.187 30 20 EKED C#CCCCCCC(=O)N1CCc2cc(Cl)cc(Cl)c2[C@@H]1C 779980618 JRCHOZDUHWBBQG-ZDUSSCGKSA-N 338.278 5.023 30 20 EKED C[C@@H](Oc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 794719838 JGTLVDIZXWKWQO-CQSZACIVSA-N 338.407 5.045 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1cnn(C2CCCC2)c1 799895218 FIAZEUNUXXQZHH-KHPPLWFESA-N 349.459 5.018 30 20 EKED C=CCCC[C@@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccccc1 883325036 MXLSYAMMNNTIAE-MOPGFXCFSA-N 342.508 5.182 30 20 EKED Cc1ccc(-c2n[nH]cc2/C=C/C(=O)c2cc3ccccc3o2)cc1 920065106 IUYUEQADNSHUCD-ZHACJKMWSA-N 328.371 5.027 30 20 EKED CC(C)c1cccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)c1 1776375402 MDZRZPPREAEUOQ-VOTSOKGWSA-N 334.824 5.119 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1ccc(Cl)s1 96032914 IEKTVUJZEJLILI-TWGQIWQCSA-N 331.849 5.421 30 20 EKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CCCCC1 111766044 UHIFNPCTRZGLAI-HNNXBMFYSA-N 345.512 5.125 30 20 EKED C[C@H](Nc1cccc(OC2CCCC2)c1)c1ccc(OCC#N)cc1 183081819 IKAOBVDIUKEURY-INIZCTEOSA-N 336.435 5.083 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(Cl)cc1 209742244 JPZKJKSRXQCKTO-FPLPWBNLSA-N 331.849 5.421 30 20 EKED COC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340446643 GSAWYTGMKFNISJ-UXHICEINSA-N 342.870 5.052 30 20 EKED C=CCCc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F 410349986 RXLAYAWERBQMNF-UHFFFAOYSA-N 337.316 5.215 30 20 EKED CCCc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)sc1C 513654375 LENHFQHLSOYNCW-CYBMUJFWSA-N 340.473 5.109 30 20 EKED CC(C)[C@H](NCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 540422122 BJAPBTIGPRGQJG-INIZCTEOSA-N 326.406 5.322 30 20 EKED C=CCC[C@H](NCc1ccc(F)cc1C(F)(F)F)c1ccco1 552033609 KPBBNASQTNZHDX-HNNXBMFYSA-N 327.321 5.235 30 20 EKED C=CCOc1ccc(CN[C@H]2C[C@H](C)Sc3sccc32)cc1 552323950 WPIROWCXCYPRJZ-GUYCJALGSA-N 331.506 5.028 30 20 EKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(C2CCC2)c1 570712197 MMLMGNGBJJPVPG-OAHLLOKOSA-N 333.435 5.051 30 20 EKED Cc1cc([C@@H](N[C@H]2CCCc3cc(C#N)ccc32)C2CC2)ccc1F 584177091 JLYRPEYTVLUUPP-VXKWHMMOSA-N 334.438 5.124 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cc(F)ccc1Oc1ccccc1 591511695 HWKSAVREBSGUSO-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C=CCN(C(=O)CCC1CCCC1)c1nc(-c2ccccc2)cs1 641902238 MYRBTOYUJCSIDS-UHFFFAOYSA-N 340.492 5.300 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 739155471 IFYDPKADBKRGRL-CRAIPNDOSA-N 346.430 5.321 30 20 EKED C#Cc1cccc(NC(=S)N(CC2CCC2)[C@H](C)c2ccccc2)c1 740773841 YQPBCKALTLQTKR-QGZVFWFLSA-N 348.515 5.228 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc3ccc(C)cc3o2)c1 756043715 UHMUHQGZWMLOON-QFBILLFUSA-N 348.446 5.273 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Cl)c(F)c2)c1 772983410 HSXGFLQKXHTEAB-BBRMVZONSA-N 346.833 5.011 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)o1 810237605 JDIXQPCSJGGBND-CLFYSBASSA-N 339.372 5.121 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1ccc(Br)s1 834676138 OJTZNYIGWCPRIE-HNQUOIGGSA-N 333.659 5.122 30 20 EKED C=CCN(Cn1c(=S)sc2ccc(C(F)(F)F)cc21)C(C)C 917481123 BIPBXRPQWJLBKV-UHFFFAOYSA-N 346.443 5.305 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccccc1Cl 918723713 ULPWPHMYMSUFGB-UHFFFAOYSA-N 326.937 5.719 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1csc(C(F)(F)F)c1 926148782 TUQAVVXCTRKBCH-VHSXEESVSA-N 342.361 5.189 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Br)cc1 37284433 SBCTXRUKVOTQAR-UGSOOPFHSA-N 343.268 5.123 30 20 EKED CCc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 79863616 XKNOUHFZGOEKFE-NSHDSACASA-N 346.864 5.064 30 20 EKED Cc1cc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)s1 119251504 CXEWHYRYFYBJTC-ZDUSSCGKSA-N 341.480 5.049 30 20 EKED Cc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 122517547 JBKDVTHYUQRKHK-LBPRGKRZSA-N 344.867 5.153 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1csc(C)n1 189878771 FFYIEQYDQUSNCN-UHFFFAOYSA-N 342.508 5.265 30 20 EKED CCOc1cc(/C=C/C(=O)c2ccc(SC)cc2)cc(Cl)c1O 301492349 HIOZKDPYIGKRKX-RUDMXATFSA-N 348.851 5.062 30 20 EKED N#C[C@H](Sc1nnc(-c2cccc3ccccc23)o1)C1CCCCC1 303916440 SEPMTICYJMBQQP-SFHVURJKSA-N 349.459 5.454 30 20 EKED C[C@@H](N[C@H](CC(C)(C)C)c1ccccc1)c1ccc(OCC#N)cc1 392270326 LADIAKOBQZYVGC-DYESRHJHSA-N 336.479 5.417 30 20 EKED CCc1cccc(CC)c1NC(=O)c1sc2ccc(C#N)cc2c1C 431405480 WOVPEPPOBDPQGF-UHFFFAOYSA-N 348.471 5.459 30 20 EKED C=CCC[C@H](NC(=O)N1CCC[C@H]1c1ccsc1)c1ccccc1 435092960 AXIMGPDSXYKIQS-OALUTQOASA-N 340.492 5.302 30 20 EKED C[C@@H](SCCCCC(C)(C)C#N)c1nc(-c2cccs2)no1 435886108 SEOPPGIFEAIYLA-GFCCVEGCSA-N 335.498 5.312 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)N[C@@H](CCC#N)c1ccccc1 438836178 MXXHDQQHVDRLBU-SFTDATJTSA-N 349.478 5.214 30 20 EKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(C#N)cc1 439579632 ZCVYWJYNJJZIRN-MRXNPFEDSA-N 339.398 5.395 30 20 EKED C[C@H](c1cccc(C#N)c1)N1CCC[C@@H]1c1nc2ccccc2s1 442683567 VRKFPFGITVAGOD-RDTXWAMCSA-N 333.460 5.066 30 20 EKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc2ccccc2c1OC(F)F 453284267 GOFLIYRNWVAEIQ-YCPHGPKFSA-N 344.405 5.174 30 20 EKED C[C@@H](C1CCCCC1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458840002 MXTVQEGBLMXKNN-FXAWDEMLSA-N 341.499 5.032 30 20 EKED CCC[C@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 460154965 LXXMAOCAXJOXCL-HNNXBMFYSA-N 340.854 5.181 30 20 EKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 467714570 RBXZWBVPLWKTAP-YJBOKZPZSA-N 349.434 5.003 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(C)cc1OCCC 485760524 RWEOQCDQIVEIOO-UHFFFAOYSA-N 341.476 5.314 30 20 EKED N#Cc1ccc(NCc2cccc(COCc3ccccc3)c2)c(F)c1 506840564 VTHWDHUEBNDCIE-UHFFFAOYSA-N 346.405 5.026 30 20 EKED Cc1cccc(C(NCc2cccc(C#N)c2)c2cccc(C)c2)c1 531451732 CHAMOTILJXFMKX-UHFFFAOYSA-N 326.443 5.054 30 20 EKED C[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 535654425 FFLGMJCHLIBPAR-JKSUJKDBSA-N 349.434 5.003 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2CC(C)(C)C)c1 589739237 LTVZYOOYPRSTKW-KRWDZBQOSA-N 330.472 5.074 30 20 EKED Fc1ccc(CNC(CCC(F)(F)F)CCC(F)(F)F)c(F)c1 657701882 DDBJPDATERAUIW-UHFFFAOYSA-N 349.265 5.108 30 20 EKED Cc1cc(C)c(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1C 726742715 WRFBWRUZKQWEPA-KTKRTIGZSA-N 333.431 5.191 30 20 EKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cnn(C(C)C)c2)c1 729644161 QPSIZQZWGYODFJ-QXMHVHEDSA-N 330.431 5.336 30 20 EKED CCCCCCCC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 731013768 CCIUNAOAVBOZQJ-HXUWFJFHSA-N 326.484 5.582 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cc4ccccc4o3)c2)s1 740012167 ZFPUJJKEHBMARE-UHFFFAOYSA-N 344.439 5.323 30 20 EKED CCCCCCCCCCC(=O)N1CC(c2nc3ccccc3[nH]2)C1 761584882 CYWJZEAOSXZPPK-UHFFFAOYSA-N 341.499 5.020 30 20 EKED CC(C)[C@H]1/C(=C/c2csc(-c3ccccn3)n2)C(=O)c2ccccc21 766507720 XAHUJNOJDHIHGN-DPWKNNTCSA-N 346.455 5.225 30 20 EKED CC(C)[C@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@H](C)C#N 780147411 GYVUPBGFOAWLPO-AEFFLSMTSA-N 342.483 5.159 30 20 EKED C#CCCCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 780385836 SRJMOIFRMQGIHY-QGZVFWFLSA-N 338.278 5.241 30 20 EKED CC(C)[C@@H]1/C(=C/c2ncc(C(F)(F)F)s2)C(=O)c2ccccc21 788356228 UEPBYQRXXNBGBE-XCHKQJEOSA-N 337.366 5.181 30 20 EKED C[C@H](c1ccc(C(=O)Nc2ccc(CCC#N)cc2)cc1)C(F)(F)F 928401466 XLDWEIVVDCPIGV-CYBMUJFWSA-N 346.352 5.061 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cc2ccccc2s1 1776782956 SBQQQTUOFHXBBO-MRXNPFEDSA-N 333.497 5.195 30 20 EKED C=CCCCN(C)[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 119291463 UMNPGJCYVHYZBF-LLVKDONJSA-N 340.254 5.002 30 20 EKED CCCCc1nc(CNc2ccccc2SC[C@H](C)C#N)cs1 172906216 BPHROZNZGRDHGL-CQSZACIVSA-N 345.537 5.350 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(F)c(C#N)c2)cc1 182098723 PSZJFGPPJJWVRU-CQSZACIVSA-N 328.456 5.049 30 20 EKED CC[C@H](c1ccccc1)c1nnc(S[C@H](C)c2cccc(C#N)c2)o1 189844592 KYDWVMIXOOYGAZ-RDTXWAMCSA-N 349.459 5.336 30 20 EKED Cc1cc(C)cc(C(=O)/C=C/c2csc(-c3ccsc3)n2)c1 303324804 RWZWVPFGDHOFKB-ONEGZZNKSA-N 325.458 5.385 30 20 EKED C=CCC[C@@H](NCc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 342189589 GIJYCONRJIGWHO-MRXNPFEDSA-N 340.414 5.267 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@H](c2ccccc2)C1 436419884 ZKEVTDPEDYPPDX-MXVIHJGJSA-N 348.490 5.606 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 485758240 WEFMKORXOCKPDZ-UHFFFAOYSA-N 336.460 5.018 30 20 EKED N#Cc1ccc(F)c(CSCc2csc(-c3cccs3)n2)c1 517287750 SGHRPOGRXUIWMO-UHFFFAOYSA-N 346.477 5.316 30 20 EKED CC(C)(C)CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 519094817 GSVIYHKFPFOOER-UHFFFAOYSA-N 340.854 5.181 30 20 EKED N#CC1(CSCc2cn(-c3ccccc3)nc2-c2ccccc2)CC1 540614335 MBCLDKGKFWEZHB-UHFFFAOYSA-N 345.471 5.076 30 20 EKED CN(c1ccccc1)c1ccc(CNc2ccc(CC#N)cc2)cc1 603834949 MVIBZWTXUXNZBU-UHFFFAOYSA-N 327.431 5.133 30 20 EKED CC[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(C)cc1 609967826 JMOAXWOLWZOWSN-OAQYLSRUSA-N 348.490 5.188 30 20 EKED N#Cc1ccccc1SCc1coc(-c2cccc(Cl)c2)n1 610206602 QXNWRPGDZGCLNS-UHFFFAOYSA-N 326.808 5.159 30 20 EKED CCc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)s1 728438954 CTUSNUFSMIEUCF-FNORWQNLSA-N 331.487 5.392 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3sccc3C)s2)cc1 734304823 XLPNMSVCDSLSNO-BQYQJAHWSA-N 325.458 5.385 30 20 EKED Clc1ccc(CSc2nncn2N=CC2CCCCCC2)cc1 741838932 YMPMOVDAMISYTP-UHFFFAOYSA-N 348.903 5.028 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747193626 KVKWLHOIHXZEPX-YOEHRIQHSA-N 340.492 5.199 30 20 EKED O=C1/C(=C\c2ccc(Cl)nc2)CCC/C1=C/c1ccc(Cl)nc1 748993863 DJKJWMYJRCCLQT-SFGFDRCGSA-N 345.229 5.003 30 20 EKED Cc1cncc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)c1 767366641 IKRRQPYSSKKUAV-SREVYHEPSA-N 340.835 5.063 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCC(C)(C)C3)n2)cc1 781768121 VNDJWPGELJDGPT-CVEARBPZSA-N 338.476 5.121 30 20 EKED C=CC[C@H](N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccncc1 788579798 HMQJQLHDWRNHDH-BVUBDWEXSA-N 332.900 5.196 30 20 EKED Cc1cc(CCCC(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)s1 792093471 JFHKZNZWNBTMRQ-LJQANCHMSA-N 348.471 5.112 30 20 EKED C=CCCCCCCCNC(=O)c1c(C(F)(F)F)ccnc1Cl 813256700 JDDILQSHLZHXKZ-UHFFFAOYSA-N 348.796 5.010 30 20 EKED N#CCCC[C@H](NCc1ccc(SC(F)F)cc1)c1ccccc1 814303705 AGBRJMIGAKVALW-SFHVURJKSA-N 346.446 5.526 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1scnc1C 915110535 XDQZFDRPBDHOIU-UHFFFAOYSA-N 334.659 5.248 30 20 EKED C#Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2Cl)c1 915339644 BWLLLMAOJIMKNW-LBPRGKRZSA-N 347.245 5.200 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776805979 MJYVTEKNYUYBOO-QXMHVHEDSA-N 342.822 5.277 30 20 EKED N#C[C@@H](Sc1nnc(-c2cc3ccccc3o2)o1)C1CCCCC1 176798591 XOCVUXLTYIJYMB-MRXNPFEDSA-N 339.420 5.047 30 20 EKED CC[C@H](c1ccccc1)c1nnc(SCCCC(C)(C)C#N)o1 177290845 FZNFQDKTBZGFTH-OAHLLOKOSA-N 329.469 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc2[nH]ccc2c1 189890996 FRWLRUOFBJCBCL-UHFFFAOYSA-N 346.474 5.591 30 20 EKED CC[C@@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 193341923 LGFCVVPOMBKIBK-NVXWUHKLSA-N 338.476 5.213 30 20 EKED Cc1cccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)C(C)(C)C)c1 237704744 OVSABUCBEDJQAN-UWJYYQICSA-N 336.479 5.163 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]1 329126919 YUAYMJFVWGMUIF-YESZJQIVSA-N 337.467 5.580 30 20 EKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1cc2ccccc2o1 329473602 AOXILLQFNSHWQJ-KRWDZBQOSA-N 349.434 5.127 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 417361605 JDGVUFJCVSBHQR-UGSOOPFHSA-N 339.508 5.175 30 20 EKED Cc1ccc2cc([C@@H](C)Nc3cccc(OCCCC#N)c3)oc2c1 426065483 ZHKPSPQRUBVITG-MRXNPFEDSA-N 334.419 5.597 30 20 EKED C[C@@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cccc(C#N)c1 429423115 IGRHSMUYCQHDJS-CYBMUJFWSA-N 332.369 5.571 30 20 EKED CC[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 447543182 REPZGOKHDLACTA-ROUUACIJSA-N 342.895 5.489 30 20 EKED CC[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(C#N)cc1 447608347 VHNRPXSTGOERDX-FQEVSTJZSA-N 343.430 5.654 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C 466440275 FQZUUFYGMZVNMP-RYUDHWBXSA-N 326.267 5.041 30 20 EKED N#CC1(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)CCCCC1 471432713 VBBCKKWUKABEJR-UHFFFAOYSA-N 338.838 5.420 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)=O)s1 476082224 XICYEZWVBIFJHQ-UHFFFAOYSA-N 327.449 5.055 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(CC)s1 476118903 OLMDYYXGUMMOPE-UHFFFAOYSA-N 327.493 5.723 30 20 EKED Cc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cccc1C(F)(F)F 476357916 XVACOBFZGMCZHB-OAHLLOKOSA-N 346.352 5.040 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2occ(C)c2c1 482538537 UOXZJISPPYUUMI-UHFFFAOYSA-N 347.418 5.057 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2F)nnc1-c1ccoc1C 501470421 INONTDJJJWRGIK-ZDUSSCGKSA-N 343.427 5.025 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 510667551 PRSMBSBMDJSABN-MRXNPFEDSA-N 349.434 5.004 30 20 EKED Cc1ccccc1[C@H](NCc1ccc(C#N)cc1C(F)(F)F)C1CC1 515334906 RIHPDNWJZLSYBQ-LJQANCHMSA-N 344.380 5.126 30 20 EKED N#Cc1c(Cl)cccc1SCc1coc(-c2cccc(F)c2)n1 538950426 ORWIQDYKGGIBLM-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccc(C#N)cc1 542721714 NARNEEPVTDMODH-SNVBAGLBSA-N 349.768 5.032 30 20 EKED N#Cc1ccc(CNCc2ccc(-c3ccccc3Cl)s2)s1 553664225 OQKAVDIPNATUMV-UHFFFAOYSA-N 344.892 5.291 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-c2ccccc2F)o1 557508185 LJBFVNMGWJELGF-NRFANRHFSA-N 346.405 5.125 30 20 EKED CC(C)(CCC#N)CN[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 566815070 RWLJFWMASSRHED-FQEVSTJZSA-N 342.433 5.168 30 20 EKED C=CCOc1cccc(NC(=O)N(C2CC2)[C@@H](C)c2ccccc2)c1 582804071 APYSGSOJCXUSIT-INIZCTEOSA-N 336.435 5.009 30 20 EKED N#Cc1c(F)cccc1CNc1ccccc1COCc1ccccc1 589970498 GIXHFAMAVPVDHI-UHFFFAOYSA-N 346.405 5.026 30 20 EKED Cc1cccc(-c2nnc(SCCC#N)n2[C@H]2CCCC[C@@H]2C)c1 593578001 IGOUPMPHGPDQFJ-RDJZCZTQSA-N 340.496 5.011 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1cc2c(Cl)cccc2s1 609187040 ORYSBLKWHKAVNP-UHFFFAOYSA-N 348.899 5.347 30 20 EKED C=CCCOCCCCC(=O)Nc1c(C)cc(C(F)(F)F)cc1C 636436095 NUAZOAXZKCGDIJ-UHFFFAOYSA-N 343.389 5.024 30 20 EKED Cc1ncccc1/C=C\C(=O)c1ccc(-c2ccccc2Cl)s1 728785605 IANKSMBLBNWDKE-HJWRWDBZSA-N 339.847 5.668 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2)o1)c1c(Cl)nc2ccccn12 737446564 WAJIMEMZVINGRT-PKNBQFBNSA-N 348.789 5.144 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccc(C)cc1 747197638 KZFUOFVPFAPDJP-WBVHZDCISA-N 340.492 5.335 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C=C2CCC2)cc1Cl 755174411 HCNOMDRDAMZNIY-SFHVURJKSA-N 336.822 5.044 30 20 EKED CCCCCCCCC(=O)N1CCC(OCc2ccccc2F)CC1 768896005 VLPKIGIPWKMFLG-UHFFFAOYSA-N 349.490 5.084 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cnc(-c2ccco2)s1 789127370 JEFLKZDLBRHBBT-HJWRWDBZSA-N 334.400 5.089 30 20 EKED CC(/C=C\C(=O)c1c(F)cccc1Cl)=C/c1cccc([N+](=O)[O-])c1 809158798 DNSNMGJMCDAQRI-DMGFJBLZSA-N 345.757 5.230 30 20 EKED C#C[C@H](NCc1c(Cl)ccc2cccnc12)c1ccc(Cl)cc1 811516288 IYXLFIRCDONQKP-SFHVURJKSA-N 341.241 5.006 30 20 EKED CC(=NNc1cccc(Cl)c1Cl)c1c(C)nn(C(C)C)c1C 841645538 PSNUKJMCLTXPLV-UHFFFAOYSA-N 339.270 5.224 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)c1ccccc1SC(C)(C)C 1776037144 BIJBQZWOAVVYOB-UHFFFAOYSA-N 342.464 5.112 30 20 EKED CC[C@@H](C)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776698349 LJZZBQXZNWXKTF-JPVKTXQWSA-N 348.442 5.501 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 25438220 MTFCDGRWDVXNQJ-UHFFFAOYSA-N 333.218 5.047 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2cccc3cccnc23)cc1 91068197 HYVWTRSMILSZJF-UHFFFAOYSA-N 349.437 5.063 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1CC(F)(F)F 173993773 CZTRUNYUCVCBSG-UHFFFAOYSA-N 348.368 5.012 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H]1CCc2ccc(F)cc21 178396735 DVWITRNIEARBBF-GUYCJALGSA-N 326.440 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccccc2)C1 191514173 HPEYXVHSTMWQLG-HXUWFJFHSA-N 348.490 5.560 30 20 EKED CSc1nc(C(C)(C)C)nc(C)c1C(O)=Nc1cccc(C)c1C 330979595 JBSUMSODCRMYGU-UHFFFAOYSA-N 343.496 5.058 30 20 EKED N#CCCC[C@H](NC/C=C/c1ccc(F)cc1F)c1ccccc1 353914683 KZKHJACGLNQDRC-ZGBFETHSSA-N 326.390 5.003 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F 410377122 ZVKPQEJLFVLPLS-HUUCEWRRSA-N 325.374 5.112 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 431950707 LYSDVAABUWADDL-UHFFFAOYSA-N 337.341 5.004 30 20 EKED N#CCCC[C@H](NCc1coc(-c2cccc(F)c2)n1)c1ccccc1 433019915 QLWPOXKXEIHFMN-FQEVSTJZSA-N 349.409 5.005 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CCC(C)(C)CC1 438051139 BPTXDSDPLMMIMS-CQSZACIVSA-N 345.512 5.171 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@](C)(CC)c1nc(C)cs1 505046735 YDCPZURMLOFLBH-IBGZPJMESA-N 343.496 5.017 30 20 EKED C=CCN(Cc1cccs1)Cc1cnc(-c2cccs2)s1 506004524 BGRXKTRPYGYPNU-UHFFFAOYSA-N 332.519 5.121 30 20 EKED C=CCC[C@H](NCc1nc(-c2ccccc2)oc1C)c1ccccc1 538192425 YPDKXTPOTMCTPC-FQEVSTJZSA-N 332.447 5.447 30 20 EKED N#CCc1ccc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)cc1 542233747 WJESUTFICGHQRH-JOCHJYFZSA-N 346.861 5.285 30 20 EKED CC(C)[C@@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)cc1F 543186391 VQKJEFOMOATVKY-LJQANCHMSA-N 330.834 5.032 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)c2ccccc12 558172238 FFJRUTIKFDOQML-INIZCTEOSA-N 346.449 5.631 30 20 EKED Cc1c([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)oc2ccccc12 614185191 RPXFJZMHVNKFSU-MRXNPFEDSA-N 332.447 5.393 30 20 EKED Cc1cc(C#N)ccc1CSc1nnc(CCC2CCCCC2)o1 614402827 KGPUQSPRDYCKPV-UHFFFAOYSA-N 341.480 5.055 30 20 EKED N#C[C@@H](C(=O)CCCC1CCCCC1)c1nc2cc(F)ccc2s1 730422059 SNPACYOBEWPWAT-HNNXBMFYSA-N 344.455 5.362 30 20 EKED O=C1/C(=C\c2ccsc2)CCc2nc(-c3ccccc3F)sc21 731939355 WKZPTANJGXDVHG-XFXZXTDPSA-N 341.432 5.223 30 20 EKED FC(F)Oc1ccc(NN=Cc2csc(Cl)c2Cl)cc1 761803567 IFHJTJNYCOVCDM-UHFFFAOYSA-N 337.178 5.102 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@@H]1C[C@@H](O)c1ccccc1 769735615 ZBLHQSOEKYBCBX-NHCUHLMSSA-N 342.527 5.075 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772240113 ZZKRGWIVCCJQJH-DQLDELGASA-N 347.462 5.137 30 20 EKED Cc1ccc(O)c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 782383718 WQAKUEXCMJPYIV-KRWDZBQOSA-N 342.442 5.090 30 20 EKED C=CC[C@@H](OC(=O)[C@H]1C[C@@H]1C(F)F)c1ccc(Cl)c(Cl)c1 800971423 LRQHNMBJDWCMRP-OUJBWJOFSA-N 335.177 5.055 30 20 EKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC1CCC(C)(C#N)CC1 862471894 BRKCCVXENNXUFG-UHFFFAOYSA-N 343.471 5.226 30 20 EKED Cc1oc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 915085272 JWXXBGDTMKPHRG-FQEVSTJZSA-N 344.414 5.113 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cc(C(C)(C)C)oc1C 1776783658 APHHFWGPNRKJQL-QGZVFWFLSA-N 337.504 5.179 30 20 EKED CCCCSc1nnc(SCCCCC(C)(C)C#N)s1 436128616 IESRBQFBGVGJQK-UHFFFAOYSA-N 329.560 5.242 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 438069404 BIOVFUAUBKAOSH-AWEZNQCLSA-N 333.501 5.171 30 20 EKED C=CC[C@@H](CC)NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 439447304 YAOQBEGRETTXNU-CQSZACIVSA-N 345.830 5.004 30 20 EKED CC(C)c1occc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 479796194 LMMQPEPKUVPEDG-UHFFFAOYSA-N 346.386 5.319 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccc(C#N)c(F)c1 488803959 JDPZNDAMMAMNOF-JBEBIEQOSA-N 343.467 5.005 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)Cc1cccc(Cl)c1 505051610 KYPOADDFBRJZTP-UHFFFAOYSA-N 328.843 5.123 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(-c2nc3ccc(C)cc3s2)cc1 505886196 ADBIVUWTTFNUBU-HXUWFJFHSA-N 349.459 5.150 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)c1 515775189 GLKZFJAORNKAHR-KRWDZBQOSA-N 349.478 5.330 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 522534319 CANWAMKVWDEFBV-LJQANCHMSA-N 348.490 5.045 30 20 EKED COc1cccc2cc([C@H](C)N[C@@H](CCCC#N)c3ccccc3)oc12 550832274 DGRGCKIHFBKGNO-LPHOPBHVSA-N 348.446 5.527 30 20 EKED N#C[C@@]1(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)CC12CCCC2 590975721 BYWYUGSGIONZBQ-OAHLLOKOSA-N 343.641 5.059 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 611390436 AKZOPOGJXPBBTH-IIBYNOLFSA-N 334.463 5.074 30 20 EKED C=CC[C@@H](NCc1ccc(-c2ccccc2Cl)o1)c1ccncc1 734509633 NFWDREQLZLRUJM-LJQANCHMSA-N 338.838 5.402 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/C2CCCCC2)cc1 735427630 DOTOPVDIERLWFV-UPMCQBDUSA-N 344.458 5.417 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2c[nH]c3cc(Cl)ccc23)s1 736434834 WNIZOLXGFYQRDB-FNORWQNLSA-N 344.867 5.471 30 20 EKED Cc1ccc(COc2ccc(/C=C/C(=O)c3cncc(F)c3)cc2)cc1 737442616 CUBIYNUAKWOADO-DHZHZOJOSA-N 347.389 5.004 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1ccc2ccccc2n1 756518892 JOALYZYVAALUFX-BHEFUSTPSA-N 346.817 5.168 30 20 EKED CC(=NNc1c(Cl)cccc1Cl)c1c(C)nn(C(C)C)c1C 763181295 YPMDKZYBNVWXRN-UHFFFAOYSA-N 339.270 5.224 30 20 EKED C=CCC[C@H](NCc1ccc(CSC(F)F)o1)c1ccccc1 771994265 PPMXEQIGWAATGM-KRWDZBQOSA-N 337.435 5.533 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccccc1 773104632 FMJBLVHRJMKPBX-FDDCHVKYSA-N 326.443 5.164 30 20 EKED C#Cc1cccc(NC(=S)Nc2cccc(-c3ccccc3)c2)c1 806587839 WMEHIVBOIAWFJQ-UHFFFAOYSA-N 328.440 5.144 30 20 EKED Cc1cc(C)c(C(=O)O)cc1/C=C\C(=O)c1ccc2ccccc2c1 1776130935 BCBMEOXIBVGSAQ-KTKRTIGZSA-N 330.383 5.051 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1cccc(F)c1C#N 195607967 TVBBOKHTETZISX-LBPRGKRZSA-N 337.423 5.302 30 20 EKED C[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(OCC#N)cc1 293905964 ZUPSOFWAZWJMRH-BLLLJJGKSA-N 346.883 5.032 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1Cl 328806721 IAABDAWTMAJVGW-RRFJBIMHSA-N 348.874 6.142 30 20 EKED C=CCCc1ccccc1NCc1nnc(-c2cccc(Cl)c2)o1 409842728 FMPUMMXSFGEORS-UHFFFAOYSA-N 339.826 5.121 30 20 EKED CC[C@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(C)cc1 439671091 ZPYIGCYGFYVWRE-NQIIRXRSSA-N 334.463 5.040 30 20 EKED C[C@@H](SCc1coc(-c2cccc(F)c2)n1)c1cccc(C#N)c1 443159205 SNRLXELWAXEZTR-CYBMUJFWSA-N 338.407 5.347 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)[C@]1(C#N)CC12CCCC2 449999177 KYFRSMVCWJPKEM-HXUWFJFHSA-N 342.508 5.049 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 464653832 XLQZGRJFGMRSEI-CXAGYDPISA-N 333.884 5.209 30 20 EKED CCC(C)(C)CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 466992304 NVPONOMAYYMWGK-UHFFFAOYSA-N 338.476 5.150 30 20 EKED C=CCC(CC=C)C(=O)N(CC=C)c1nc(-c2ccccc2)cs1 468539722 DBKQUOCFSGVNRM-UHFFFAOYSA-N 338.476 5.098 30 20 EKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)c(C)cc1Cl 475769233 BONMOAPSIGURHA-UHFFFAOYSA-N 344.867 5.215 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccc(Cl)cc3)n2)nc1 476584527 PGXKQDRRRPFAHP-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1c(C)cccc1CC)c1ccc(F)c(F)c1 479780558 YGURACJKVMGAIG-GOSISDBHSA-N 344.405 5.275 30 20 EKED CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480809729 YUCRTINFKKFMFE-BEFAXECRSA-N 349.434 5.003 30 20 EKED C[C@H](NC[C@H](C)C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 542012180 PJXWGLQRPFEMJU-KBPBESRZSA-N 332.369 5.074 30 20 EKED N#CC1(c2ccc(-c3nc(-c4ccc5sccc5c4)no3)cc2)CC1 546396149 SMBHNSUQKGQZEH-UHFFFAOYSA-N 343.411 5.173 30 20 EKED N#CCCCCCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 588884326 FNBJMEDWQQUMAP-HXUWFJFHSA-N 340.854 5.020 30 20 EKED CC(C)CN(C(=O)CCCCCC#N)c1ccc(C(F)(F)F)cc1 590878559 MIMBTNLYTQHRIY-UHFFFAOYSA-N 340.389 5.168 30 20 EKED CCc1ccc(-c2nc(CN[C@H](C)c3cccc(C#N)c3)cs2)cc1 611386703 RYSJSIMRNHWQIT-OAHLLOKOSA-N 347.487 5.095 30 20 EKED CC(=O)Nc1c(C)ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1C 619508506 FAJLLQSHIYDDES-OAQYLSRUSA-N 347.462 5.013 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)sc1Cl 619754765 KCAXVPQVTZQECX-MRVPVSSYSA-N 345.682 5.431 30 20 EKED C=CC[C@@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1 666304528 WDOULEZFCLOFET-OAHLLOKOSA-N 340.389 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccoc1 682778185 YUXMVEQFHARJGS-UHFFFAOYSA-N 326.440 5.186 30 20 EKED CC(=NNc1ccc(C)cn1)c1ccc(Cl)c(Cl)c1Cl 727259518 FWYKSMJITHDGPZ-UHFFFAOYSA-N 328.630 5.186 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2c(C)cccc2C)c1 727285506 WSBWAIBFAJFUHA-UHFFFAOYSA-N 326.465 5.067 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)(C)C 744036090 XFJUTPAXIDMHPV-SCOADAFUSA-N 338.476 5.287 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CC[C@@H](C)c3ccccc32)c1 772985754 YANLRCQVUCOUBG-RADWXHQJSA-N 334.463 5.096 30 20 EKED C=CCC[C@H](Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1)c1ccco1 796918626 QFLJLAVCJDGOQX-ZWOKBUDYSA-N 340.467 5.013 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2c(Cl)nccc2o1 866309183 MHGSPIRVXYDABU-CZUORRHYSA-N 339.826 5.177 30 20 EKED CC(C)(C)[C@@H]1CCc2sc(C(=O)Nc3sccc3C#N)cc2C1 908091516 FVBFVEGERLDSLZ-CYBMUJFWSA-N 344.505 5.085 30 20 EKED O=C(O)c1cccc(NN=C2CCC[C@@H](c3cccc(Cl)c3)C2)c1 1776037335 AXKABDZJPGFZSQ-CQSZACIVSA-N 342.826 5.164 30 20 EKED N#C[C@H](C(=O)c1ccc(Cl)s1)c1nc(-c2ccccc2)cs1 78735526 PHQHUWUJJDVJNK-LLVKDONJSA-N 344.848 5.015 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc12 118443155 YGDYXDPFMPYRFL-GJZGRUSLSA-N 334.419 5.115 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1O 186150811 CUQGPFFAXWMUHG-KKSFZXQISA-N 330.431 5.241 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc2c(c1)CCCC2 237495656 VSIUVMWKGCJYME-SFHVURJKSA-N 348.490 5.099 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)s1 271515644 UDBSPVGNIPTCJQ-IUODEOHRSA-N 334.872 5.106 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1Cl 329032968 XSJYXVLRMHPHPM-CWRNSKLLSA-N 348.874 6.142 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2nc3c(ccc4ccccc43)s2)CCC1=O 329386133 POCZWEMTWARQAO-WCQYABFASA-N 338.432 5.043 30 20 EKED Cc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cc1Cl 330000140 VZMHHEMIIDOSTG-UHFFFAOYSA-N 334.847 5.162 30 20 EKED Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c2ccccc12 420279606 PJABUBYZKGAMCM-KRWDZBQOSA-N 334.444 5.218 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1cccc(CSC(C)C)c1C 438827057 BBJUTNLIGXNJOX-UHFFFAOYSA-N 338.476 5.069 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2ccc(SCc3ccccc3Cl)cn2)C1 442833348 HLRXSFGQXIKLIX-UKRRQHHQSA-N 343.883 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](CC2CC2)C1 455239626 CYYWYVNAFCKKHP-KRWDZBQOSA-N 326.484 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1Cl 552507373 FGCFTOPUQVLGTP-UHFFFAOYSA-N 338.838 5.316 30 20 EKED Cc1c(C(=O)N(c2ccccc2)C(C)C)sc2ccc(C#N)cc12 563667167 RAJYUBWVWWABLT-UHFFFAOYSA-N 334.444 5.137 30 20 EKED N#CCCn1cc(-c2csc(CCC(F)(F)F)n2)c2ccccc21 600885910 ZNVHIGFQWYPCOQ-UHFFFAOYSA-N 349.381 5.173 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@H](C#N)C3CCCCC3)sc2c1 610502088 ZXGVWOHGQCGXBO-CQSZACIVSA-N 346.883 5.065 30 20 EKED Cc1nc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)s1 611367541 JHVSTILLLCNGGA-AWEZNQCLSA-N 347.487 5.149 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(SC)cc1C 613900819 KQUSIVFNDDHVGH-UHFFFAOYSA-N 329.465 5.414 30 20 EKED C=C[C@H](CC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 677567426 YYPVNXQTZICYNX-LJQANCHMSA-N 349.449 5.191 30 20 EKED C=CCOc1ccc(/C=C/C(=O)c2ccc(F)cc2F)cc1Cl 727264568 SFCHTYIIVLSKTQ-XVNBXDOJSA-N 334.749 5.079 30 20 EKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCC(C)(C)C)cc1 729070380 UUIGWUMDPGFKOM-YJBOKZPZSA-N 342.483 5.064 30 20 EKED O=C(/C=C\c1ccc(-n2cccn2)cc1)c1cccc(Cl)c1Cl 734982170 YECGFUFFRDPORY-YFHOEESVSA-N 343.213 5.075 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@H]1c1cccnc1 735632221 ZCRILHLYEHGICS-XIJQHFHMSA-N 328.500 5.442 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 744119481 RXGZNWVBMQPUGS-TZMCWYRMSA-N 332.444 5.218 30 20 EKED FC(F)(F)c1csc(NN=Cc2c(Cl)oc3ccccc23)n1 761268147 XGOZEXIYARDQKM-UHFFFAOYSA-N 345.733 5.008 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1cccc(-c2ccccc2)c1 773030863 WHCRDNVOLQXBLP-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)Nc1ccccc1O[C@H](C)C#N 780743418 BHFBWWMTDSJKDB-UONOGXRCSA-N 348.368 5.039 30 20 EKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1cc2ccccc2s1 788356975 YGIXGEHTXXTPLS-AATRIKPKSA-N 339.363 5.273 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1nccc2ccccc12 802812902 HKAJVTDRMVMALL-QOJCHSLYSA-N 332.447 5.018 30 20 EKED CC(/C=C\C(=O)c1ccnc(Cl)c1)=C\c1ccccc1OC(F)F 811693524 KFWNJMGECZGXPL-WTVYDBEASA-N 349.764 5.179 30 20 EKED O=C1/C(=C/c2csc(-c3ccccc3)n2)Cc2c(Cl)cccc21 921263938 LJCBMPMJIWXPIK-UKTHLTGXSA-N 337.831 5.286 30 20 EKED CC(C)[C@@H]1/C(=C/c2ccc(C(=O)O)cc2Cl)C(=O)c2ccccc21 1776308863 RVLCJAUGBVREAE-VUZIPCMWSA-N 340.806 5.058 30 20 EKED CCc1ccsc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 66510939 DPMKYIWGFKRBNX-NSHDSACASA-N 346.864 5.064 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(F)c1Cl 80172196 CQMPALLVWLQYNW-NSHDSACASA-N 348.830 5.126 30 20 EKED CC(C)N(C(=O)c1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 89623292 KSKITMBHABHFGW-UHFFFAOYSA-N 347.245 5.115 30 20 EKED C=CCC[C@@H](C(=O)Nc1cc(C(C)=O)ccc1Cl)c1ccccc1 188593874 RAMNVSHJLGEIQS-QGZVFWFLSA-N 341.838 5.231 30 20 EKED N#CCC[C@@H](NCc1ccc(F)c(Cl)c1Cl)c1ccccc1 432258900 PCLBRWXTNGHYHQ-OAHLLOKOSA-N 337.225 5.267 30 20 EKED CC(C)(C#N)CCCCN[C@@H](Cc1ccccc1)c1cccs1 444688570 ZYTHDZLXDDIGAN-SFHVURJKSA-N 326.509 5.342 30 20 EKED N#Cc1ccnc(S[C@H](c2ccccc2)c2ccc(F)c(F)c2)c1 463252129 YYCBHPBXGCWCBJ-LJQANCHMSA-N 338.382 5.113 30 20 EKED N#CCCCC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 463683331 USKGOKZEXWCUMD-UHFFFAOYSA-N 348.324 5.130 30 20 EKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 467714567 RBXZWBVPLWKTAP-CRAIPNDOSA-N 349.434 5.003 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1noc(-c2ccccc2)n1 477426371 KGPQTEGYHFPULW-LLVKDONJSA-N 341.823 5.115 30 20 EKED CCc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 503227761 XJRZZZFBXCKEET-AWEZNQCLSA-N 339.464 5.287 30 20 EKED CC[C@H](C)Oc1cc(C)ccc1CN[C@H](C)c1ccc(C#N)cc1F 512628103 CWRXRCRKGVUNSD-JKSUJKDBSA-N 340.442 5.034 30 20 EKED N#C[C@@H](C(=O)c1csc2ccccc12)c1nc2ccccc2s1 513695976 PWQWNHDVIQHPRO-LBPRGKRZSA-N 334.425 5.001 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 518277082 COMSAIPBNZVRDQ-AWEZNQCLSA-N 336.822 5.322 30 20 EKED Cc1nc([C@@H](C)Oc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 532162542 BJQFMOMZWRPWPF-CYBMUJFWSA-N 338.794 5.315 30 20 EKED C=C[C@H](CC(=O)N1[C@@H](C)c2ccc(F)cc2C[C@H]1C)c1ccccc1 537692590 JKRNICNKYBWPTH-IXDOHACOSA-N 337.438 5.020 30 20 EKED C[C@@H](N[C@H](C)c1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1 544577690 HOANKFZBDNGRGH-HZPDHXFCSA-N 332.472 5.699 30 20 EKED C=CCC[C@@H](NC(=O)Nc1ccccc1CSC)c1ccccc1 546843369 IDXWXWJLLHDUKN-GOSISDBHSA-N 340.492 5.379 30 20 EKED C[C@H](Oc1ccccc1N[C@H](C)c1cccc(C#N)c1)C(F)(F)F 600850554 CQRRGBSMRUYVSG-OLZOCXBDSA-N 334.341 5.061 30 20 EKED C=CCCCN(C)C(=O)N[C@H](CCC)c1cccc(C(F)(F)F)c1 605965458 BRUZSYSOBIDYKE-MRXNPFEDSA-N 342.405 5.154 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C\c1csc(-c2cccs2)n1 731318231 HGXROCBRQJXOGG-ALCCZGGFSA-N 329.421 5.215 30 20 EKED CC(C)(C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739154746 DMDNMSVSNVFXEU-AWEZNQCLSA-N 346.883 5.466 30 20 EKED C[C@H](C#N)Oc1ccccc1NC(=O)CC1CCC(C(C)(C)C)CC1 780159206 OCDSYWVKENBQRS-KLAILNCOSA-N 342.483 5.159 30 20 EKED CC1(C)C/C(=C\c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 794967552 FGIOWBLMQVQNAC-SDNWHVSQSA-N 346.455 5.153 30 20 EKED CCC[C@](C)(CC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 796651005 NXMYBKHNIIMJNH-SJCJKPOMSA-N 334.872 5.342 30 20 EKED Cc1nc(Oc2ccc(C3SCCS3)cc2)c(Cl)cc1C#N 812449790 UKMWJVZXQBCBGE-UHFFFAOYSA-N 348.880 5.186 30 20 EKED C=CCOc1ccc(C(=O)Nc2ccccc2-c2cccs2)cc1 32426645 IUCIZXHVPSRDMA-UHFFFAOYSA-N 335.428 5.232 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC1(C)C 77496295 WMQPJEQWSULTAN-UHFFFAOYSA-N 349.434 5.065 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(OC(F)(F)F)c1 90665565 TUCYPINVBYCWPJ-KSSFIOAISA-N 348.368 5.281 30 20 EKED Cc1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)cc1C 118171171 HUFDYXMJADPWHH-AWEZNQCLSA-N 335.432 5.078 30 20 EKED Cc1cccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)C(C)(C)C)c1 237581754 OVSABUCBEDJQAN-UTKZUKDTSA-N 336.479 5.163 30 20 EKED C[C@H](/N=C(/O)C[C@H]1CCCC(C)(C)C1)c1ccc2c(c1)CC(O)=N2 328794490 SMSSLYYYUXWXTE-UONOGXRCSA-N 328.456 5.455 30 20 EKED CCC[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 431768092 CMEHPNFQBNVEAJ-NHCUHLMSSA-N 349.478 5.262 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1cccc(C2CC2)c1 449348240 KSLIGJBWOORCRN-KRWDZBQOSA-N 334.463 5.097 30 20 EKED Cc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1-c1ncco1 481997079 GJNGMSCBUWDZFB-OAQYLSRUSA-N 343.430 5.401 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Oc2cccnc2)cc1 487935562 NFKLUGIAYDUXDX-SJORKVTESA-N 343.430 5.157 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCc3c(Cl)cccc32)c1 507827156 QMVJTERSEYWYJX-LJQANCHMSA-N 326.827 5.122 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cccc(OCC)c2)cc1Cl 518786032 LYVIFABSAJJAPX-OAHLLOKOSA-N 345.870 5.154 30 20 EKED CC(C)(C)OCc1cccc(CNc2ccc(C#N)c(Cl)c2)c1 520319433 JKWFBDNMKOHVON-UHFFFAOYSA-N 328.843 5.139 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(C1CC1)C1CC1 530553096 VJDXJDJKMMDBFH-UHFFFAOYSA-N 326.484 5.096 30 20 EKED N#Cc1ccnc(N2CCC[C@@H]2c2cccc3ccccc23)c1Cl 553332318 XQMWPVHORQZEDW-GOSISDBHSA-N 333.822 5.101 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2cscc2C#N)cc1)c1ccccc1 572382941 LSRFYAHMBMZBJC-CQSZACIVSA-N 347.443 5.045 30 20 EKED Cc1ccc(-c2noc(CC3(C#N)CC3)n2)c(Sc2ccccc2)c1 590270900 GGTOCDQRIBJKBK-UHFFFAOYSA-N 347.443 5.043 30 20 EKED CCCC(=O)Nc1ccc(Cl)c(N[C@H](C)c2cccc(C#N)c2)c1 600852315 PCABSIKERMQKDE-CYBMUJFWSA-N 341.842 5.123 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(C(C)C)cc1 603755075 NRVUUHRCVLDUGL-UHFFFAOYSA-N 348.490 5.053 30 20 EKED N#CC1(CCCNc2ccc(-c3ccccc3)cc2F)CCOCC1 619586155 CSYRXSWAJJQQDO-UHFFFAOYSA-N 338.426 5.005 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C2CC2)C1 685089284 HZORZWLNSPQRNY-SFHVURJKSA-N 326.484 5.192 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccs3)s2)cc1 727974108 GJZBNPVXJHNTBE-KTKRTIGZSA-N 341.457 5.085 30 20 EKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 752393968 UOXBJHXCAHUNRN-FQEVSTJZSA-N 347.422 5.260 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](CCC)c2ccccn2)cc1 765734725 CQBYJULYZPDASI-OXJNMPFZSA-N 344.886 5.405 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1c(Cl)cc(F)cc1Cl 768901750 WUILNWJWRWUDKM-UHFFFAOYSA-N 332.202 5.009 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 776073829 ANBJMQFBOUQIMP-DOTOQJQBSA-N 348.471 5.132 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(N2CCCCC2)cc1 776796346 JCSUPDBIVBZHOG-QFIPXVFZSA-N 331.463 5.038 30 20 EKED CC(C)(C#N)CCCOC(=O)c1occc1CSc1ccccc1 782611047 LAGXWXZFSKXNJY-UHFFFAOYSA-N 343.448 5.059 30 20 EKED CC(C)n1nccc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 794930932 HLHOXPHANRJMHK-ZZXKWVIFSA-N 343.641 5.320 30 20 EKED FC(F)(F)c1cscc1C=NOc1ccccc1C(F)(F)F 811645954 GBKPGRBAIWSKQB-UHFFFAOYSA-N 339.260 5.199 30 20 EKED FC1(F)CCC(=NNc2nc(Cl)c(Cl)cc2Cl)CC1 842523358 ILUANZGPKXZWRQ-UHFFFAOYSA-N 328.577 5.019 30 20 EKED Cc1ccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 917028012 LKZPCBQQZZPSAQ-NRFANRHFSA-N 341.414 5.295 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)[C@H](C)c1cc2ccccc2s1 1776013550 FHSISUJBZBLKQB-LBPRGKRZSA-N 338.432 5.191 30 20 EKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)cc2)cc1 96721473 STOMUZBJXVJRBF-FQEVSTJZSA-N 347.462 5.225 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccccc1Oc1ccccc1 237445070 CSLNAHGEGZLWLS-OAHLLOKOSA-N 334.444 5.263 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(C(F)F)c1 280022367 JYCPMEQWMFHGKX-ZDUSSCGKSA-N 332.419 5.631 30 20 EKED CCc1nc(C)c([C@H](C)N[C@H](CCCC#N)c2ccccc2)s1 340436622 RXNYKOVNQOWYRD-WMLDXEAASA-N 327.497 5.100 30 20 EKED C=CCCc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 410361352 DMBHFZSVGAAUQD-QGZVFWFLSA-N 347.380 5.480 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(F)c(Cl)c1 468991532 LWLNFKWKMOXSCL-LBPRGKRZSA-N 334.847 5.485 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc2[nH]c(C)cc2c1 485331427 NUYFLFQDUPEZEW-UHFFFAOYSA-N 325.456 5.077 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(COC(C)C)c1 485335183 ZCWXEANMDWFIOX-UHFFFAOYSA-N 344.499 5.212 30 20 EKED CCCCN(CC)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517533595 XYPZQQGRHHSXBQ-UHFFFAOYSA-N 337.423 5.004 30 20 EKED C=CCOc1ccc(CNCc2oc3ccccc3c2C)cc1Cl 523738737 JIGYHPWDSFNNJD-UHFFFAOYSA-N 341.838 5.249 30 20 EKED C=CCCCNc1ccccc1CN(C)C(=O)c1cc2ccccc2o1 525359193 TXNKXBWWCBCCFI-UHFFFAOYSA-N 348.446 5.083 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1ccccc1SC1CCCC1)OCC 533692006 MTQJRXMDMXMPKF-QGZVFWFLSA-N 333.497 5.031 30 20 EKED C=C[C@H](CC(=O)N(C)[C@H](C)c1cc2ccccc2o1)c1ccccc1 535335439 FPBAXIBWCTXSDF-IAGOWNOFSA-N 333.431 5.312 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1)c1ccccc1 536182899 RDAGAUWIJRHXDX-CBGDNZLLSA-N 337.438 5.095 30 20 EKED C[C@H](NCc1ccc(CC#N)cc1)c1cc(F)c(Cl)cc1Cl 542255127 CZGRAEKICSUKAW-NSHDSACASA-N 337.225 5.049 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 552343083 ZKFWDHJQGMOUKR-MGPUTAFESA-N 338.476 5.418 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)CCCc2ccccc2Cl)cc1 581636556 DVKIQBWRZADNJF-UHFFFAOYSA-N 340.854 5.103 30 20 EKED N#Cc1ccc(CN2CCC[C@@H]2c2ccccc2C(F)(F)F)c(F)c1 728061672 XIYLBSBYFMEBTH-GOSISDBHSA-N 348.343 5.053 30 20 EKED O=C(/C=C/c1ccc(F)nc1)c1ccc(SC2CCCC2)cc1 777468789 WNHLBPPQYLUCNJ-VZUCSPMQSA-N 327.424 5.152 30 20 EKED C#CCCCCCC(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 779915489 MAMREPNZSUWHNS-UHFFFAOYSA-N 327.374 5.154 30 20 EKED C=CCC(F)(F)C(=O)Nc1cc(Cl)ccc1-c1ccc(C)o1 816546919 BOWSPSRDSSSQMU-UHFFFAOYSA-N 325.742 5.058 30 20 EKED FC(F)Oc1ccc(NN=C[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 853299098 JHUDJUDKAVBERM-WDEREUQCSA-N 336.304 5.054 30 20 EKED CC(=NNc1cccc(Cl)c1C)c1nc2ccccc2n1C(F)F 915051430 TZBVLHQOGFPMHF-UHFFFAOYSA-N 348.784 5.229 30 20 EKED COc1ccc(C)cc1C(=O)/C=C\c1csc(-c2ccsc2)n1 920064455 SVCXDGMELODPFA-PLNGDYQASA-N 341.457 5.085 30 20 EKED CC1(CNC(CCC(F)(F)F)CCC(F)(F)F)CC(F)(F)C1 926842463 RZRLNRFRRVLRDW-UHFFFAOYSA-N 341.286 5.065 30 20 EKED N#CCC[C@H](NCc1csc(-c2ccsc2)n1)c1ccccc1 130458268 BSXFJEBVCJPWCZ-KRWDZBQOSA-N 339.489 5.006 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SCCC(C)(C)C#N 289391559 LUGUPVZETBKRSA-LSDHHAIUSA-N 332.513 5.200 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1Cl 328806718 IAABDAWTMAJVGW-RBSFLKMASA-N 348.874 6.142 30 20 EKED N#Cc1ccc(NCc2cccc(C(F)F)c2)cc1C(F)(F)F 391156872 ZHJUVZVFJAKAGC-UHFFFAOYSA-N 326.268 5.127 30 20 EKED C[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)c(F)c1 426305820 DRYCDNFCBDYANR-BMIGLBTASA-N 334.847 5.140 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(C)(C)C)cc1 463013499 SHZPZEMZFJQTNH-LAUBAEHRSA-N 336.479 5.560 30 20 EKED C=CCCCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 470200626 NATCBPLFVDGIFF-INIZCTEOSA-N 325.374 5.115 30 20 EKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 477543444 PIRVSVPXJGFJRX-QGZVFWFLSA-N 349.478 5.330 30 20 EKED C=C(C)CN(C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 481289633 VBJVBMJVUAOLNL-NSHDSACASA-N 325.239 5.217 30 20 EKED CC(C)(C#N)CCCNc1cccc(COc2ccc(F)cc2)c1 506269188 PDCCYYFMMSQMDV-UHFFFAOYSA-N 326.415 5.147 30 20 EKED CCN(C(=O)CCc1ccc(C(C)C)cc1)[C@H](C)c1ccc(C#N)cc1 509574031 HQNFMHLVWBQXLG-GOSISDBHSA-N 348.490 5.224 30 20 EKED C=CCC[C@H](NCc1ncc(-c2ccc(C)cc2)o1)c1ccccc1 538256576 QZJZJUPRLDXHQI-FQEVSTJZSA-N 332.447 5.447 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cc(Cl)sc1Cl 553314612 QXGLYZPDDDVGLK-CQSZACIVSA-N 337.275 5.094 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 556203275 JBQLJQSEEAQBLB-AUUYWEPGSA-N 347.289 6.079 30 20 EKED COc1cc(CN[C@@H](C)c2ccc(-c3ccccc3)s2)ccc1C#N 577328673 HMLGXMWSEHBMSO-HNNXBMFYSA-N 348.471 5.146 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)cc1Cl 615468348 KNSLWKIOENECQR-UHFFFAOYSA-N 332.806 5.008 30 20 EKED CC(=NNc1cccc2cnccc12)c1cc(Cl)sc1Cl 728432249 POLPETNGSFUZFE-UHFFFAOYSA-N 336.247 5.439 30 20 EKED CC(=NNc1nccc2sccc12)c1ccc(SC(F)F)cc1 734979421 HBXINOJNWXNXIT-UHFFFAOYSA-N 349.431 5.447 30 20 EKED CCCCCCCCCC(=O)N1CC[C@@H](c2ccccc2OC)C1 737745129 GZRZIZQVICIBCZ-GOSISDBHSA-N 331.500 5.152 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1 739141840 FHJRPBXPKSHOLC-YJBOKZPZSA-N 345.446 5.056 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(Cl)c(Cl)c1 740764335 RPLDJXFZPKPHER-FPLPWBNLSA-N 328.198 5.438 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)cn1 753718312 WRINJIHETSKTDC-UTCJRWHESA-N 342.748 5.032 30 20 EKED C#CCCCCCC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 779821179 VBLXSROYMPAKRZ-ZDUSSCGKSA-N 326.267 5.097 30 20 EKED CCC[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797570779 KKIVYXSMSVQREY-CVEARBPZSA-N 340.492 5.201 30 20 EKED Cc1ccc(F)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915087285 RWMSMVODCYMIDM-OAQYLSRUSA-N 344.389 5.042 30 20 EKED C=CCc1ccccc1CNCCCCCCCCCCCC(=O)O 1776188769 NPGPBEHULWCZMP-UHFFFAOYSA-N 345.527 5.490 30 20 EKED CC(C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46706897 DZKYVBLHPTVQCH-AWEZNQCLSA-N 332.856 5.076 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCOc2ccccc21 189911419 LSQZFPCJNUKJSU-IBGZPJMESA-N 335.447 5.043 30 20 EKED CC(C)(C#N)CCCCN[C@H](CC(F)(F)F)c1ccc(F)cc1 278661980 HUEMJBUXMOQPAV-OAHLLOKOSA-N 330.369 5.129 30 20 EKED CC(C)[C@@H]1C[C@H](C/C(O)=N/[C@@H](C)c2ccc3ncsc3c2)CCO1 330121012 GRLWQOACECDGJW-VBQJREDUSA-N 346.496 5.155 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cnc2ccsc2c1 340450387 YAGKIKCVGIWCMD-MAUKXSAKSA-N 335.476 5.382 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(OCc2ccccc2)cc1 442863493 RJFNWOJGFAGQEW-XEVCZEQESA-N 348.490 5.246 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)Nc2ccc(C#N)cc2)cc1 462887976 MTOZGIGXXIMYIC-MRXNPFEDSA-N 328.415 5.407 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCC1CCCC1 463750770 NMHOBNZQOWGTQU-OAHLLOKOSA-N 330.497 5.237 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(F)cc(F)c1 475551234 XJEBUZBYCOPEKP-UHFFFAOYSA-N 344.405 5.138 30 20 EKED C=C(CNC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1 477066680 GANYRYWTFIBNEL-UHFFFAOYSA-N 348.368 5.016 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(-c2ccccc2)[nH]1 506046274 UASRNZUPUZGQGV-UHFFFAOYSA-N 345.446 5.181 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc(C#N)cc1 511417236 ZYDCAABTUPGOAN-LBPRGKRZSA-N 337.423 5.302 30 20 EKED C[C@H](Sc1cccc(F)c1C#N)c1nc2ccccc2n1C(F)F 518061696 OPWQETHDSHFOQI-JTQLQIEISA-N 347.365 5.295 30 20 EKED C=C[C@H](CC(=O)N1[C@@H](C)Cc2cc(F)ccc2[C@H]1C)c1ccccc1 537692589 JKRNICNKYBWPTH-GVDBMIGSSA-N 337.438 5.020 30 20 EKED CC(C)(CCC#N)CNC(=O)c1cc(-c2ccccc2)ccc1Cl 557997447 QGWDFWBBOAOTEP-UHFFFAOYSA-N 340.854 5.067 30 20 EKED C[C@H](NC[C@@H](C#N)CCC#N)c1ccc(-c2ccc(Cl)cc2)s1 580543414 XXOWJPRZUFEOHU-UONOGXRCSA-N 343.883 5.163 30 20 EKED C[C@H](Nc1cccc(C(F)F)c1C#N)c1ccc(OC(F)F)cc1 582330812 MREXWDRMEYUPIX-JTQLQIEISA-N 338.304 5.270 30 20 EKED Cc1cc(C)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 601135868 ZZSPPAMTJFUBJG-GFCCVEGCSA-N 330.478 5.012 30 20 EKED N#Cc1cc(Cl)ccc1SCc1nc2ccccc2n1C(F)F 610655293 YRFMOHZUQAEDHQ-UHFFFAOYSA-N 349.793 5.249 30 20 EKED N#Cc1cc(CS[C@@H](c2ccccc2)c2ccc(F)cc2)ccn1 610954400 TVRCEKKSMBGGEG-FQEVSTJZSA-N 334.419 5.115 30 20 EKED CC(C)(C#N)c1ccc(CN[C@H](c2ccc(F)cc2)C2CCC2)cc1 614174024 GAIPJWKEVCOCGL-NRFANRHFSA-N 336.454 5.258 30 20 EKED C=CC[C@@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccncc1 766019863 NMLWVVKPCXIRIB-IAGOWNOFSA-N 330.884 5.179 30 20 EKED C=CCCC[C@@H](c1ccccc1)c1nc(-c2ccccc2OC)no1 904266856 PBNKLPPPGWVOSL-KRWDZBQOSA-N 334.419 5.233 30 20 EKED N#CC1(c2nc(-c3ccc(-c4ccccc4)cc3)no2)CCCCC1 904551720 KZVXGGMSLNRGHQ-UHFFFAOYSA-N 329.403 5.129 30 20 EKED O=C(/C=C\c1cccc2c1OCCCO2)c1cc(Cl)ccc1Cl 917143147 CQIOBIMQSLAFBP-YVMONPNESA-N 349.213 5.051 30 20 EKED Cc1ccc(CCCC=NNc2ccc(Cl)c(C(=O)O)c2)cc1C 1776033663 OAZHSDLFIPZNAE-UHFFFAOYSA-N 344.842 5.076 30 20 EKED N#Cc1cccc(C(=O)Nc2ccccc2SCc2ccccc2)c1 15566139 BWJZSCUYKKAEAR-UHFFFAOYSA-N 344.439 5.103 30 20 EKED O=C(/C=C\c1cccc(/C=C\C(=O)c2ccccc2)c1)c1ccccc1 34688327 PSWLVTPAAJSQQT-RYOQUFEFSA-N 338.406 5.479 30 20 EKED C=CCN(Cc1cccs1)C(=O)CC1CCC(C(F)(F)F)CC1 182939481 OKIXTMKDKKNGHP-UHFFFAOYSA-N 345.430 5.022 30 20 EKED CC(C)Sc1ccccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 192618673 NNVWXABCBZVLRM-UHFFFAOYSA-N 338.476 5.241 30 20 EKED Cc1cccc([C@@H](Nc2ccc(Cl)cc2C#N)c2ccccn2)c1 301890607 NXEINPHGWQBKRL-HXUWFJFHSA-N 333.822 5.117 30 20 EKED C=CCOc1cccc(NC(=O)N(Cc2ccccc2)[C@@H](C)CC)c1 303640753 BDCJOABHCYTWTG-KRWDZBQOSA-N 338.451 5.084 30 20 EKED N#Cc1c(N=C(O)C2CCSCC2)sc2c1CCCCCC2 329415714 FLGWGRFELPCOIQ-UHFFFAOYSA-N 334.510 5.010 30 20 EKED CC1(C)CCC[C@H](CC(=O)N[C@H](CCCC#N)c2ccccc2)C1 352206559 NUEJLQWXOAXPPG-IEBWSBKVSA-N 326.484 5.144 30 20 EKED CC[C@H](N[C@@H](C)c1nc(-c2ccccc2)cs1)c1ccc(C#N)cc1 447581427 UKGVBKUMQFZNMO-KXBFYZLASA-N 347.487 5.484 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C 466248883 VVUHRVQOWZLXQV-VXGBXAGGSA-N 326.267 5.041 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCCc3sccc32)CC1 468048342 KJAQOCMWNSSRJH-MOMVYJMYSA-N 336.504 5.119 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(Cl)ccc1F 471123577 SLOAWNODFHEENX-UHFFFAOYSA-N 332.806 5.089 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC)CC1 475568579 NYLRTFDGEKZZNN-QGZVFWFLSA-N 328.500 5.583 30 20 EKED N#Cc1cccc(CN[C@@H](c2cccc3ccccc23)C(F)(F)F)c1 510401764 JVNKVCIYBFFRTB-IBGZPJMESA-N 340.348 5.105 30 20 EKED CCC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 514514381 IZDUPMIRILPVIP-LJQANCHMSA-N 335.451 5.151 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(-c2ccccn2)cc1 519675386 CIWPUQXHCYOQQI-UHFFFAOYSA-N 327.431 5.162 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cccc2ccccc12 520973398 AXUKNUSLUPVORS-UHFFFAOYSA-N 342.442 5.010 30 20 EKED C[C@H](c1cccc(C#N)c1)N1CCC[C@@H](c2nc3ccccc3s2)C1 527482129 PYKFHXDXHNGVDW-CRAIPNDOSA-N 347.487 5.109 30 20 EKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)cc1 536725631 NPJDZVIFTLUMIC-INIZCTEOSA-N 330.406 5.215 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1cccc(C#N)c1F 542727594 HMESICWGSPIBNX-UHFFFAOYSA-N 326.415 5.015 30 20 EKED N#CCCC[C@H](N[C@H](CCc1ccccc1)C(F)F)c1ccccc1 556203266 IXIUWIZXEHZDOT-VQTJNVASSA-N 342.433 5.278 30 20 EKED CC(C)(C)c1ccc(Cl)cc1NC(=O)c1cc(C#N)ccc1Cl 588989788 DSEBZKBQGWCOEF-UHFFFAOYSA-N 347.245 5.415 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccccc1 590115086 JTNBJRNYSLFOAA-INIZCTEOSA-N 345.805 5.036 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(Cl)cc1 609387251 VKZHFAVUCWNGQO-KBPBESRZSA-N 330.884 5.765 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1F 728813260 JFMCRGDVQYRBFL-HXUWFJFHSA-N 344.389 5.042 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)/N=C/c1ccccc1O 729150142 UBECOUHYVMIZCH-OVMKCGGTSA-N 340.423 5.143 30 20 EKED C#CCCOc1ccc(CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc1 733326384 ZQBWPPARIYVIPR-OAQYLSRUSA-N 339.454 5.105 30 20 EKED N#CCOc1ccc(Cl)cc1COc1ccc(Cl)cc1Cl 735231099 POEIHQFBXJPIFQ-UHFFFAOYSA-N 342.609 5.128 30 20 EKED COc1cc(C(C)=NNc2cccc3ccccc23)ccc1SC 747614223 HQEMKNXPYCDLES-UHFFFAOYSA-N 336.460 5.406 30 20 EKED CCNc1ccc(C#N)cc1NCc1nc(C2CCCCC2)cs1 766767091 CFYIUFNOVBBKQJ-UHFFFAOYSA-N 340.496 5.106 30 20 EKED CCCCCCCCC(=O)N1CC=C(c2ccc(Cl)nc2)CC1 773813554 ACHACILHGMODFQ-UHFFFAOYSA-N 334.891 5.101 30 20 EKED CC[C@@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(C#N)cc1 774224252 NVYSNUWNHJGQTE-WOJBJXKFSA-N 332.447 5.045 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1O 775513109 NVYOLURGBGYYEM-BDJLRTHQSA-N 349.261 5.373 30 20 EKED C[C@H](N[C@H](C)c1ccccc1O)c1ccc(-c2cccc(C#N)c2)cc1 783531992 GYQVNVIAEDWNBN-DLBZAZTESA-N 342.442 5.343 30 20 EKED C=CC[C@@H](OC(=O)C1CC(F)(F)C1)c1ccc(Cl)c(Cl)c1 797553196 FJYGAZXOKOQGFR-CYBMUJFWSA-N 335.177 5.199 30 20 EKED Cc1cccc(NC(=S)N[C@H](CCCC#N)c2ccccc2)c1C 814209763 DNXYEMDLHDBXAL-LJQANCHMSA-N 337.492 5.025 30 20 EKED C=CCCCC(=O)N(Cc1ccc2[nH]ccc2c1)Cc1cccs1 863623935 VODPGMUUHXDSFY-UHFFFAOYSA-N 338.476 5.115 30 20 EKED O=C(/C=C\c1cccc(Cl)c1)c1sccc1Br 915113735 TZZGAXZFNOAUOM-PLNGDYQASA-N 327.630 5.060 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccc(F)c3)cc2)cc1 1776129836 YLSAXTNGHHBQDG-MLPAPPSSSA-N 346.357 5.087 30 20 EKED C=CCc1ccccc1/C=C\c1nc2ccccc2c(C(=O)O)c1C 1776189171 ZJMHMKCOOPXDKN-YPKPFQOOSA-N 329.399 5.140 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(C(F)F)c1F 1776784074 WRNVODVKUFYQKW-AWEZNQCLSA-N 345.405 5.057 30 20 EKED CC(C)(NCc1ccc(F)cc1C#N)c1ccc(Cl)c(Cl)c1 303182439 KMWQWVKQYIOMQB-UHFFFAOYSA-N 337.225 5.029 30 20 EKED CCCCCCCC(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 303332943 UBICSVVRDVXUOC-OAHLLOKOSA-N 330.497 5.348 30 20 EKED OC(=Nc1csc(-c2ccncc2)n1)C12CC3CC(CC(C3)C1)C2 329818797 OWRURBQSNLIPJE-UHFFFAOYSA-N 339.464 5.010 30 20 EKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(C#N)cc1 439579631 ZCVYWJYNJJZIRN-INIZCTEOSA-N 339.398 5.395 30 20 EKED N#CCc1ccc(NCc2csc(C3CCCC3)n2)c(Cl)c1 453131717 PQMPHQXURKJVGL-UHFFFAOYSA-N 331.872 5.132 30 20 EKED CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458799930 KMOOSVLEQQERIS-YSIASYRMSA-N 341.499 5.032 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2c[nH]c3c(CC)cccc23)CC1 466820184 YFKGBRRIQHRTFO-MRXNPFEDSA-N 338.495 5.039 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 488380208 ORPLOAXDIONXEC-HOTGVXAUSA-N 332.513 5.458 30 20 EKED C[C@H]1CCCCN1Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1 540700886 NUNKQPXSJZFPHL-ZWKOTPCHSA-N 333.479 5.106 30 20 EKED N#CCSCCCS[C@H](c1ccccc1)c1ccc(F)cc1 549197388 SSNOPYWMAXQDON-GOSISDBHSA-N 331.481 5.295 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Oc2cccc(F)c2)cc1 588152741 RBFWBXRDAMEMRI-UHFFFAOYSA-N 326.371 5.031 30 20 EKED CC(C)Oc1cccc([C@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)c1 595415299 LNIOHEUVWFTGBA-LIRRHRJNSA-N 328.843 5.043 30 20 EKED C[C@@H](c1cccc(C(F)(F)F)c1)N(Cc1ccc(C#N)cc1)C1CC1 603940616 WOEFOUFHXZHDGN-AWEZNQCLSA-N 344.380 5.303 30 20 EKED Cc1ncccc1/C=C/C(=O)c1ccc(-c2ccccc2Cl)s1 728785603 IANKSMBLBNWDKE-CMDGGOBGSA-N 339.847 5.668 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1cnc(C(C)(C)C)s1)C2=O 736433361 DNWDCCGZGABRHV-RAXLEYEMSA-N 343.517 5.375 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(Cl)cc1Cl 740764332 ROJASIZSLFAUQD-BQYQJAHWSA-N 328.198 5.438 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(C#N)s2)cc1 749006437 VGTCCNWPWAIAKB-SEYXRHQNSA-N 345.423 5.191 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1O 775513120 NVYOLURGBGYYEM-BZNIZROVSA-N 349.261 5.373 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(C#N)c(F)c3)cs2)cc1 776725788 GDZITKZQJBXJLM-CMDGGOBGSA-N 348.402 5.025 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)n1 797096193 FZHVSQIKYJMYLK-CAOSSQGBSA-N 330.497 5.049 30 20 EKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(CCC#N)cc1 932581490 OVDDIVVTOMFERZ-AWEZNQCLSA-N 341.842 5.021 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(Br)c1 37284482 CXFQXAJPMXRDTH-FZKQIMNGSA-N 343.268 5.123 30 20 EKED Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)n1[C@H]1CCC[C@H](C)C1 245647457 UIAKLCXTDCJOMM-IYOUNJFTSA-N 340.496 5.063 30 20 EKED C=C(C)COc1cccc(NC(=O)CCCc2c[nH]c3ccccc23)c1 303156508 GWPNXJZJYQNEPR-UHFFFAOYSA-N 348.446 5.084 30 20 EKED O/C(Cc1coc(-c2cccs2)n1)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329160153 YBCNBORBSBPLAH-RRFJBIMHSA-N 344.480 5.261 30 20 EKED CC1(C)CCC[C@@H](CC(=O)N[C@H](CCCC#N)c2ccccc2)C1 352206561 NUEJLQWXOAXPPG-PKOBYXMFSA-N 326.484 5.144 30 20 EKED COc1cc(Cl)ccc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 421855925 NISGUBIEZQDNSX-KXBFYZLASA-N 342.870 5.434 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H]1c1nc2ccccc2s1 433952854 HZZCZPLLUSFPOT-KSSFIOAISA-N 333.460 5.066 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 471165063 LBRLKFHBYRZFTA-GFCCVEGCSA-N 341.282 5.028 30 20 EKED N#Cc1cc(NCc2nc(-c3ccccc3Cl)cs2)ccc1F 478361605 NMXWUSDLHDZCRD-UHFFFAOYSA-N 343.814 5.086 30 20 EKED Cc1c(Cl)cc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 480407955 RKJUPPQXRCOZAR-NSHDSACASA-N 348.233 5.056 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C2CC2)c(C)c1 481909270 HWAQZJDIZRUUQR-UHFFFAOYSA-N 347.462 5.188 30 20 EKED N#Cc1cnc(N2CCC[C@H]2c2cccc3ccccc23)c(Cl)c1 513610172 TZKIYOMDFSFDGI-IBGZPJMESA-N 333.822 5.101 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 524882544 YPMYCFKEJDJYFN-HXOBKFHXSA-N 344.433 5.332 30 20 EKED Cc1oc(-c2ccccc2)nc1CS[C@H](C)c1ccc(C#N)cc1 609825087 FVSGSPRGHNCNPG-OAHLLOKOSA-N 334.444 5.516 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCc2cc(Cl)cc(Cl)c21 618804280 KNAICWNBOMJIJR-ZWKOTPCHSA-N 343.257 5.129 30 20 EKED C#Cc1cccc(N(C(=S)Nc2ccc(C(C)C)cc2)C(C)C)c1 728226896 NPDWKYQVANOEEE-UHFFFAOYSA-N 336.504 5.403 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)C(C)C 729887855 DIRZSCGAKYLVOL-NVXWUHKLSA-N 340.492 5.367 30 20 EKED CC[C@@H](C#N)OC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 753423718 GSZZROMZNCKZIR-QMMMGPOBSA-N 347.745 5.032 30 20 EKED C[C@@H](c1ccccc1)N(CCCC(C)(C)C#N)Cc1ccccc1O 776012017 WAQNATAMSCQHQF-SFHVURJKSA-N 336.479 5.285 30 20 EKED O=C1/C(=C/c2ccc(Cl)s2)CCc2ncc(C(F)(F)F)cc21 777469306 BAUSFPGFJUYQHK-VMPITWQZSA-N 343.757 5.028 30 20 EKED CC(C)(C#N)CCCOC(=O)c1ccccc1SCc1ccco1 782587848 ZMRVJSUWWDBGQV-UHFFFAOYSA-N 343.448 5.059 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3F)o2)s1 790224392 BFTMZGWBSLZOPX-QPJJXVBHSA-N 341.338 5.054 30 20 EKED CC(C)c1ccc(N2Cc3ccc(N[C@@H]4CC[C@H](C#N)C4)cc3C2)cc1 799718833 AKRYIODLKXMAMX-LAUBAEHRSA-N 345.490 5.434 30 20 EKED CCCC[C@@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 810158504 NPPHADVHRMIPKV-UTKZUKDTSA-N 349.478 5.384 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2ccc(Cl)s2)c(C(F)(F)F)c1 811685595 WWXVQHKZPIPION-ONEGZZNKSA-N 341.741 5.188 30 20 EKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1cc(C)sc1C 916286811 WSOUARMXHBNRBV-UHFFFAOYSA-N 347.793 5.268 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 47840326 CUYSUFIISIDOSW-IBGZPJMESA-N 338.863 5.152 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 120314564 VCHRFLMWLOBFBO-UHFFFAOYSA-N 348.352 5.064 30 20 EKED Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 124125978 IEHDRQFTQUXYCU-QAPCUYQASA-N 346.455 5.099 30 20 EKED CCCc1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 207595152 ZBHSXEMMGZPQLT-KAMYIIQDSA-N 333.431 5.218 30 20 EKED CC(C)c1ccc([C@H](Nc2ncccc2C#N)c2cccs2)cc1 302804356 JHFSMYAZIUAOOM-IBGZPJMESA-N 333.460 5.340 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 303207054 ZHPPOEPUXYMOHR-OAHLLOKOSA-N 343.854 5.235 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccoc2C2CC2)cc1 409507107 KWKPEVQBRMONSF-UHFFFAOYSA-N 344.370 5.073 30 20 EKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1cccc(C#N)c1C 432277532 QUGYKKHXJZCOBO-HXUWFJFHSA-N 335.451 5.036 30 20 EKED N#CCC[C@@H](NC(=O)CCCCCc1cccs1)c1ccccc1 439674999 REKIBHHSLPJVFC-LJQANCHMSA-N 340.492 5.012 30 20 EKED CC[C@H](N[C@@H](CC(F)(F)F)c1ccccc1C)c1ccc(C#N)cc1 447576858 CYTUTTNBXIYPBW-OALUTQOASA-N 346.396 5.601 30 20 EKED N#Cc1cc(Oc2ccc(NCc3sccc3Cl)cc2)ccn1 515465757 LILRIIISWMCLFW-UHFFFAOYSA-N 341.823 5.073 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)c1cccc(C)c1 523484546 OWVKSNIAFONVTG-AWEZNQCLSA-N 333.884 5.028 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1 532206869 KZOFWNMQIYMRTK-ZIAGYGMSSA-N 328.843 5.022 30 20 EKED N#Cc1ccc(CN[C@H](c2cccc(Cl)c2)C2CCCCC2)o1 538413787 RJABIHRAVQIJRI-IBGZPJMESA-N 328.843 5.216 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 539047622 UVZGTIPLFWCBLN-UTKZUKDTSA-N 338.520 5.883 30 20 EKED C[C@H](Nc1ccc(Cl)cc1OCC(F)F)c1cccc(C#N)c1 600852983 CILGDSJMHGTDHC-NSHDSACASA-N 336.769 5.029 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Cl 609376499 BBJGGKSMBBVBJO-LBPRGKRZSA-N 344.867 5.153 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(OC(C)(C)C)cc1 618805638 OTVAYBAMZSYQQD-YCRPNKLZSA-N 334.463 5.074 30 20 EKED C[C@H](N[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1cccc(C#N)c1 618984889 KKSDITFAOXVWJB-GVAFMPQTSA-N 330.884 5.116 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1cccc(Cl)c1Cl 734980018 GOFYFNCYFKQQMD-CMDGGOBGSA-N 331.198 5.208 30 20 EKED Cc1cc(C)cc(CNCc2cccc(-c3ccc(C#N)s3)c2)c1 740011765 SKZSNGYKTLUOAK-UHFFFAOYSA-N 332.472 5.193 30 20 EKED Cc1ncsc1/C=C1/CC(C)(C)C/C(=C\c2scnc2C)C1=O 742434115 DVNCXKCFHRKKOK-FUJGBLOQSA-N 344.505 5.073 30 20 EKED Cc1ccc(C)c(SCc2cccc(C(=O)O[C@@H](C)CC#N)c2)c1 744136054 VWRDYPXTTHNJEY-INIZCTEOSA-N 339.460 5.055 30 20 EKED COc1ccccc1/C=C/C=C\C(=O)c1cc(Cl)sc1Cl 744868986 OBUSCVYAEFYJSA-XATRDHJGSA-N 339.243 5.516 30 20 EKED CC(C)C[C@H](C)N(C(=O)c1cccc(C#N)c1)c1ccc2[nH]ccc2c1 750825144 AKERSAMPGXWFCN-INIZCTEOSA-N 345.446 5.121 30 20 EKED CC(/C=C\C(=O)c1sccc1Br)=C/c1ccccc1 750904193 GQDWZUNDRSMDMM-MQEUWQHPSA-N 333.250 5.353 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 772161268 GSJFYNZPDQPWGB-VGOFRKELSA-N 340.426 5.084 30 20 EKED N#Cc1ccccc1CNc1ccccc1SCc1ccccc1 780653916 VKLCCCBQAOHHMT-UHFFFAOYSA-N 330.456 5.463 30 20 EKED CC(=NNc1cc(Cl)cc(Cl)c1)c1c(C)nn(C(C)C)c1C 790201299 BJYZGLBHFVONOR-UHFFFAOYSA-N 339.270 5.224 30 20 EKED C[C@@H](CC(=O)OCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 798877343 YLEVQNPVTNCYRR-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCC1CCC(CCC)CC1 1776783376 WTBDJCSEOWNHKZ-CTWPCTMYSA-N 325.537 5.386 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(F)c1Cl 80172197 CQMPALLVWLQYNW-LLVKDONJSA-N 348.830 5.126 30 20 EKED CCSc1ccc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 180541577 SDCDLJXFVPSIGH-HOTGVXAUSA-N 340.492 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccccc1 191467105 ZLYHIPUWSCYCGH-QGZVFWFLSA-N 336.479 5.763 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](OCC)c1ccccc1 298600992 NDHJEERPGRJVOB-OAQYLSRUSA-N 337.463 5.255 30 20 EKED C[C@@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)cc1 311227856 YESSSAMMNHNGRQ-QGZVFWFLSA-N 328.415 5.310 30 20 EKED CC(C)c1nc2cc(N[C@H](C)c3ccc(OCC#N)cc3)ccc2o1 326854018 QESSHCBRQQCEHQ-CQSZACIVSA-N 335.407 5.027 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)c(F)c(F)c1 340450339 MMSVDIXPYCFBIN-SCLBCKFNSA-N 332.369 5.190 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 447559788 ASRYMZWWYOCKLF-SCLBCKFNSA-N 332.369 5.379 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(F)c(Cl)c1 517461645 ZERIBAOGCLCTGO-STQMWFEESA-N 348.874 5.904 30 20 EKED C=CCCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 523273114 UFVOHXRJKXIZLO-SFHVURJKSA-N 334.246 5.165 30 20 EKED C=CCC[C@H](NCc1cnccc1C)c1ccc(C(F)(F)F)cc1 526982116 PDVYJMYPYLKNFV-SFHVURJKSA-N 334.385 5.206 30 20 EKED CC(C)(C)c1cc(NC(=O)[C@@H]2CCCc3sccc32)c(C#N)s1 539173179 APRPEBRLBGKREU-GFCCVEGCSA-N 344.505 5.037 30 20 EKED C[C@@H](N[C@H](C)c1cscn1)c1ccc(-c2cccc(C#N)c2)cc1 543961458 KGPGDZXNLFKCCX-HUUCEWRRSA-N 333.460 5.094 30 20 EKED CCCCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](C)c1ccc(C)o1 590855330 CPWAUEWMYPYLDR-INIZCTEOSA-N 339.439 5.049 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NC2CCC(C#N)CC2)cc1 602562891 KDQDAFRZJQEZMF-VXESANQCSA-N 334.463 5.095 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NCc1ccc(N(C)CCC#N)cc1 732820299 HVDNBXIEKMVHOP-HSZRJFAPSA-N 349.522 5.222 30 20 EKED COc1cc(/C=C2\C(=O)c3ccsc3S[C@H]2C)ccc1SC 742436231 HNZSPFDLYOSZBW-AAIQCTMTSA-N 348.514 5.239 30 20 EKED Cc1c(C(=O)/C=C\c2ccc(Cl)c([N+](=O)[O-])c2)oc2ccccc12 747138451 DMDNXSBAQSFALY-CLFYSBASSA-N 341.750 5.199 30 20 EKED Cc1ccc(CCCCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747198822 LDJQRJFGVAROGU-KRWDZBQOSA-N 340.492 5.164 30 20 EKED CC(=NOCc1ccc(F)cc1)[C@@H](C)c1nc2ccccc2s1 758142877 MRGUDCFHYVACAB-GFCCVEGCSA-N 328.412 5.132 30 20 EKED CCC(CC)(CC)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 761049540 XVSBZHIFOKIXGH-LBPRGKRZSA-N 334.872 5.342 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2cnn(C(C)C)c2)cc1 765948043 YJYUIQXREUOLDZ-HZPDHXFCSA-N 347.890 5.007 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2cccnc2)C2CC2)cc1 773119282 ODJNUMNFBPNLEQ-FOIQADDNSA-N 342.870 5.015 30 20 EKED CC(C)n1nccc1/C=C\C(=O)c1ccc(Cl)c(C(F)(F)F)c1 794947033 SNABCTQTGVVLTD-XQRVVYSFSA-N 342.748 5.032 30 20 EKED N#C[C@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2ccccc2s1 798814514 OSMFHKCYLSZPLM-BDVYOWHSSA-N 346.455 5.056 30 20 EKED O=C(/C=C/c1cccc(-c2cccnc2)c1)c1nccc2ccccc12 811699292 QMXPMGWSTFSNIU-ZHACJKMWSA-N 336.394 5.193 30 20 EKED N#CCCCCC(=O)O[C@@H](c1ccccc1)c1ccc(Cl)cc1 847635001 UTFIVNBTTPQYKR-IBGZPJMESA-N 327.811 5.057 30 20 EKED C=CCCCCC[C@@H](C)N[C@@H](C(=O)O)c1cccc2ccccc12 902565141 JSCJEUUXKPGDKJ-OXQOHEQNSA-N 325.452 5.080 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(F)cc3F)cs2)cc1 918712660 LSHXZXMDIHFCAU-CLFYSBASSA-N 341.382 5.293 30 20 EKED O=C(O)c1ccccc1NN=C1CCC[C@@H](c2cccc(Cl)c2)C1 1776030716 INBIZZWPDSTIBF-CQSZACIVSA-N 342.826 5.164 30 20 EKED CC(C)(C)[Si](C)(C)N(C=C1C=CC(=O)C=C1)c1ccc(F)cc1 2048529420 WMUAMERVQAEDEM-UHFFFAOYSA-N 329.491 5.216 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(C#N)c1 181887050 CTQHMWDWOZPPGB-ZHRRBRCNSA-N 330.406 5.138 30 20 EKED Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)n1[C@@H]1CCC[C@H](C)C1 245647462 UIAKLCXTDCJOMM-PMUMKWKESA-N 340.496 5.063 30 20 EKED O=C1/C(=C\c2cccnc2Cl)CCC/C1=C/c1cccnc1Cl 255658390 MBFQUDXGLKJACY-MIMPSMLTSA-N 345.229 5.003 30 20 EKED CCCCCCCC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 303396769 PTOYWDCNSBJOGI-CQSZACIVSA-N 327.255 5.035 30 20 EKED CCN(Cc1ncc(-c2ccc(C)cc2)o1)[C@@H](C)c1ccc(C#N)cc1 441241778 ZBYAGASUJRSCJD-KRWDZBQOSA-N 345.446 5.105 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 464537395 XHQOKGAOKPKJNR-CQSZACIVSA-N 336.460 5.504 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc([C@@H](C)OC)c1 471293376 SZFMGVGEFZGFIP-QGZVFWFLSA-N 338.451 5.004 30 20 EKED N#C[C@@H]1CC[C@@H](N[C@H](c2ccccc2)c2cccc3ccccc23)C1 471590725 OCARMYZUQOQGSD-HCLVMJGWSA-N 326.443 5.211 30 20 EKED C=CCCC1(C(=O)N[C@@H](C)c2ccc(-c3ccccc3OC)cc2)CC1 476123935 XJNZATJIOISPCZ-KRWDZBQOSA-N 349.474 5.286 30 20 EKED COc1ccc(Cl)c(CNc2ccccc2SC[C@@H](C)C#N)c1 479469582 HRQGVSSIDMHTPD-ZDUSSCGKSA-N 346.883 5.212 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cc(C)cc1C 479777186 OAKCYYFSMYDAGW-UHFFFAOYSA-N 348.899 5.547 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 480670814 MFPQXTGTWOYCGT-BFUOFWGJSA-N 346.377 5.149 30 20 EKED C=C(C)COc1cccc(NC(=O)Nc2cccc(SC)c2)c1 502427143 ULFZFTQKLDKVBZ-UHFFFAOYSA-N 328.437 5.007 30 20 EKED CCc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 511943506 OKIVERARFQXBCC-QGZVFWFLSA-N 341.458 5.033 30 20 EKED C=CCCCCCN(C)C(=O)c1ccc(C)c(Oc2ccncc2)c1 523512765 RBWZPCBNRAOXRH-UHFFFAOYSA-N 338.451 5.001 30 20 EKED C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)c(F)c1 540708564 ZLCKNHWKGHVFAX-DJJJIMSYSA-N 328.406 5.274 30 20 EKED N#Cc1ccc(F)c(CSCc2c(Cl)ccc3cccnc23)c1 609236498 LXCPCRLQQCRQQS-UHFFFAOYSA-N 342.826 5.332 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)c(Cl)c1 615373200 FACVYMMPFLBEHK-UHFFFAOYSA-N 332.806 5.008 30 20 EKED O=C(/C=C/c1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1 727975421 TWVKWUHAHQKNAW-LZCJLJQNSA-N 330.227 5.019 30 20 EKED Cc1ccc(-c2ncc(/C=C3\Cc4c(F)cccc4C3=O)s2)cc1 734304063 DFLFZHNFJOHXQC-NTEUORMPSA-N 335.403 5.080 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1cccc(Cl)c1Cl 734981301 PLYONVHBUAQCBG-GQCTYLIASA-N 327.594 5.249 30 20 EKED C#CCCCNC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 742786684 ITPHFUYVALZEGP-UHFFFAOYSA-N 346.666 5.005 30 20 EKED N#CCOc1ccc(CSCc2ccc(C(F)(F)F)cc2)cc1 742973247 KJJXLWPRYBZHFX-UHFFFAOYSA-N 337.366 5.041 30 20 EKED CC(C)c1ccc([C@@H](NCc2ccc(OCC#N)cc2)C(C)C)cc1 743767962 PIFRRVPXGGSSMK-QFIPXVFZSA-N 336.479 5.199 30 20 EKED CC(C)c1cccc(NC(=S)N(c2cccc(C#N)c2)C(C)C)c1 749766083 AQKWWJPKEZMVMB-UHFFFAOYSA-N 337.492 5.293 30 20 EKED CCCCCCCCCC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 765328986 VJBMNSHGGZYLQC-WOJBJXKFSA-N 331.500 5.164 30 20 EKED O=C(/C=C\c1cocn1)c1ccc(Oc2ccc(F)cc2)cc1Cl 790222679 DRVGHXHBDBDJHQ-BAQGIRSFSA-N 343.741 5.156 30 20 EKED C/C(=C/c1ccc(C)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567835 MRTLNRBRQBVWFK-SCOADAFUSA-N 338.476 5.029 30 20 EKED CC[C@@H](C)c1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776034036 ILVMTDHFRLVEKK-GFCCVEGCSA-N 344.842 5.388 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(F)c(C(=O)O)c1 1776064316 HXPPOLKPZKLVAI-DYVFJYSZSA-N 348.462 5.554 30 20 EKED CC(C)(CCC#N)CN(Cc1cccc(-c2cccnc2)c1)C1CC1 93818213 HZWNSWPIHOCCLF-UHFFFAOYSA-N 333.479 5.043 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CCCCCCC1 217050038 BEUYPEPHMBRSSH-OAHLLOKOSA-N 345.512 5.315 30 20 EKED CCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 302979500 CRZUYWWQQMQHFP-WFASDCNBSA-N 346.883 5.466 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1Cl 328806425 IAABDAWTMAJVGW-QLFBSQMISA-N 348.874 6.142 30 20 EKED CCc1nc(N[C@H](CCCC#N)c2ccccc2)c2ccsc2n1 431492308 CBSGWWDMQDPNHP-MRXNPFEDSA-N 336.464 5.101 30 20 EKED N#CC1CCC(CN[C@@H](Cc2ccccc2F)c2ccccc2)CC1 442851715 GECQPCAPNRDPLV-IRZJEQJZSA-N 336.454 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C)c1Cl 476155890 PZYFRQJXVPZTMW-UHFFFAOYSA-N 341.882 6.061 30 20 EKED CC(C)(C#N)c1ccc(C(=O)N2CCCC3(CCCCCC3)C2)cc1 476189538 JUXDSRDBSVZHSJ-UHFFFAOYSA-N 338.495 5.064 30 20 EKED Cc1oc2ccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)cc2c1C 476779431 OBCNECQMIQKMLU-UHFFFAOYSA-N 332.403 5.103 30 20 EKED C[C@@H]1CCC[C@H](CC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 520187306 HUDWNCPOWIRHPU-OAGGEKHMSA-N 330.497 5.236 30 20 EKED C=CCCC[C@H](C)NC(=O)c1occc1CSc1ccccc1 537228646 LHNYJMSQYCXIGG-HNNXBMFYSA-N 329.465 5.047 30 20 EKED COCc1ccccc1/C=C(\C)CN[C@H](CCCC#N)c1ccccc1 556908328 MACVMUASRCJUED-WNLUNTPQSA-N 348.490 5.261 30 20 EKED CC[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 561129865 CKWINSOJHJBVOA-CVEARBPZSA-N 330.884 5.391 30 20 EKED C=CCCC(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 588037228 BMVVIPBCJABUGO-LLVKDONJSA-N 331.403 5.501 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc2ccncc2s1 595025663 JIJOGBNBHCTETI-CQSZACIVSA-N 337.448 5.152 30 20 EKED CCc1c([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)oc2ccccc12 618802803 FUXWBVGQOUJUFU-VLIAUNLRSA-N 330.431 5.205 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 734083574 PVNAILNWYQJLSV-UKRRQHHQSA-N 344.455 5.218 30 20 EKED Cc1nn(C(C)C)cc1/C=C/C(=O)c1ccc(OC(C)C)c(Cl)c1 789157661 PFABSRUEOLKLRJ-SOFGYWHQSA-N 346.858 5.109 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 63388599 TYJJSXDMWOSNSD-UHFFFAOYSA-N 347.462 5.076 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)OC1CCCC1 189894598 TYWPNKOZXFCCSY-IBGZPJMESA-N 329.484 5.215 30 20 EKED CC(C)(C#N)CCCCSc1nnc(-c2cc3ccccc3o2)o1 277697102 MGRHHUOJNSGBOP-UHFFFAOYSA-N 341.436 5.295 30 20 EKED CCCC[C@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 289628311 PFGAQNOTHSDJGE-GJZGRUSLSA-N 333.501 5.123 30 20 EKED CCc1cc2c(N[C@H](CCCC#N)c3ccccc3)ncnc2s1 431512939 REAQVJCLBGNMKL-QGZVFWFLSA-N 336.464 5.101 30 20 EKED CN(CC(C)(C)C#N)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 455307983 JGCOYAOKXKQFOF-UHFFFAOYSA-N 341.842 5.020 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 467985286 SFVGWDZOPGQUHF-SFHVURJKSA-N 339.401 5.014 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@](C)(CC)C1 475563662 JMJYQJSVEHYVKN-OAQYLSRUSA-N 328.500 5.583 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)NCC(C)(C)CCC#N 480044752 KOFPFQWQVZBFCG-UHFFFAOYSA-N 343.858 5.253 30 20 EKED CC[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 487519364 ZIMNTFRGTUTFHZ-RXVVDRJESA-N 334.463 5.122 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(-c2nc(C)co2)c1)c1ccccc1 489707634 AJWMDJABCVKBIA-FQEVSTJZSA-N 346.430 5.339 30 20 EKED CC(C)[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512643753 YDXYQNLQVUIHFG-BUXKBTBVSA-N 332.369 5.023 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 516984700 QTHRXQQXUCWSQL-HNAYVOBHSA-N 344.405 5.374 30 20 EKED CCC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 524258550 VECNVDUSRSDYLY-UHFFFAOYSA-N 349.434 5.004 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1sc(C2CCCCC2)nc1C 526069768 LMOZPHZYKHMTFP-UHFFFAOYSA-N 347.528 5.044 30 20 EKED C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)c1cccc(C#N)c1 539495387 OKSSTNQLSLACPO-FDDCHVKYSA-N 326.443 5.193 30 20 EKED N#CCCC[C@@H](NCc1cccc(Cl)c1Cl)c1ccccc1 556908058 IFTVMLLWMVUBTP-QGZVFWFLSA-N 333.262 5.518 30 20 EKED N#C[C@H](C(=O)c1cccc(C2CCC2)c1)c1nc2ccccc2s1 566948578 LTVBZPHCWSMRHK-MRXNPFEDSA-N 332.428 5.054 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)CCCCCC#N 588154971 SKDPUJUWLBSDDQ-UHFFFAOYSA-N 344.524 5.832 30 20 EKED N#Cc1ccc(F)c(CSCc2csc(-c3ccsc3)n2)c1 609236385 WYOBDGDFVOUJJL-UHFFFAOYSA-N 346.477 5.316 30 20 EKED Cc1nc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)s1 611367545 JHVSTILLLCNGGA-CQSZACIVSA-N 347.487 5.149 30 20 EKED Cc1ccc(C)c(NC(=S)Nc2ccccc2SCCC#N)c1 730953350 VSDHYXPLLNMPQE-UHFFFAOYSA-N 341.505 5.118 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2cccc(C#N)c2)o1 734304603 PLYYUGBHOHRXIO-NTMALXAHSA-N 331.346 5.162 30 20 EKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2ccc(C)s2)ccc1OC 749450986 DGOLRXTZZQKYEG-FNOHHLHBSA-N 330.449 5.139 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)s1 758435023 YRMMTEQYPJZQIC-SREVYHEPSA-N 334.444 5.225 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c(F)c1 781107820 KTYBOZVSSNGXRO-CLFYSBASSA-N 333.387 5.322 30 20 EKED CC(C)c1ccc(-c2ncc(CSCCO[C@@H](C)C#N)s2)cc1 802752077 OBLZTDGNPKUBRR-AWEZNQCLSA-N 346.521 5.095 30 20 EKED C[C@H](OC(=O)CCCCCC#N)c1ccc(SC(F)(F)F)cc1 805916200 SSZOJMYSFJSINU-LBPRGKRZSA-N 345.386 5.377 30 20 EKED CC(/C=C\C(=O)c1cccc(C#N)c1)=C\c1ccccc1OC(F)F 811686869 BJZZVQXIRBGEIK-TVFNDYRWSA-N 339.341 5.002 30 20 EKED CCc1c(C(C)=NNc2ncccc2C(F)(F)F)oc2ccccc12 915050233 HQHOJNTVKJKQDS-UHFFFAOYSA-N 347.340 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccncc1)C1CC1 931058646 CGRBMZLBVOWIBS-FQEVSTJZSA-N 349.478 5.206 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 90664941 HUUTWZVLPTVYKW-KBXCAEBGSA-N 332.369 5.401 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1cccc(C#N)c1 177112895 HQIVYSDLXISCLN-OAHLLOKOSA-N 338.476 5.109 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(SCCCC(C)(C)C#N)o1 177290829 FZNFQDKTBZGFTH-HNNXBMFYSA-N 329.469 5.034 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C)ccc1C 479764650 HJDCNHOCLMGQTO-UHFFFAOYSA-N 334.872 5.238 30 20 EKED CCCN(CCC)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510653179 ZQNWJOICSCWGBK-UHFFFAOYSA-N 337.423 5.004 30 20 EKED N#Cc1ccnc(N2CCC[C@H]2c2cccc3ccccc23)c1Cl 553332319 XQMWPVHORQZEDW-SFHVURJKSA-N 333.822 5.101 30 20 EKED C[C@H](N[C@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 553398215 PPTJOSPZVLJVJD-KSFYIVLOSA-N 346.861 5.652 30 20 EKED CC(C)OCc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 583964100 SSDXNPVLNAHGGN-UHFFFAOYSA-N 348.368 5.114 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc3oc(C4CC4)nc3c2)cc1 594495104 MBCRVLXZXPCIQB-UHFFFAOYSA-N 331.419 5.118 30 20 EKED C[C@H](SCc1c(F)c(F)c(F)c(F)c1F)c1ccc(C#N)cc1 735676382 WTHYEGSGWBSFNO-QMMMGPOBSA-N 343.320 5.248 30 20 EKED CCCCn1nc(C)c(C=NNc2cccc3ccccc23)c1Cl 747060476 SMZOOJMGCGWXDG-UHFFFAOYSA-N 340.858 5.244 30 20 EKED C=CC[C@H](C(=O)Oc1ccc(-c2c(C)noc2C)cc1)c1ccccc1 759906803 WWZUCGSKSCDIIZ-FQEVSTJZSA-N 347.414 5.224 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCc1ccsc1 783386549 WOULOBHJUQXEEB-UHFFFAOYSA-N 339.913 5.001 30 20 EKED N#CC[C@@H](CC(=O)O[C@H]1CCc2sc(Cl)cc21)c1ccccc1 796768411 BUDQMKSTDTVHKB-ZFWWWQNUSA-N 345.851 5.020 30 20 EKED C/C(=C\c1ccc(C)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567832 MRTLNRBRQBVWFK-DKGMDFAASA-N 338.476 5.029 30 20 EKED CC(C)(C)c1ccc(C=NOCc2coc(-c3ccccc3)n2)cc1 849384457 SOBPXKMOCCQHII-UHFFFAOYSA-N 334.419 5.190 30 20 EKED CCCC[C@@H](CC)CNC(=S)N(CC)[C@@H](C)c1ccc(C#N)cc1 920993237 ALMRYYGFCWTKGY-DLBZAZTESA-N 345.556 5.032 30 20 EKED CCCCCCCC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 104983975 MGTRSGZJVKEBIL-MRXNPFEDSA-N 330.497 5.320 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1csc(C2CC2)n1 134853435 LJLYHXKANDFUJM-GFCCVEGCSA-N 329.494 5.027 30 20 EKED Cc1ccccc1-c1nnc(SCc2ccccc2C(C)(C)C#N)o1 135296043 VUCZXMHYGAUDPC-UHFFFAOYSA-N 349.459 5.139 30 20 EKED N#CCCCOc1cccc(CNC2(c3ccccc3)CCCCC2)c1 237820603 VAVGODSOUYMEOQ-UHFFFAOYSA-N 348.490 5.318 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)C1CCC(C(F)(F)F)CC1 354559891 CEQBXFSABDCECI-HRSCSKTISA-N 338.417 5.378 30 20 EKED COc1ccc2oc([C@H](C)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 358344236 VXVUOFIKVCEBBJ-JXFKEZNVSA-N 348.446 5.446 30 20 EKED C[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)c(F)c1 427881464 IQEUSFHHEWFAJC-QWRGUYRKSA-N 337.225 5.416 30 20 EKED CC[C@@H](Nc1ccc(NC(=O)CC(C)C)cc1)c1ccc(C#N)cc1 447578502 FVWCCPZNZGJDNI-HXUWFJFHSA-N 335.451 5.106 30 20 EKED Cc1ccc(C(C)(C)CC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487519342 ZHCXVSWBQZEWBZ-NRFANRHFSA-N 348.490 5.214 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1C 510073530 OSBUFAXSGOBWHZ-HOTGVXAUSA-N 349.434 5.003 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1OC(F)F 512648047 LBDGHTYOUNKBPV-SJCJKPOMSA-N 348.368 5.101 30 20 EKED CC(C)c1ccc(CN(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 514514782 NXXZNJICNUXTNK-UHFFFAOYSA-N 349.478 5.275 30 20 EKED C=CCn1c(S[C@H](C)c2cccc3ccccc23)nnc1C1CC1 518482153 KWPNUUJBTYHDFG-CQSZACIVSA-N 335.476 5.348 30 20 EKED CCCC[C@@H](CC)CC(=O)Nc1ccccc1S[C@H](C)CC#N 522682596 UDQGDJMJDROVFR-HZPDHXFCSA-N 332.513 5.626 30 20 EKED N#Cc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)c(F)c1 532990332 MVKJUBBPQOGYRA-QHCPKHFHSA-N 344.433 5.161 30 20 EKED CC(C)[C@H](NCc1ccccc1C#N)c1ccc(C(F)(F)F)cc1 537125935 OAAXYLHIKLWQFP-SFHVURJKSA-N 332.369 5.064 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)c1cccc(C#N)c1 540595078 UBRHSKWNDJKAIC-UWJYYQICSA-N 346.499 5.563 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(Oc2cccnc2)cc1)c1ccccc1 580361660 FXVJLTLDCUZCIJ-OAQYLSRUSA-N 344.414 5.172 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cc(F)ccc1Cl)c1ccccc1 590115087 JTNBJRNYSLFOAA-MRXNPFEDSA-N 345.805 5.036 30 20 EKED Cc1ccc(C[C@@H](C#N)Sc2ncc(-c3ccc(F)cc3)o2)cc1 590666128 QPMWUYPNKSTAID-KRWDZBQOSA-N 338.407 5.016 30 20 EKED CC(C)(C)c1ccc(C2CCN(C(=O)CCCCCC#N)CC2)cc1 590774877 YPQMTHLXMCXOKJ-UHFFFAOYSA-N 340.511 5.164 30 20 EKED C[C@@H](CC#N)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 597132721 VBFHHFSWGLZWNK-KBPBESRZSA-N 341.842 5.001 30 20 EKED C[C@H](SCc1ncc(-c2ccc(F)cc2)o1)c1ccc(C#N)cc1 609825814 VAXWJXVUFBWZEC-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)s1 736434135 OFTVHJDOBIOULX-CMDGGOBGSA-N 339.382 5.356 30 20 EKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccccc1OC(F)F 741840010 ASJWLOZBFVROHY-VOTSOKGWSA-N 332.277 5.069 30 20 EKED C#Cc1cccc(NC(=O)c2ccccc2Sc2ccccc2)c1 741894813 LWKDIIBJLOUSEE-UHFFFAOYSA-N 329.424 5.071 30 20 EKED CC(=NNc1cccc2ccccc12)c1sccc1Br 747060196 LCJBEMYTVDUMKJ-UHFFFAOYSA-N 345.265 5.500 30 20 EKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747193625 KVKWLHOIHXZEPX-WMLDXEAASA-N 340.492 5.199 30 20 EKED Cc1ccc(-c2ccc(CNc3cccc(OCC#N)c3)s2)cc1 779587942 HGYJJTRTHUNZIL-UHFFFAOYSA-N 334.444 5.238 30 20 EKED CC(C)Sc1cccc(Cl)c1CNc1cccc(OCC#N)c1 793061454 KAUSDBVXCOSHPC-UHFFFAOYSA-N 346.883 5.355 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 839436125 SNKJODORCDZTJQ-HOCLYGCPSA-N 346.352 5.019 30 20 EKED CCCC[C@H](CC)CNC(=S)N(CC)[C@@H](C)c1ccc(C#N)cc1 920993239 ALMRYYGFCWTKGY-IRXDYDNUSA-N 345.556 5.032 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2c(F)ccc(C(=O)O)c2F)cc1 1776699995 MMGARCAAZLPOIC-MMRAYRKESA-N 344.357 5.073 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)cc1 55870586 IDGXYQOJYJKHOA-NRFANRHFSA-N 332.834 5.091 30 20 EKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1F 78671976 ZYHFCHORBWBKIJ-INIZCTEOSA-N 346.405 5.449 30 20 EKED CSc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1F 90665302 OABHGJFEJXOOMW-KDOFPFPSSA-N 328.456 5.243 30 20 EKED C[C@H](SCc1ccc(-c2ccccc2C#N)cc1)c1cnccn1 185696948 RNMUNWNKZZECCP-HNNXBMFYSA-N 331.444 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 191432311 RGTLHWMQMYINIW-HTAPYJJXSA-N 348.490 5.763 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccc(F)c(F)c1 191507731 JFEXXYWUFQMNAT-BFUOFWGJSA-N 333.426 5.019 30 20 EKED CC[C@@H](C)[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 302936612 IJAJODODQDDPKI-OXQOHEQNSA-N 334.463 5.256 30 20 EKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1Cl 439446074 PWLWOXPFQJEDNB-LBPRGKRZSA-N 341.867 5.014 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1ccccc1OCc1ccccc1 442872948 JLTGEBNOKIXETL-HDYDNRTBSA-N 348.490 5.246 30 20 EKED CC(C)(C#N)CCCN[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 444795663 AQJWTSBVIIVJQI-CYBMUJFWSA-N 336.760 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1SC 476141934 JXMQMNYFUDTXQK-UHFFFAOYSA-N 339.504 5.442 30 20 EKED C[C@H](SCCCc1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 479527010 NTUDKYQHBFPNIS-HNNXBMFYSA-N 349.459 5.035 30 20 EKED C[C@@H](NCc1cc(C#N)n(C)c1)c1ccccc1-c1ccc(Cl)cc1 480352051 COOCFGUYQJIQQT-OAHLLOKOSA-N 349.865 5.068 30 20 EKED C=C(C)[C@@H](NCc1csc(C2CCCC2)n1)c1ccc(F)c(F)c1 481569300 KPIVDFWURDWJDE-GOSISDBHSA-N 348.462 5.486 30 20 EKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCCC(C)(C)C#N 488808964 VWVHKYKVRYLWQL-MWTRTKDXSA-N 333.541 5.514 30 20 EKED C=CCCc1ccccc1NC(=O)N(CC)Cc1c[nH]c2ccccc12 505016289 FEDSGEMMJRJEEE-UHFFFAOYSA-N 347.462 5.341 30 20 EKED C=CCC(CC=C)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 512015235 KYTJYZNPKLOPHQ-AWEZNQCLSA-N 340.320 5.383 30 20 EKED C=C[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)c1ccccc1 513038149 QACVGMIKSCXFGT-IITNATTFSA-N 345.486 5.284 30 20 EKED CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 521259903 SOIPRNHCLHXPCH-XHSDSOJGSA-N 345.512 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(C)(C)OC1(C)C 529137910 SLVVEGFGXHVRLO-KRWDZBQOSA-N 329.484 5.071 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc2c(s1)CCC2 538527995 LSCYCHIOTAJWLX-CQSZACIVSA-N 326.465 5.092 30 20 EKED N#Cc1ccc(CNCc2ccccc2Sc2ccccc2)s1 540602836 YQRXHSKKGXCMLG-UHFFFAOYSA-N 336.485 5.061 30 20 EKED CCc1ccc(Cl)c(CC)c1NC(=O)N1CCC(CCC#N)CC1 563083710 FMSVXSYOAWDPHA-UHFFFAOYSA-N 347.890 5.012 30 20 EKED CCCCN(CCCC)C(=O)Nc1ccccc1S[C@H](C)CC#N 609435186 WQYNTPAFQGIFLY-MRXNPFEDSA-N 347.528 5.515 30 20 EKED C[C@H](NCc1ccc(Oc2ccccc2)c(F)c1)c1cccc(C#N)c1 611386354 IIFSCJKXGFRJEY-INIZCTEOSA-N 346.405 5.340 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cnc(-c2ccccc2)s1 727264023 LXLBKJVPLVYBGV-QXMHVHEDSA-N 344.439 5.496 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(F)cc1 731321264 POAVESYZGDWSRW-LBPRGKRZSA-N 345.468 5.029 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cccc4cc[nH]c34)c2)s1 740010738 GJAXXJYWVBJPQB-UHFFFAOYSA-N 343.455 5.058 30 20 EKED N#C[C@H](C(=O)CCCC1CCCC1)c1nc2cc(Cl)ccc2s1 744036417 YNYMJPSOWPQLHX-CQSZACIVSA-N 346.883 5.486 30 20 EKED C=CC[C@@H](N[C@H](CC)c1ccc2cc(OC)ccc2c1)c1ccncc1 766020456 PYCKXMYKHMWTTD-DHIUTWEWSA-N 346.474 5.602 30 20 EKED O=C(/C=C\c1sccc1Cl)c1sccc1Br 782330624 QWYRCOSXSNMVBC-UPHRSURJSA-N 333.659 5.122 30 20 EKED CCC(=NNc1nncc2ccccc12)c1ccc(Cl)c(Cl)c1 915914240 KKLQXRXNKHIKJE-UHFFFAOYSA-N 345.233 5.163 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCC)cc1C 1776784721 MTCYCKMVCVINJN-LJQANCHMSA-N 349.515 5.077 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1cc(-c2ccccc2)no1 114452536 ZODKXAVKMPVXHH-OAHLLOKOSA-N 349.459 5.205 30 20 EKED CC(C)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1Cl 115619942 IKSKMNNUWRSADF-QRWLVFNGSA-N 342.870 5.118 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cc2ccccc2o1 209744404 CKEVCTABXRLNGT-FPLPWBNLSA-N 337.425 5.514 30 20 EKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccs1 329024673 NKVVINYVRGGHHB-YLFCFFPRSA-N 348.512 5.471 30 20 EKED CC[C@H]1CC[C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 433123376 YYICSFDWYCYUHQ-JYJNAYRXSA-N 345.512 5.029 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCCCCC(C)(C)C#N 444673050 MGAHIROZKDQYOB-HNNXBMFYSA-N 341.524 5.489 30 20 EKED Cc1ccccc1[C@H](C)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458799534 JMNUZWRJCODPID-RXVVDRJESA-N 349.478 5.133 30 20 EKED C=CCCN(C)C(=O)Nc1cccc(CSCc2ccccc2)c1 466557508 WRWFTNHQEJYEJD-UHFFFAOYSA-N 340.492 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CC(OC(C)(C)C)C1 489786829 METBZXXOHYGOSD-UHFFFAOYSA-N 343.511 5.461 30 20 EKED N#Cc1ccc(CSCc2cc(Cl)cc3cccnc23)c(F)c1 498101045 JPIXRXRBPWSFBN-UHFFFAOYSA-N 342.826 5.332 30 20 EKED C[C@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1F 512636146 JWMPFLDLLJHMNZ-LBPRGKRZSA-N 342.464 5.261 30 20 EKED C[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 518780041 BJHYZRVOHYNWCS-CQSZACIVSA-N 336.822 5.322 30 20 EKED C[C@@H](SCCC(=O)Nc1cccc(Cl)c1)c1ccc(C#N)cc1 522841969 ZVILUBYPFCQCSM-CYBMUJFWSA-N 344.867 5.035 30 20 EKED CC(C)(C)[C@@H](NCCCSCC#N)c1cccc(C(F)(F)F)c1 537098382 FOMPNBSWLZUUSY-HNNXBMFYSA-N 344.446 5.029 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1F 540317825 HILVTOXEWYKEJM-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CCC(C)(C)C 541624018 NGNHWMQZBGQRTM-HUUCEWRRSA-N 332.513 5.339 30 20 EKED C=CCC[C@H](NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccco1 552048230 LMYLDLCUUHVJOR-IRFCIJBXSA-N 325.452 5.044 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 552607077 MQRLVOLWFAISCG-ZBFHGGJFSA-N 339.401 5.014 30 20 EKED CC[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 561129868 CKWINSOJHJBVOA-JKSUJKDBSA-N 330.884 5.391 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1Cl 577684760 UGFSGVXXQZQVJB-VOJFVSQTSA-N 331.246 5.203 30 20 EKED CC[C@H](Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(C#N)cc1 618573755 AMQKYAUGKPWHPZ-FQEVSTJZSA-N 331.419 5.393 30 20 EKED Cc1cccc2c1C/C(=C\c1csc(-c3ccc(F)cc3)n1)C2=O 729151519 SUIULGDGFPACBY-NTEUORMPSA-N 335.403 5.080 30 20 EKED CCCCCC[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 741924007 BCBMSRSWDAERGR-JKSUJKDBSA-N 332.513 5.626 30 20 EKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744037838 FJBJJGKPZQUHQW-UONOGXRCSA-N 347.409 5.214 30 20 EKED C=CCN(C(=S)Nc1c(C)cc(C)cc1Cl)c1ccccc1 745992735 ZUJSGNIGBWHDOR-UHFFFAOYSA-N 330.884 5.346 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)o2)cc1 761804894 UIQQPYLJPQDHOG-HMWXGYMHSA-N 343.382 5.134 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(C#N)c(F)c3)s2)cc1 776726506 KCPWDZCLDPIUQU-CMDGGOBGSA-N 348.402 5.025 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(-c2coc(C)n2)cc1)c1ccccc1 777469296 AMFRDWMYFXMSPL-FQEVSTJZSA-N 346.430 5.339 30 20 EKED CC(=NNc1cccc(F)n1)c1ccc(Cl)c(Cl)c1Cl 795007864 OUBDKTYCVWXJCW-UHFFFAOYSA-N 332.593 5.017 30 20 EKED CC(C)c1ccccc1NC(=O)C[C@H](C)Nc1ccc(CCC#N)cc1 903298421 SULCFALHTVCEPJ-KRWDZBQOSA-N 349.478 5.095 30 20 EKED Oc1nc2ccccc2cc1C=Nc1cccc(OC2CCCC2)c1 912961651 DMFWABAAFZGFPK-UHFFFAOYSA-N 332.403 5.012 30 20 EKED CC(C)c1cccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)c1 1776375385 LGZALASVWPAEAA-SOFGYWHQSA-N 334.371 5.151 30 20 EKED C(#Cc1ccc(-c2ccncc2)cc1)c1ccc(-c2ccncc2)cc1 2113919170 GOPOAAAAUVXGJK-UHFFFAOYSA-N 332.406 5.210 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1cccc(OC)c1 189894410 LAZSVANCTHYRLZ-SFTDATJTSA-N 349.474 5.289 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/SCc1ccco1 189901812 DJLZYRWPQDINGK-ACCUITESSA-N 341.476 5.517 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1ccsc1Cl)c1ccc(F)c(F)c1 446570146 WYWQTCCZMZDKJM-CYBMUJFWSA-N 342.798 5.119 30 20 EKED C=CCC[C@@H](NCc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 450688747 WTRQVVIRHUZOTA-GOSISDBHSA-N 334.385 5.206 30 20 EKED N#CCCCC(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 463956096 UUUCYRRTWSXPMA-UHFFFAOYSA-N 340.426 5.653 30 20 EKED C[C@@H](NCCCC1CCOCC1)c1ccc(-c2cccc(C#N)c2)cc1 470318290 MWOSNLFKBJBOSH-GOSISDBHSA-N 348.490 5.083 30 20 EKED C=CCC[C@H](NCc1ccc(OCc2ccccn2)cc1)c1ccco1 476015060 XTCPEBRWANKOIO-NRFANRHFSA-N 348.446 5.051 30 20 EKED C=CCCCC(=O)N(Cc1cc(C)nc2ccccc12)C1CCCC1 480864278 ADIWBCQHYHXWEJ-UHFFFAOYSA-N 336.479 5.171 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(C)c(F)cc1Cl 487405542 NONIUYZEUIMTJF-UHFFFAOYSA-N 332.806 5.008 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C(F)(F)C1 494933688 VNNJLNJLQIMCKI-AWEZNQCLSA-N 336.426 5.048 30 20 EKED C[C@H](c1ccccc1)N(C(=O)c1sccc1C#N)c1ccccc1 502766593 SKJIIPCIZXHMLG-OAHLLOKOSA-N 332.428 5.028 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccco1 505059897 BYMSKAQTGZXUHY-LJQANCHMSA-N 338.451 5.547 30 20 EKED Cc1ccc2[nH]c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1 520187454 NWJJPROCWLXZBT-AWEZNQCLSA-N 349.459 5.123 30 20 EKED COc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542018005 HMUAAKFKNZZVDE-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C=CCCCC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1 543297468 JYYMYWFJKMCIKS-JTHBVZDNSA-N 349.474 5.109 30 20 EKED C[C@@H](NCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 543428542 XWULYKDRCKJCPL-GFCCVEGCSA-N 338.398 5.388 30 20 EKED CCCCSc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1ccccn1 561982343 GWGBJCMYQIMAOG-HNNXBMFYSA-N 344.867 5.117 30 20 EKED N#CCCC1CCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 565654361 MORZFDOAHYBNPC-UHFFFAOYSA-N 347.418 5.134 30 20 EKED C[C@@H](NC[C@H](C#N)CCC#N)c1ccc(-c2ccc(Cl)cc2)s1 580543413 XXOWJPRZUFEOHU-KGLIPLIRSA-N 343.883 5.163 30 20 EKED Cc1cc([C@@H](NCCCCC#N)c2cccc(Cl)c2)c(C)s1 582479023 IWBKEZICCPHNEP-SFHVURJKSA-N 332.900 5.391 30 20 EKED N#Cc1cccc(CSCc2csc(Cc3ccccc3)n2)c1 609236413 BVLDORBUPPIWMY-UHFFFAOYSA-N 336.485 5.039 30 20 EKED CCCCC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 731400532 QNJLPOHUDBTSJU-GJZGRUSLSA-N 333.501 5.171 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(-c2cccs2)cc1)c1ccncc1 766019572 MNSUEZDOTADXNI-OXQOHEQNSA-N 334.488 5.778 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(SC(F)F)cc1)c1ccccc1 773118447 ZRHQBHHLTBIODT-KSSFIOAISA-N 331.431 5.417 30 20 EKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 779825178 MQAGRABHYWODGC-GOSISDBHSA-N 339.504 5.422 30 20 EKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nccc2ccccc12 792106630 SHBHWUPRBCMRCV-LJQANCHMSA-N 348.471 5.276 30 20 EKED Cc1csc([C@H](C#N)C(=O)C2(C3CCCCC3)CCCCC2)n1 796617408 BZNDPTXFWHEKDR-MRXNPFEDSA-N 330.497 5.159 30 20 EKED C[C@@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC=CCC1 822495248 CLOQNUDHXYUHFY-RBBKRZOGSA-N 330.431 5.027 30 20 EKED CCCC[C@@H](CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915180653 QPIGQZNHETZUPN-UTKZUKDTSA-N 334.463 5.497 30 20 EKED C=CCN(C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)C(C)C 918076756 NBXRKOIJQXDUDM-LJQANCHMSA-N 342.870 5.035 30 20 EKED O=C(O)c1csc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c1 1776131010 DLSHMEZZNJBGGL-ZHACJKMWSA-N 334.396 5.009 30 20 EKED O=C(/C=C\c1cc(C(=O)O)c(Cl)s1)c1ccc2ccccc2c1 1776131702 ZMYJGTJMFRXRHE-FPLPWBNLSA-N 342.803 5.149 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776700114 ZOWULIDSTHZSCA-CFRMROPGSA-N 347.414 5.276 30 20 EKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)[C@@H](C)CC)c1 1776787443 OAZAWWUTZNLCIM-FXAWDEMLSA-N 349.515 5.015 30 20 EKED CCN(C(=O)Nc1ccccc1C(C)C)[C@H](C)c1ccc(C#N)cc1 118789613 DJSXIPGXBQGTED-MRXNPFEDSA-N 335.451 5.297 30 20 EKED Cc1cccc(F)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 179861505 MUTFUSOYLUALSP-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2ccc3nc(C(C)(C)C)sc3c2)CCC1=O 328897373 CQMQIBAHFUZNSU-NEPJUHHUSA-N 344.480 5.187 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(C2CC2)cs1 342456181 SAKNGLUZSVIAPW-LBPRGKRZSA-N 329.494 5.027 30 20 EKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2o1 352198375 LFBHZDKHQQORJV-LPHOPBHVSA-N 346.430 5.088 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C2CCC2)c1 463846008 ASNLDJMWKRZSLI-UHFFFAOYSA-N 347.462 5.270 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccco3)n2)c(Cl)c1 465386587 BQAZFCHDQSLICZ-UHFFFAOYSA-N 332.837 5.220 30 20 EKED CCC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CCCC1 473828235 XASDCTNUWLFUKE-OAHLLOKOSA-N 345.512 5.173 30 20 EKED C=C1CCN([C@H](C)c2ncc(-c3ccc(Cl)cc3Cl)o2)CC1 510565702 OHLVWGFMJGFWFA-GFCCVEGCSA-N 337.250 5.361 30 20 EKED Cc1ccc(-c2csc3ncnc(SCC4(C#N)CC4)c23)cc1 517048735 XLQDKWZHVWCIAX-UHFFFAOYSA-N 337.473 5.063 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536816391 MGSHNFUZMLUJCC-CRAIPNDOSA-N 349.434 5.145 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 537948152 ZORFTFSJADMDDX-KSSFIOAISA-N 334.385 5.459 30 20 EKED C[C@@H](NC[C@H](C#N)CCC#N)c1ccccc1-c1ccc(Cl)cc1 538187143 VBLVVXYQVLPPJB-CVEARBPZSA-N 337.854 5.101 30 20 EKED N#CCCC[C@@H](NC/C=C/c1ccc(F)c(F)c1)c1ccccc1 560561530 JJRPXPWXZKICMX-ROUKRRSUSA-N 326.390 5.003 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(CSC2CCCC2)c1 570372738 FZJRLGMXWSKVGO-UHFFFAOYSA-N 332.513 5.292 30 20 EKED C[C@](C#N)(NC(=O)c1cccc(Nc2ccccc2)c1)C1CCCCC1 574194803 QRFIAOBLBSSCKJ-JOCHJYFZSA-N 347.462 5.023 30 20 EKED C=C(C)[C@H](Cc1nc([C@@H](c2ccc(Cl)cc2)C(C)C)no1)OCC 578099273 LQLHFLIQQWNGCD-FUHWJXTLSA-N 348.874 5.035 30 20 EKED N#Cc1ccc(F)c(CSc2ncc(-c3ccc(Cl)cc3)o2)c1 590690516 RVPRCBZVSPYNSI-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C=C(CNC(=O)N(c1ccccc1)c1ccccc1)c1ccccc1 672423601 FDTLEDDHNMWZGI-UHFFFAOYSA-N 328.415 5.248 30 20 EKED Cc1nc(/C=C\c2ccsc2)sc1C(=O)/C=C\c1ccsc1 726849138 XDIHEBKCCFAFMV-JVLMNHKTSA-N 343.498 5.641 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1 739141837 FHJRPBXPKSHOLC-MAUKXSAKSA-N 345.446 5.056 30 20 EKED CSc1ccc(C(=O)/C=C/c2ccccc2OC(F)F)cc1F 741847530 OZHPIPRCDWUMSI-SOFGYWHQSA-N 338.350 5.045 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc2ccccc12 775384619 DPVQKVCLUJXEAN-VLIAUNLRSA-N 332.472 5.501 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCC(C)(C)C3)n2)cc1 781768124 VNDJWPGELJDGPT-JKSUJKDBSA-N 338.476 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1cccc(F)c1 789717981 CBGVYLQIKHWHSJ-DTQAZKPQSA-N 337.438 5.720 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1cc2ccccc2cc1C#N 839436177 UQOONVCZZGKINB-UHFFFAOYSA-N 349.459 5.026 30 20 EKED Cc1ccc(C(F)(F)F)cc1NCc1cccc(OCCCC#N)c1 864024847 FOWCMMACBSDIOJ-UHFFFAOYSA-N 348.368 5.309 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)s1)c1ccncc1 902806830 PESCCRGBNXRGHS-AAEUAGOBSA-N 326.387 5.130 30 20 EKED N#Cc1csc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)c1 904551149 FADFZYYYKXMTIW-UHFFFAOYSA-N 329.384 5.004 30 20 EKED COc1ccc2c(c1)CC/C(=C/c1csc(-c3ccccc3)n1)C2=O 916153592 UXPPNMLLPIJIIT-WJDWOHSUSA-N 347.439 5.031 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(F)c(F)c3)cs2)cc1 918713738 URMRWEQINMOWGH-CLFYSBASSA-N 341.382 5.293 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 54464625 OQMJHNHYDGUBDS-NKAIQICCSA-N 344.439 5.090 30 20 EKED CC(C)CN(CC(C)C)C(=O)Nc1ccccc1SC[C@H](C)C#N 108531436 YCKVKQRERHCXBH-MRXNPFEDSA-N 347.528 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccncc1 191415945 YIAFLYMLRRMQES-HXUWFJFHSA-N 349.478 5.303 30 20 EKED Cc1nc2ccc(CN[C@@H](CCCC#N)c3ccccc3)cc2s1 353918067 XEWCXSIYXAEXKS-SFHVURJKSA-N 335.476 5.130 30 20 EKED Cc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 432468992 BADZCEYFVCTWSX-KRWDZBQOSA-N 341.842 5.205 30 20 EKED Cc1cc(C)c(NC(=O)c2cn(CCCC#N)c3ccccc23)c(C)c1 443976458 AFOIXVSSDZAOOD-UHFFFAOYSA-N 345.446 5.123 30 20 EKED CC(C)C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cccs1 475112108 DHOHYABNGSGSOB-QGZVFWFLSA-N 340.492 5.066 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCCC[C@@H]1CC 476149443 NLYPBPGBKDUUSS-FXAWDEMLSA-N 343.511 5.462 30 20 EKED N#CCCCOc1cccc(CN(C2CC2)[C@@H]2CCc3ccccc32)c1 510641860 WEFSAMPIWSGICQ-HSZRJFAPSA-N 346.474 5.021 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H]1CCC[C@@H](C)C1 520187308 HUDWNCPOWIRHPU-PMPSAXMXSA-N 330.497 5.236 30 20 EKED C[C@H](SCCC(=O)Nc1cccc(Cl)c1)c1ccc(C#N)cc1 522841970 ZVILUBYPFCQCSM-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1nc(-c2ccccc2)cs1 560260731 FIVPJQUBQURXPC-OAHLLOKOSA-N 345.471 5.022 30 20 EKED CC(C)c1cccc2c1N(C(=O)c1ccc(C#N)cn1)C(C)(C)C[C@H]2C 560709914 AIHGQAGAZNGKPF-OAHLLOKOSA-N 347.462 5.009 30 20 EKED COCCSc1ccc([C@H](C)Nc2ccc(Cl)cc2C#N)cc1 572506922 VCCZHXJJVSVQFX-ZDUSSCGKSA-N 346.883 5.123 30 20 EKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)CCCCCC#N)cc1 588299752 POKOMYXCVXUFAH-LJQANCHMSA-N 326.484 5.122 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(Cl)c1 609387375 ZDWNUNCADAQVAD-UONOGXRCSA-N 330.884 5.765 30 20 EKED CCCN(Cc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2cccnc21 614215632 OFYUBDCKXUDIOQ-OAQYLSRUSA-N 347.506 5.172 30 20 EKED N#CC1CCC(CNCc2c(Cl)ccc(Cl)c2Cl)CC1 619655363 VJLJERXUQHCHNM-UHFFFAOYSA-N 331.674 5.066 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)NC3(C#N)CCCC3)sc2c1 732657693 RXRQDNPHTAFWMN-UHFFFAOYSA-N 346.883 5.244 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)(C)C 744034903 FXENSNLSZSUYPH-UMAGTOLTSA-N 332.856 5.118 30 20 EKED Cc1cc(OC(C)C)ccc1NCc1cccc(OCCCC#N)c1 747098940 JQLIBKHXCPZQJK-UHFFFAOYSA-N 338.451 5.077 30 20 EKED Cc1ncsc1C(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl 753712840 VBVWKXBLKQEIDU-DJWKRKHSSA-N 331.746 5.020 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(C)s1 789448988 AWMVKECDFLPMOU-HNNXBMFYSA-N 342.508 5.791 30 20 EKED CCCCCCCCC(=O)Nc1ccccc1C(=O)N1CCCCC1 832560649 LQSYHXGTINMPHI-UHFFFAOYSA-N 344.499 5.002 30 20 EKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 920791684 CEIGTVHOSJHFPB-DJIMGWMZSA-N 338.476 5.203 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](CC)c2c(C)noc2C)cc1 90886207 VTYFCMTXSSYSBJ-UGSOOPFHSA-N 348.874 5.225 30 20 EKED CCCCCCCCC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 303477381 PDZMKVDMTOGADH-UHFFFAOYSA-N 346.515 5.669 30 20 EKED C[C@H](SCC1CC1)C(O)=Nc1sc2c(c1C#N)CCCCC2 329625972 SZXGUSLUOSUFEH-NSHDSACASA-N 334.510 5.008 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 340442235 FGUKJIHAGWWWFL-RTBURBONSA-N 340.467 5.387 30 20 EKED C[C@H](N[C@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 376868186 YJBMDIFIDWXGAB-DLBZAZTESA-N 327.431 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@H]1c1ccccc1 432585879 WAQACGPZYRULLL-VQTJNVASSA-N 334.463 5.216 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCC2CCC(C#N)CC2)cc1 442870000 CKGAFBYSHPJKHL-LMDPOFIKSA-N 348.490 5.343 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 475556504 VNBYVXOSYHAEHY-INIZCTEOSA-N 347.462 5.293 30 20 EKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 475908029 VNOBVJZGJIPKHT-NFBKMPQASA-N 348.490 5.238 30 20 EKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(Cl)cc1C#N 480585872 XKPKXNUQZOXFOO-LBPRGKRZSA-N 341.867 5.014 30 20 EKED C[C@H](CCCC(F)(F)F)NCc1ccc(F)c(C(F)(F)F)c1 494849886 ZOCNLPWCNLFHCQ-SECBINFHSA-N 331.275 5.055 30 20 EKED CCC(CC)[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 503386893 UTLPBMRVKFEZQW-FQEVSTJZSA-N 335.451 5.052 30 20 EKED CCNc1cc(C)ccc1NC(=O)c1sc2ccc(C#N)cc2c1C 506099622 TZVSQLRRBYCEQO-UHFFFAOYSA-N 349.459 5.074 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C)c1ccc(C#N)cc1 524069132 XWHHSTFJWXTKLE-LAUBAEHRSA-N 346.499 5.563 30 20 EKED C[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1cccc(C#N)c1 539506498 JGLFFEVKPVQALG-PIGZYNQJSA-N 331.246 5.203 30 20 EKED CCN(C(=O)[C@H](C)c1cccc(Cl)c1)c1ccc(C#N)c(Cl)c1 540273794 WCGDKAZSJSCUJH-GFCCVEGCSA-N 347.245 5.022 30 20 EKED C=CCC[C@H](NC1CCC(OC)CC1)c1ccc(C(F)(F)F)cc1 542485038 GQNFAIYFZSYNBE-ABHNRTSZSA-N 341.417 5.260 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@@H]1CCc2ccccc21 604273216 KKPKNJYBUKPUFC-HNNXBMFYSA-N 345.895 5.036 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H](c1cccnc1)C1CCCCC1 611391843 BKPNYWAQCAJMAA-DHIUTWEWSA-N 345.490 5.242 30 20 EKED C=CC[C@@H](NCc1ccc(-c2c(F)cccc2F)o1)c1ccncc1 734508511 ALMFJRNNBPOAFW-GOSISDBHSA-N 340.373 5.027 30 20 EKED CCCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2s1 735204190 RCPHCIZQHSENNC-CABCVRRESA-N 328.481 5.469 30 20 EKED C=C(C)CNC(=S)Nc1ccc(SC2CCCCC2)cc1C 748156356 FRAJUDSBCZEJFV-UHFFFAOYSA-N 334.554 5.282 30 20 EKED C[C@@H](Oc1ccc(C(=O)Nc2sccc2C#N)cc1)c1ccccc1 788423893 RYNJOSKCHYLJNI-CQSZACIVSA-N 348.427 5.012 30 20 EKED CC(C)(CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 815010961 UZKAPIBCEXCSTE-FQEVSTJZSA-N 332.447 5.107 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)C12CC3CC(CC(C3)C1)C2 915050580 WEMPOXRJAGPPAG-UHFFFAOYSA-N 337.389 5.105 30 20 EKED Fc1ccc(F)c(CNN=Cc2c(Cl)ccc(Cl)c2Cl)c1 915978020 AIKSSMHWHHYSDO-UHFFFAOYSA-N 349.595 5.049 30 20 EKED CCCCn1nc(C)c(/C=C\C(=O)c2cc3ccccc3o2)c1Cl 916138349 GWMUEZGCPUGHFX-KTKRTIGZSA-N 342.826 5.287 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(Oc2ccccc2)c(F)c1 917144409 LBUWFLDUNRXNRX-KTKRTIGZSA-N 337.350 5.119 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1 90580680 NYVYCLWSGNGDHK-JXFKEZNVSA-N 348.490 5.274 30 20 EKED C[C@@H](SCc1csc(-c2ccccn2)n1)c1cccc(C#N)c1 190791659 IPEXCZHIXNWREI-CYBMUJFWSA-N 337.473 5.071 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 320977914 KYNOMZMZLIUKDH-LJQANCHMSA-N 328.843 5.586 30 20 EKED C=CCCc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc12 410352388 OMYYAOIFALEKIT-MRXNPFEDSA-N 332.447 5.419 30 20 EKED Cc1cccc([C@@H]2CCCCCN2CCCC2(C#N)CCOCC2)c1 410381884 YAKZHQYDFCATEM-NRFANRHFSA-N 340.511 5.013 30 20 EKED CC[C@H](c1ccc(F)cc1F)[S@](=O)CCC1(C#N)CCCCC1 417153538 VJIMOEQHWKOLBK-UZUQRXQVSA-N 339.451 5.029 30 20 EKED Cc1cc(CN[C@H](C)c2cccc(C#N)c2)ccc1-c1ccccc1 427859591 WPQDSERDBROTHV-GOSISDBHSA-N 326.443 5.385 30 20 EKED C[C@H](CC1CCCCC1)NC(=O)N[C@H](CCCC#N)c1ccccc1 431915799 GBYAXMSJEWFDSQ-YLJYHZDGSA-N 341.499 5.080 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 432503279 WBIBKAHBNOGREW-HXUWFJFHSA-N 349.478 5.675 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cccc([C@@H](C)OC)c1)c1ccccc1 435605052 CGJMSRHVHBFACZ-OXQOHEQNSA-N 338.451 5.223 30 20 EKED C/C=C/c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 497366077 ILHTWSMQJNMYQU-SNAWJCMRSA-N 333.435 5.034 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1C 505016821 MNLRNMGWZBDJGT-OAQYLSRUSA-N 334.463 5.483 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)CCC1CCCCC1 518139900 CWMZCOWZZBAIRL-OAHLLOKOSA-N 330.497 5.237 30 20 EKED CC(C)=CCSc1ccccc1C(=O)Nc1cc(C#N)ccc1C 530832481 VUADRWAYXZQFLC-UHFFFAOYSA-N 336.460 5.177 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1cccc(C)c1C)c1ccccc1 534665219 SDFFSFSPGUUYKM-KNQAVFIVSA-N 333.475 5.327 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H](c2ccccc2)CC1)c1ccccc1 535340023 MAHHRHRGWNNLDI-KNQAVFIVSA-N 333.475 5.143 30 20 EKED N#Cc1c(Cl)cccc1SCc1ncc(-c2ccc(F)cc2)o1 536737133 SMCNVXFSDHFQJH-UHFFFAOYSA-N 344.798 5.298 30 20 EKED C[C@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1 538394587 GNNLERXLMKQBFQ-DJJJIMSYSA-N 328.406 5.274 30 20 EKED CC(C)Sc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 539047623 UVZGTIPLFWCBLN-UWJYYQICSA-N 338.520 5.883 30 20 EKED CCOCc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 539934467 OJHQDPZCBQNLHK-UHFFFAOYSA-N 334.463 5.039 30 20 EKED CC(C)c1ccc([C@H](NC(=O)CC(C)(C)C#N)c2cccs2)cc1 548413112 UUVMEOXKJWURIM-IBGZPJMESA-N 340.492 5.017 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 553305231 KIOMBQXVPVVNGU-YJYMSZOUSA-N 344.380 5.305 30 20 EKED N#C[C@H](C(=O)c1cc2sccc2s1)c1nccc2ccccc12 568825156 HGMQPIMDXVTQDK-ZDUSSCGKSA-N 334.425 5.001 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)N1CCC(CCC#N)CC1 570799168 QRVJIERAIKZNHW-UHFFFAOYSA-N 347.462 5.210 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCCCC1(C)C 574873016 RWIQVAWNLSFRCE-CABCVRRESA-N 330.497 5.236 30 20 EKED CCc1cc(C#N)c(NC(=O)c2cc3c(Cl)cccc3s2)s1 604028896 ZASDWAWMWPUJBP-UHFFFAOYSA-N 346.864 5.303 30 20 EKED COc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)c2ccccc12 610830034 YRIJLTLQRYHCMG-JKSUJKDBSA-N 330.431 5.132 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H](c2ccc(Cl)cc2)c2cccs2)C1 613255189 XJUYIKVKMPFOSB-SKDZVZGDSA-N 330.884 5.163 30 20 EKED CC(C)(C)CCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 729069939 JHUILXFBPKYTBN-LBPRGKRZSA-N 334.872 5.342 30 20 EKED O=C(/C=C\c1nccs1)c1ccc(-c2ccc(Cl)cc2)s1 735228870 JRYBYVQKRMKIHY-YVMONPNESA-N 331.849 5.421 30 20 EKED CCc1c(C(=O)/C=C\c2nccc3ccccc23)oc2ccccc12 740765426 ZFLPPEHCYJRGAH-QXMHVHEDSA-N 327.383 5.440 30 20 EKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1ccc(Cl)s1 741840168 IZCUMCQGEHPXAI-AATRIKPKSA-N 346.757 5.239 30 20 EKED Cc1ccc(-c2nc(/C=C3/CCc4c(O)cccc4C3=O)cs2)cc1 742434530 JJELBFLMDANNJO-PTNGSMBKSA-N 347.439 5.037 30 20 EKED CCCCCCCC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 746562978 ZRTYZNACEPNHCY-UHFFFAOYSA-N 345.418 5.052 30 20 EKED N#C[C@@H](SC1=Nc2ccccc2CS1)c1ccc(Cl)cc1 752934935 YKKGSDSRKQGPSZ-OAHLLOKOSA-N 330.865 5.572 30 20 EKED FC(F)(F)c1cccc(C2CCC(=NOCc3cccnc3)CC2)c1 761828114 LBJKNYJEMYADTE-UHFFFAOYSA-N 348.368 5.331 30 20 EKED CCOc1ccc(NCc2cccc(OCCCC#N)c2)cc1Cl 770488816 JXHUOSJHXXIUJP-UHFFFAOYSA-N 344.842 5.033 30 20 EKED CC(C)Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc3ccccc3o2)c1 796815789 GFBGBGLOANEXAV-YJBOKZPZSA-N 346.430 5.006 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)s1 797568834 WSSNUKWSEKCCJH-ZJIFWQFVSA-N 344.524 5.223 30 20 EKED CCCCc1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 916846270 OHGSZMQEVSVHIS-QGZVFWFLSA-N 348.471 5.058 30 20 EKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2csc(C(=O)O)c2)c1 1777461704 GWNDAXIQIVOHHM-MDZDMXLPSA-N 348.423 5.318 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 25438625 VWAHPXAXWUMLHN-UHFFFAOYSA-N 339.247 5.108 30 20 EKED CCc1c(C)sc(NC(=O)c2cccc(Cl)c2Cl)c1C#N 68677944 XKMXZKPABHNTKV-UHFFFAOYSA-N 339.247 5.050 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2cccs2)cc1)c1ccc(C#N)cc1 174026081 QILXPXWIPGFETL-CQSZACIVSA-N 347.443 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(F)c1 191423886 QUMGJUIRVWMXHK-UHFFFAOYSA-N 340.442 5.342 30 20 EKED C[C@@H](NCc1cc(C#N)cs1)c1ccc(Oc2ccccc2)cc1 237445294 PLNNCUMFACEVJY-OAHLLOKOSA-N 334.444 5.263 30 20 EKED CCCCCCCCOCc1cccc(N[C@@H](C)c2nnc(C)o2)c1 264890869 TVOOXLUYRIDOSR-INIZCTEOSA-N 345.487 5.428 30 20 EKED O=C1/C(=C\c2ccsc2)CCc2nc(-c3ccc(F)cc3)sc21 303235945 ZSCHLKJUAWOFTK-LCYFTJDESA-N 341.432 5.223 30 20 EKED COc1ccc(N=C(C)O)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 328992159 IRCNNMVOBJSPRS-HYVNUMGLSA-N 344.455 5.498 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1cccc(F)c1C#N 427840883 XHZDGEATCRGHCN-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cccc3ccsc23)s1 430604517 QMEYETUYEQEFGU-CYBMUJFWSA-N 340.473 5.145 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cccc3ccccc23)s1 430621814 KHJDCRAELASKJZ-MRXNPFEDSA-N 334.444 5.084 30 20 EKED N#CCCC[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccccc1 433030079 DIJTZLDFWZFVAY-IBGZPJMESA-N 349.409 5.005 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2cc(Cl)cc(Cl)c2[C@@H]1C 466414038 GLQJGATXPUDGLE-RYUDHWBXSA-N 326.267 5.041 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C)c1F 481118918 VQXZVMRZEGKHQR-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCc1ccc(F)c(F)c1 489735952 KSPGOLOJOHAIGV-CYBMUJFWSA-N 332.419 5.014 30 20 EKED CC(C)c1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)c(C(C)C)c1 513915837 XWULOZRXAGIKPT-OAHLLOKOSA-N 327.472 5.089 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H]1CCC[C@@H](C)C1 520187307 HUDWNCPOWIRHPU-OWCLPIDISA-N 330.497 5.236 30 20 EKED N#Cc1cccc(CC(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 526777584 CBOMBOFGDMFXGC-UHFFFAOYSA-N 346.817 5.060 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(-c2ccncc2)ccc1C)c1ccccc1 534697833 WXSRKSGUXZLXTB-SFHVURJKSA-N 342.442 5.355 30 20 EKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(C#N)c(F)c3)c2)oc1C 537452174 OQVJIYCUDLBEGU-ZDUSSCGKSA-N 335.382 5.142 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(-c2ccncc2)c(C)c1)c1ccccc1 553241900 AIUMUCDLJIPXNX-QFIPXVFZSA-N 342.442 5.355 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCC1CCCC1 609398272 PQKBFFMAHWSMNB-OAHLLOKOSA-N 345.512 5.030 30 20 EKED N#C[C@@H](C(=O)c1ccc(-c2ccco2)s1)c1ccc2ccccc2n1 675907334 SSSOYTAMTOXWJY-CQSZACIVSA-N 344.395 5.046 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(C)c2ccccc21 682822475 OGMDTKFMDXFIBB-HXUWFJFHSA-N 348.490 5.101 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc3ccccc23)cc1 728694732 HIFHVMVFDWBLSB-UKYUDJEDSA-N 327.383 5.027 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1cnc(-c3ccccc3)[nH]1)C2=O 742435605 YYMWMBVHCXYYEN-WJDWOHSUSA-N 346.455 5.011 30 20 EKED C(=NN(c1ccccc1)c1ccccc1)c1cnc([C@@H]2CCCO2)s1 755465028 FATJWRKPMFQTRO-IBGZPJMESA-N 349.459 5.167 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 765333473 VFZBKXPGULHXJL-CVEARBPZSA-N 340.854 5.101 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 766022447 VZQTVBQHIMPGET-APPDUMDISA-N 339.241 5.496 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1cncc2ccccc12 772806573 LZYYWWDHPHRPEP-MDZDMXLPSA-N 336.460 5.193 30 20 EKED CC[C@H](NCc1cc(C#N)ccc1F)c1ccc(Cl)c(Cl)c1 773027432 QRUTYIOPXSRVQC-KRWDZBQOSA-N 337.225 5.245 30 20 EKED O=C(/C=C/c1ccc(SCc2ccccc2)cc1)c1cncs1 787170924 DEGLYRUDOAHAJP-DHZHZOJOSA-N 337.469 5.332 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C\c2nc(Cl)cs2)cc1Cl 789156890 GDCHPNMLFYIZEO-XQRVVYSFSA-N 342.247 5.133 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)cc(Cl)n1 789719067 HRTHKDXLBXWLHN-UHFFFAOYSA-N 349.261 5.493 30 20 EKED CCCCCCCC[S@@](=O)[C@@H](C)c1nc(-c2ccccc2C)no1 790139753 MMOBLQHHQAFAJK-UPCLLVRISA-N 348.512 5.215 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](F)CC1CCCCC1 793469342 SJIZQVZZSKSSAU-GOEBONIOSA-N 348.487 5.328 30 20 EKED C[C@H](Nc1snc(Cl)c1C#N)c1ccc(F)c2ccccc12 808120183 GGGRAYNQBHTGBS-VIFPVBQESA-N 331.803 5.134 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C)[C@H]1CCC[C@H]1C#N 878545850 OPDKSUIATNKDEX-YOEHRIQHSA-N 345.512 5.042 30 20 EKED C[C@H](OC(=O)C1(C#N)CCCCC1)c1ccc(Cl)c(Cl)c1 920159064 QMJVGCCNPKMDPT-NSHDSACASA-N 326.223 5.072 30 20 EKED C=C(Cl)CSc1nc(O)c2c(C[C@@H](C)CC)c(C)sc2n1 1643608407 LYPPQYKKGZLLET-QMMMGPOBSA-N 342.917 5.139 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)c1 1776341402 CMAYUMYTOLHXHV-HJWRWDBZSA-N 342.822 5.133 30 20 EKED C[C@@H](SCc1nc(C(F)(F)F)cs1)c1ccc(C#N)cc1 155614404 YDZBVABAACJFJA-SECBINFHSA-N 328.384 5.028 30 20 EKED Cc1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)co2)cc1 353912704 FXBYQDNYLJTODZ-OAQYLSRUSA-N 345.446 5.175 30 20 EKED N#CC1(CCSc2nnc(-c3ccc(Cl)cc3)o2)CCCCC1 412980218 RNGSYQCXTZFJKH-UHFFFAOYSA-N 347.871 5.346 30 20 EKED CC(C)c1ccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431858098 JHTDKGDDSNPKFL-OAQYLSRUSA-N 349.478 5.044 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2ccc3[nH]c(C)cc3c2)CCCC1(C)C 444909757 ZOUYXSJQPQKLEN-SFHVURJKSA-N 325.456 5.075 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 466874196 VQDAURSGBIPKDR-RHSMWYFYSA-N 339.401 5.361 30 20 EKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)csc2c1 483716627 ZBOXDTPNGCYFIE-CYBMUJFWSA-N 340.473 5.280 30 20 EKED N#CCCCOc1cccc(NCc2ccc(Oc3ccccc3)o2)c1 503569676 VNFHMLKUTZEVSZ-UHFFFAOYSA-N 348.402 5.367 30 20 EKED C[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1F 512637475 WEXIWBPEWXPRTG-PIGZYNQJSA-N 346.858 5.238 30 20 EKED CCCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCCC1 519841810 NEICCSXNRIONDL-UHFFFAOYSA-N 326.484 5.063 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1=CCCCC1 526123922 HPKKIORVBUPIGF-UHFFFAOYSA-N 332.403 5.098 30 20 EKED Cc1ccc(CN[C@H](C)c2ccc(C#N)c(F)c2)c(OC(C)(C)C)c1 538509743 OHMNPZOHABSGDS-OAHLLOKOSA-N 340.442 5.034 30 20 EKED C=CCC[C@H](N[C@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1 540146811 MOKCEECWFOCUIW-XLIONFOSSA-N 339.479 5.370 30 20 EKED C[C@@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 540607663 WHYUKSNNLBIJSF-DIFFPNOSSA-N 331.246 5.203 30 20 EKED C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)CCCCCC#N 598451902 FMUUDJFTISOQGQ-FQEVSTJZSA-N 348.490 5.120 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(C)cc1 739142844 LGMPBVSFBSQZHD-XLIONFOSSA-N 342.442 5.303 30 20 EKED COc1ccc(Cl)cc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745989981 IUUURUDOBJSTKU-VURMDHGXSA-N 349.817 5.307 30 20 EKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1ccc(F)c(F)c1 751526142 ZHBHOIHOEJZNAS-XQRVVYSFSA-N 339.316 5.062 30 20 EKED CC(C)[C@H]1CCc2ccccc2[C@@H]1N[C@@H](C)c1ccc(OCC#N)cc1 765809322 MDFCRGVBXKHCNU-AMHTUMDSSA-N 348.490 5.199 30 20 EKED Cc1ccc(C)c2c1CC/C(=C/c1cnc(-c3ccncc3)s1)C2=O 769746946 SYFAMODOBKCMAF-WJDWOHSUSA-N 346.455 5.034 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2ccc(C#N)o2)cc1 794375303 QXJLTTKZSUBDTG-CQSZACIVSA-N 348.427 5.257 30 20 EKED Cc1cc2ccccc2nc1NN=C1CCC[C@@H](c2cccnc2)C1 799883476 DSSUWHVDUJIBRK-MRXNPFEDSA-N 330.435 5.064 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1O 810213519 UOWBFODTASBIKA-YVEFUNNKSA-N 348.368 5.085 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc(C#N)s1 811694236 UMLMTVQCKHXCMV-FDAFXCBZSA-N 345.370 5.064 30 20 EKED FC(F)C1CC(=NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 814948956 NIHABZFBFJZPIY-UHFFFAOYSA-N 346.221 5.167 30 20 EKED Cc1cc2ccc(Cl)cc2nc1NN=C1CCC(C)(C#N)CC1 834970694 PEXFWZADOGSSTC-UHFFFAOYSA-N 326.831 5.068 30 20 EKED Cc1ccc2ccccc2c1C[S@](=O)CCCCC1(C#N)CCC1 899398060 UEUMKQFAZYDBCH-XMMPIXPASA-N 339.504 5.261 30 20 EKED O=C(/C=C\c1ccccc1OC1CCCC1)c1ccc(F)cc1F 920063883 JNHCLLPJMOPHNM-XFXZXTDPSA-N 328.358 5.182 30 20 EKED C[C@H]1C[C@@H](Nc2cccc(OCCCC#N)c2)c2ccsc2S1 120860708 POTCBFQEDGAUKK-SUMWQHHRSA-N 344.505 5.468 30 20 EKED CCCCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 173122943 WYHGCRPRGDYJDE-INIZCTEOSA-N 347.528 5.513 30 20 EKED C=CC[C@H](C)[C@@H](C)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 179904616 YPWGKTBETKYBHW-RHGYRFJNSA-N 341.520 5.148 30 20 EKED CC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCC1 426171272 UIOLWQFDJQLEPW-KRWDZBQOSA-N 338.838 5.124 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432503278 WBIBKAHBNOGREW-FQEVSTJZSA-N 349.478 5.675 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cccc(Cl)c1F 477835154 GFCABPHFICCBGG-OLZOCXBDSA-N 348.874 5.904 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2F)s1 480794385 BJHJNESSEHGILH-CQSZACIVSA-N 336.435 5.277 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(SC)cc1OC)c1ccccc1 487497728 DHBNTROHINYHID-KRWDZBQOSA-N 341.476 5.106 30 20 EKED C[C@H](Nc1ccc(NC(=O)c2ccc(C#N)s2)cc1)c1ccccc1 487707115 ZGVVQQMFXPFRSV-AWEZNQCLSA-N 347.443 5.045 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2nc3ccc(Cl)cc3o2)cc1 494168338 KSZRNSANPOFXPU-CQSZACIVSA-N 328.824 5.017 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)cc1 538780712 MZHAYKFEWONGLN-MRXNPFEDSA-N 330.406 5.215 30 20 EKED CC(F)(F)c1ccc(CN[C@H]2CCCCc3cc(C#N)ccc32)cc1 551239907 ACLWJWIXYUNLDP-FQEVSTJZSA-N 340.417 5.227 30 20 EKED CC(C)Oc1ccccc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 611390434 AKZOPOGJXPBBTH-HRAATJIYSA-N 334.463 5.074 30 20 EKED CCCCc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 673813542 BEWFPPFRUFPRLF-INIZCTEOSA-N 326.465 5.099 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2ccc(Cl)cc2)o1 745626232 KKHLZHXHBXFAQF-VURMDHGXSA-N 329.808 5.261 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(Cl)ccc1OCC)c1ccncc1 766019867 NNRXTZDJYWQFRD-KDOFPFPSSA-N 330.859 5.102 30 20 EKED C=CCN(C(=O)Nc1ccccc1SCc1ccccc1)C1CC1 772225918 INJNZPUVHGEHTQ-UHFFFAOYSA-N 338.476 5.161 30 20 EKED C=CCC[C@H](Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1)c1ccco1 796918620 QFLJLAVCJDGOQX-HLIPFELVSA-N 340.467 5.013 30 20 EKED C[C@@H](CC(=O)OCC(C)(C)CCC#N)c1cccc(C(F)(F)F)c1 798876939 VPIBNVZZSLKPLY-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED C#C[C@@H](NCc1c(Cl)ccc2cccnc12)c1ccc(Cl)cc1 811516287 IYXLFIRCDONQKP-GOSISDBHSA-N 341.241 5.006 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1cc(Cl)cc(Cl)c1F 864021645 CEAVXOULQAYYTB-SNVBAGLBSA-N 339.197 5.035 30 20 EKED C=CCC[C@H](NCc1nccn1C1CC1)c1ccc(C(F)(F)F)cc1 893185211 WOHQZCJJDRHLJZ-KRWDZBQOSA-N 349.400 5.034 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1c[nH]c2cc(Cl)ccc12 921268276 AFJAFZYEHIYQBR-KTAJNNJTSA-N 332.186 5.076 30 20 EKED N#CCCC[C@H](N[C@@H]1CCCc2c(Cl)ccnc21)c1ccccc1 926482064 XIDUQSIRZBGDMI-RBUKOAKNSA-N 339.870 5.137 30 20 EKED CCCCCCCCC[C@@H](C)CCN1CCC[C@](CC)(C(=O)O)C1 1776785082 CEJPQKUSLFIKNC-CTNGQTDRSA-N 339.564 5.730 30 20 EKED CSc1ccc(Cl)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 25438292 MTORAKZDSNLBAH-UHFFFAOYSA-N 344.867 5.115 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1C 56469611 CMDSSXAGKBQRFE-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CC1CCC(N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 66955166 VFWGAUIQKWAVGB-PCKAHOCUSA-N 345.512 5.123 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)(F)F 90665616 SSXJENLEVHMIDD-RHSMWYFYSA-N 348.368 5.281 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 160596567 HRHDLASSNHQNIU-LEWJYISDSA-N 349.478 5.070 30 20 EKED N#CCCCCNCc1ccc(-c2ccc(C(F)(F)F)cc2)s1 237846100 YXDOMEGEPPTMST-UHFFFAOYSA-N 338.398 5.217 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCCOc2c1ccc(Cl)c2Cl 348247442 VAOLWWWSKHRYJM-CQSZACIVSA-N 341.282 5.127 30 20 EKED N#CCCC[C@@H](Nc1ncnc2c1oc1ccccc12)c1ccccc1 431492359 CKHWWLTZRZIEJO-QGZVFWFLSA-N 342.402 5.223 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483200992 OEXLJENGTGMPFO-SFHVURJKSA-N 328.415 5.022 30 20 EKED CCCC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(OC)cc1 512620688 SDAVHVSIDJBYAT-VFNWGFHPSA-N 340.442 5.288 30 20 EKED Cc1nc(C)c(C#N)c(S[C@@H](c2ccccc2)c2ccccc2C)n1 518381754 BKSZTKMLODWSCG-FQEVSTJZSA-N 345.471 5.155 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)cc1OC)c1ccccc1 537945972 HKVHCJRFDMTEQA-OXQOHEQNSA-N 325.452 5.062 30 20 EKED C=CCC[C@@H](CC)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 545189542 DQKKZGROLCYIOK-HYBUGGRVSA-N 341.520 5.292 30 20 EKED CCCCOc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 551532859 HHMSKCFNYKCFAO-XMSQKQJNSA-N 336.479 5.561 30 20 EKED C=CCC[C@@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560264635 CHFLMIRDWSUUKL-RDTXWAMCSA-N 341.417 5.117 30 20 EKED CC(C)(C#N)CCSCc1nc(-c2ccccc2Cl)cs1 583656139 IMSGVLGLHVGQPH-UHFFFAOYSA-N 336.913 5.637 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(F)c(Cl)c1 728440878 XEPZZIUQOXJPQS-XQRVVYSFSA-N 349.839 5.560 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H]2CCCc3occc32)cc1 764881063 QSLSZZOXCDEWAI-KSSFIOAISA-N 331.843 5.139 30 20 EKED Nc1c(Cl)cc(C(=O)/C=C/c2nccc3ccccc23)cc1Cl 773162058 SUNOSPISOOLELR-AATRIKPKSA-N 343.213 5.020 30 20 EKED CCCCCCCCC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 786322830 JPJGMVVZKBVQOL-NSHDSACASA-N 336.423 5.090 30 20 EKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 795992917 RXOAYELKSLHWQD-RHSMWYFYSA-N 327.811 5.032 30 20 EKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nc(C2CC2)cs1 842940568 CLLVFKKCIRJNBI-OAHLLOKOSA-N 344.505 5.061 30 20 EKED Cc1ccc(Cl)cc1NC(=O)c1ccccc1-c1ccccc1C#N 7278806 ZPDWKUOVAMJSED-UHFFFAOYSA-N 346.817 5.439 30 20 EKED CCCCCCCOc1cc2c(cc1C(C)=O)C(C)(C)CCS2 139989325 WPHRQJMJLXWVPK-UHFFFAOYSA-N 334.525 6.012 30 20 EKED C[C@H](Nc1cccc(Cl)c1Br)c1cccc(C#N)c1 235545341 FQHWTBCKFISKAH-JTQLQIEISA-N 335.632 5.147 30 20 EKED Cc1c(N[C@@H](C)C(C)C)cccc1/C(O)=N/CC1CCC(C#N)CC1 331265564 HCJIRKGKIXZRHY-AOCRQIFASA-N 341.499 5.086 30 20 EKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)cc1Cl 352175392 VCDCPFQRCPDGBP-LJQANCHMSA-N 340.854 5.122 30 20 EKED N#CCCC[C@@H](NCCCc1ccc(Cl)cc1)c1ccccc1 433023131 ZISYRLDSHLQHNT-HXUWFJFHSA-N 326.871 5.297 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCC1CCC(C#N)CC1 442869413 AQIAKPRSXAMCKZ-MHJFOBGBSA-N 338.520 5.260 30 20 EKED CC(C)[C@H]1CN(C(=O)N[C@H](CCC#N)c2ccccc2)c2ccccc21 447752537 HACUYVCGXQTSAN-WOJBJXKFSA-N 347.462 5.001 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 466641598 KNWXVFODJLEKMP-GJZGRUSLSA-N 342.508 5.206 30 20 EKED Cc1ccccc1C(NCc1ccc(C#N)c(F)c1)c1ccccc1C 479453962 KZNPJFPXCZRXAL-UHFFFAOYSA-N 344.433 5.193 30 20 EKED CC[C@@H](C)[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499604515 DPMMVQAFYCNPDV-VQIMIIECSA-N 348.918 5.117 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccc(F)cc3)n2)cc1 509665706 SZUWBWORGCSEFO-UHFFFAOYSA-N 326.421 5.113 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(C)C)c1 519909241 OIQQFVURHWEJLN-UHFFFAOYSA-N 349.478 5.372 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)CCCC(F)(F)F)cc2)cc1 539941598 KOYYURJYAVOSPD-UHFFFAOYSA-N 348.324 5.022 30 20 EKED CC(C)c1cccc2c1N(C(=O)c1ccc(C#N)cn1)C(C)(C)C[C@@H]2C 560709913 AIHGQAGAZNGKPF-HNNXBMFYSA-N 347.462 5.009 30 20 EKED C[C@H](c1cccc(O)c1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 561733665 DGXNUTOUCYLGKY-QGZVFWFLSA-N 342.442 5.124 30 20 EKED CC(C)c1ccc(NC(=O)N2Cc3cccc(C#N)c3C2)c(C(C)C)c1 593141628 ARQPWQPTNWGRPR-UHFFFAOYSA-N 347.462 5.353 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCc2ccc(F)c(Cl)c21)c1ccccc1 593628622 DQILSKPZDVDGPX-QZTJIDSGSA-N 342.845 5.491 30 20 EKED Cc1ccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)o1 609825405 VWPQOZATSRCXJN-ZDUSSCGKSA-N 340.473 5.578 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1 610830364 ODDHQIYBJLVTJN-QWHCGFSZSA-N 327.497 5.033 30 20 EKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1ccccc1Cl 727261870 JJNJIDRMORIZTG-UHFFFAOYSA-N 342.748 5.117 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccc(O)c3)s2)cc1 727654609 OMADWGDZAOAGGZ-DHZHZOJOSA-N 335.428 5.029 30 20 EKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccsc1 737501384 AWRBELHFLJGPHX-YWZLYKJASA-N 346.455 5.146 30 20 EKED Cc1c(C(=O)/C=C\c2csc(Cl)c2Cl)cnn1C(C)C 761485811 IZURMLYFRXXMLN-PLNGDYQASA-N 329.252 5.037 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H]2CCCc3occc32)cc1 764881062 QSLSZZOXCDEWAI-KDOFPFPSSA-N 331.843 5.139 30 20 EKED Cc1cccc2c1[C@@H](C)/C(=C/c1cccc(OCCCC#N)c1)C2=O 766694279 BVEDOMMPSTVACD-IEOAWGNMSA-N 331.415 5.061 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792103694 LQYXDRBGEIXUDO-RNUYOQPASA-N 346.817 5.168 30 20 EKED C=CCC(F)(F)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 815220775 WDBZNRLBZPKEKQ-CQSZACIVSA-N 330.378 5.010 30 20 EKED N#CCCCCC(=O)O[C@@H](c1ccc2ccccc2c1)C(F)(F)F 851583824 RKANMHNDCHKJLG-KRWDZBQOSA-N 335.325 5.070 30 20 EKED CCCCCCCC(=O)Nc1ccc(OCC)cc1C(F)(F)F 920820271 RWFBOHVMQXUPMV-UHFFFAOYSA-N 331.378 5.403 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1 117951268 RXZMAGFJBWDDML-CHWSQXEVSA-N 349.261 5.135 30 20 EKED CC(C)(C#N)CCSc1nnc(-c2ccco2)n1C1CCCCC1 123676284 AIJIRRBQIIRYHF-UHFFFAOYSA-N 344.484 5.075 30 20 EKED Cc1ccc(C)c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 191947793 KSILBPFFOLOKOR-CQSZACIVSA-N 339.464 5.199 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)C2CCCCC2)cc1 237500285 NGCQZNWVJLAWDY-FDDCHVKYSA-N 348.490 5.389 30 20 EKED CC1(C)CCC[C@H](CC(O)=Nc2cccc([C@@H]3CN=C(O)C3)c2)C1 328855134 JVAFBWSYIIMVEX-ZBFHGGJFSA-N 328.456 5.325 30 20 EKED C=CCCc1ccccc1NC(=O)c1nc(-c2ccccc2)oc1C 410348956 MSAUILZTBVVONZ-UHFFFAOYSA-N 332.403 5.021 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1c(Cl)ccc(C)c1C 434487352 BTJFUBFVYSOLPR-UHFFFAOYSA-N 342.870 5.219 30 20 EKED COc1ccccc1[C@@H](CC(C)C)NCc1ccc(C#N)cc1Cl 439446648 ZJUUXPJANKMFKM-LJQANCHMSA-N 342.870 5.097 30 20 EKED N#CC1CCC(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 442864586 DCVZZRBGRUPTIP-JRSKDTKFSA-N 336.401 5.076 30 20 EKED C=CC[C@H]1N(C(=O)Nc2cccc(COC(C)C)c2)CCCC1(C)C 445232626 BGHRTFXPNKRRDV-LJQANCHMSA-N 344.499 5.210 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H]2CCCC[C@@H]21 475548567 CFNGITMPNSUQKO-DBVUQKKJSA-N 340.511 5.581 30 20 EKED C=CCN(C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 484259154 VSWYORUEFLUXDS-SJORKVTESA-N 345.364 5.028 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2Cc2ccccc2)c1 505887197 UHORGWGNZDTHSP-UHFFFAOYSA-N 346.817 5.055 30 20 EKED CCC[C@H](C(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccccc1 520973888 CCPBGQLBHGNJKU-QFIPXVFZSA-N 348.490 5.127 30 20 EKED C[C@H](Sc1ccc(C#N)cc1)c1nc2ccccc2n1C(F)F 585732103 HMCYVTPPRKHNQI-NSHDSACASA-N 329.375 5.156 30 20 EKED Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C 603968011 GYVCEHGNERWHBX-UHFFFAOYSA-N 332.428 5.156 30 20 EKED CC[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 609378029 OTGDYZGDFKZROI-WBVHZDCISA-N 338.476 5.071 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1Cl 619755365 FYPIFBJHRJUYRB-GOSISDBHSA-N 331.246 5.032 30 20 EKED C[C@@H](Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc(C#N)cc1 743465711 QJPFMCGRVMDGOZ-OAHLLOKOSA-N 334.419 5.163 30 20 EKED N#CCCC[C@@H](NC(=S)Nc1ccc(Cl)cc1)c1ccccc1 814209380 ACOLICYGINSGLC-QGZVFWFLSA-N 343.883 5.062 30 20 EKED Cc1nc(C)c(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)o1 821028715 VUGICEPDQIXZHO-AATRIKPKSA-N 330.598 5.148 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C2CCCC2)cc1 1776784149 LEEUECNQLXKYRN-NRFANRHFSA-N 345.527 5.638 30 20 EKED N#Cc1ccc(CSc2nnc(-c3ccc4ccccc4c3)o2)cc1 42180892 FTJKYQVBVFDABF-UHFFFAOYSA-N 343.411 5.054 30 20 EKED COc1ccc2oc([C@H](C)N[C@H](C)c3ccc(C#N)cc3)c(C)c2c1 154336094 CRWFXPVPSVJCTL-CABCVRRESA-N 334.419 5.033 30 20 EKED O=C(/C=C/c1csc2ccccc12)c1c(Cl)nc2sccn12 303879990 IXAWCVRSLWGNRD-AATRIKPKSA-N 344.848 5.160 30 20 EKED CC(O)=Nc1cc(N=C(O)N[C@H]2CCCCC23CCCC3)ccc1F 329595817 BZNSEAFGSDHPGG-KRWDZBQOSA-N 347.434 5.072 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1ccc(Cl)c2ccccc12 462479430 LOUXAWNRIRMFPU-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCC1CCCC1 463750024 ABGLXDDVLBXSBO-OAHLLOKOSA-N 330.497 5.380 30 20 EKED CC#CCCCC(=O)N(Cc1ccco1)Cc1cc2cc(C)ccc2o1 467791836 XAGJMOXTHSBDSR-UHFFFAOYSA-N 349.430 5.057 30 20 EKED CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 475901519 RISKGIASXJBVAQ-UHFFFAOYSA-N 340.854 5.198 30 20 EKED C=C[C@@H](CC(=O)Nc1cnn(CCCC)c1C(C)C)c1ccccc1 482719766 YKKNWIFAXHSVEY-KRWDZBQOSA-N 339.483 5.105 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc2ccccc12 521763883 CKKGFTBRSNHAIA-UHFFFAOYSA-N 343.430 5.154 30 20 EKED C=CCOc1ccc(CN[C@@H]2C[C@H](C)Sc3sccc32)cc1 552323951 WPIROWCXCYPRJZ-SUMWQHHRSA-N 331.506 5.028 30 20 EKED N#Cc1c(NC[C@@H]2CCCO[C@H]2c2ccccc2)cccc1C(F)F 570610336 UDOLNXSFIMOAMG-KXBFYZLASA-N 342.389 5.076 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCC(C)(C)C 609968729 BPDIQZUZMGQRMK-UHFFFAOYSA-N 336.435 5.424 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccsc1 682777647 OZTFLCONGMOKPC-UHFFFAOYSA-N 328.481 5.264 30 20 EKED CCC(CC)[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccccc1 727466813 JCRXBLAVQGMQGB-QHCPKHFHSA-N 349.522 5.304 30 20 EKED O=C1/C(=C/c2ccsc2)CCc2nc(-c3ccc(F)cc3)sc21 727685763 ZSCHLKJUAWOFTK-UKTHLTGXSA-N 341.432 5.223 30 20 EKED C=CCCCCCN(C)C(=S)Nc1cc(Cl)cc(Cl)c1 739458622 OLZDDYPANAPVMR-UHFFFAOYSA-N 331.312 5.368 30 20 EKED C=C(Cl)COc1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 740765234 SRSCUFOLLUVHRV-ZHACJKMWSA-N 349.817 5.262 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccccc1C(F)(F)F 749885825 GIOYXMSZYJGXLP-KHPPLWFESA-N 343.304 5.257 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2cccc(C(F)F)c2Cl)cc1 757936425 NESLJFXYPREGMW-LLVKDONJSA-N 336.769 5.181 30 20 EKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 776188542 VNJOMGOKSFUKIK-UPHRSURJSA-N 345.242 5.015 30 20 EKED COc1cc(C(=O)/C=C/c2cc(C)c3ncccc3c2)ccc1SC 783705747 CBZQCBCSKWRCEK-SOFGYWHQSA-N 349.455 5.170 30 20 EKED CC[C@H](CC#N)OC(=O)c1sc2cc(Cl)ccc2c1Cl 787098538 FQNQWOPPLNZIST-SECBINFHSA-N 328.220 5.057 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/Sc1ccccc1 789718941 LDGIVHJMCYSWOA-CCEZHUSRSA-N 337.488 5.783 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(Br)nc1)c1ccccc1 810228770 YRFDZFYOSNUFTN-YOEHRIQHSA-N 345.284 5.202 30 20 EKED Cc1cc(Cl)cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1O 815635615 GLKBWXTVWHXJSS-DNVCBOLYSA-N 342.870 5.440 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC[C@H](CCC)c1ccccc1 1776782379 NORIBZVAQUSCJA-VQTJNVASSA-N 333.516 5.364 30 20 EKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2csc(C(=O)O)c2)c1 1777461703 GWNDAXIQIVOHHM-KTKRTIGZSA-N 348.423 5.318 30 20 EKED Cc1cccc(Oc2ccccc2NC(=O)c2cccc(CC#N)c2)c1 97364937 PDXFUDLEFOVHSC-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C=CCN(C)C(=O)c1oc2ccccc2c1CSc1cccs1 161529725 RJVXVRZNMWSZEB-UHFFFAOYSA-N 343.473 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2cc(C)ccc12 189870842 BAWFEKJRQVXDBC-UHFFFAOYSA-N 346.474 5.509 30 20 EKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 193495178 PXUKPCNGERQRAK-FQEVSTJZSA-N 347.462 5.165 30 20 EKED Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 285329270 BRTFTNVHOKFSMH-CYBMUJFWSA-N 342.464 5.216 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Oc2ccccc2)cc1 439571898 OEABIQABOSCMIV-MSOLQXFVSA-N 342.442 5.762 30 20 EKED N#C[C@H]1CC[C@H](Sc2nnc(-c3ccccc3)c3ccccc23)C1 450684249 RGCFGRDQXIJJGG-HOCLYGCPSA-N 331.444 5.081 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 466568799 XIBFIVVGLSONEI-KRWDZBQOSA-N 338.451 5.175 30 20 EKED Cc1cccc2cc(C(=O)N[C@@H](CCCC#N)c3ccccc3)sc12 487487967 UFZQHXFZWKVQHF-SFHVURJKSA-N 348.471 5.375 30 20 EKED N#C[C@@H](Nc1ccc(F)cc1OCCC(F)(F)F)C1CCCCC1 507712738 DKFKXYCNYBNQNM-OAHLLOKOSA-N 344.352 5.041 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1 521821034 UPHPYBPMFWEYAJ-HXUWFJFHSA-N 327.855 5.146 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(F)c1 539216530 FGBGGFOIRPRNEK-INIZCTEOSA-N 330.406 5.215 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)c(F)c1 539609761 LVEIDEAZTTVSBH-CVEARBPZSA-N 345.421 5.171 30 20 EKED C=CCC[C@H](NCc1ccccc1CN1CCCCC1)c1ccco1 572668621 JMRQVGQRHQUVHM-NRFANRHFSA-N 338.495 5.063 30 20 EKED CC1(C#N)CCC(Nc2ccc(C(F)(F)C(F)(F)F)cc2)CC1 590649941 VVCVNHPDBQSGBV-UHFFFAOYSA-N 332.316 5.225 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(C#N)c(Cl)c2)c(C)c1 604083475 WKXKQVJABHUTEJ-CQSZACIVSA-N 341.842 5.053 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 605965269 XLESZQVTHJZGHI-KRWDZBQOSA-N 348.899 5.099 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(C)c3ccccc3C#N)sc2c1 611072006 LYKSDEVTYYYIMQ-UHFFFAOYSA-N 340.835 5.011 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1Cl 618808037 YRPIXYZIMGNJJR-DIFFPNOSSA-N 331.246 5.203 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccccc1OCc1ccccc1 728695767 FYWBZYAGMVWOOF-OUKQBFOZSA-N 349.817 5.210 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc2ccccc2c1 731835895 VFFCVYJBWPTECI-OUKQBFOZSA-N 325.367 5.391 30 20 EKED C=CC[C@H](OC(=O)Cc1nc(-c2ccccc2)oc1C)c1ccccc1 778740489 ZAUPGPKCWPJJAR-FQEVSTJZSA-N 347.414 5.053 30 20 EKED CCCCCCC[C@@H](C)CN[C@@H]1CCN(C(C)=O)Cc2ccccc21 779021057 XCTLQZONZURXQB-XMSQKQJNSA-N 344.543 5.066 30 20 EKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc2ccccc2c1 788344881 LOAGPQTYJMLBAN-BQYQJAHWSA-N 333.334 5.211 30 20 EKED CCCCCCCC[S@@](=O)Cc1nc(-c2ccccc2)oc1C 790135243 OQPFUYHVXVJINT-HSZRJFAPSA-N 333.497 5.259 30 20 EKED CCCNc1ccc(C#N)cc1NCc1csc(C2CCCC2)n1 795268007 PYYNWALNIZDNPG-UHFFFAOYSA-N 340.496 5.106 30 20 EKED CC(/C=C/C(=O)c1ccccc1C#N)=C\c1ccccc1OC(F)F 811690352 BHSGYVKRLNOOLX-CYZWUHAYSA-N 339.341 5.002 30 20 EKED CC[C@@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1O 842888246 QROKSDYCZLPXFL-MRXNPFEDSA-N 349.261 5.006 30 20 EKED CCCC(=O)Nc1cccc(N[C@@H](CC)c2cccc(C#N)c2)c1C 902905754 QOBZFEGQNHSQBY-SFHVURJKSA-N 335.451 5.169 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1C 916850003 XSOXAPCRZRIFCF-XADARROHSA-N 340.426 5.050 30 20 EKED CCc1ccc(C(CC(C)C)=NNc2cccc(C(=O)O)c2C)cc1 1776088979 UXCKTMAFNBMKBO-UHFFFAOYSA-N 338.451 5.118 30 20 EKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777477281 UTBROTOQFNKKKA-DHZHZOJOSA-N 348.423 5.318 30 20 EKED N#Cc1csc(CNc2cccc(COC3CCCCC3)c2)c1 123606232 SQJRDORKDJYAQJ-UHFFFAOYSA-N 326.465 5.081 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(C#N)s1 176973034 LZNLWLQNBGFFQB-GOSISDBHSA-N 338.501 5.063 30 20 EKED C[C@@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1cccc(C#N)c1 181901648 NGOPWVBGGRAKFJ-QVKFZJNVSA-N 347.849 5.047 30 20 EKED COc1cccc2cc([C@@H](C)N[C@H](CCC#N)c3ccccc3)oc12 182052978 HJRNUBPXUOIRBF-CRAIPNDOSA-N 334.419 5.137 30 20 EKED CC1(C)CCC[C@H](CC(O)=Nc2cccc([C@H]3CN=C(O)C3)c2)C1 328855129 JVAFBWSYIIMVEX-GDBMZVCRSA-N 328.456 5.325 30 20 EKED COC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340446642 GSAWYTGMKFNISJ-PMACEKPBSA-N 342.870 5.052 30 20 EKED N#CC1(CCSc2nnc(-c3ccccc3Cl)o2)CCCCC1 412988817 BHGIXTDEQSBPHX-UHFFFAOYSA-N 347.871 5.346 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)cc1 442911863 BKXWTLLLHSZQAR-CQSZACIVSA-N 349.459 5.585 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 449444430 BNKAALYNLRMOHG-IKICRFKJSA-N 336.401 5.013 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCCOc1ccc(F)cc1 462228709 DLPVHZVBZMLROD-OAHLLOKOSA-N 344.455 5.101 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C 466440274 FQZUUFYGMZVNMP-NWDGAFQWSA-N 326.267 5.041 30 20 EKED C[C@H](c1cccs1)N(CCCC(C)(C)C#N)Cc1ccccc1 472440289 QFVMHVXMHVZGQT-QGZVFWFLSA-N 326.509 5.641 30 20 EKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccc3ccccc3c2)c1 518818390 AXOIVWFWJQEJQO-RUZDIDTESA-N 348.449 5.591 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1ccc(-c2ccccc2)cc1 521485699 LPPNUYMLIVRXFO-UHFFFAOYSA-N 334.463 5.146 30 20 EKED CCc1ccc([C@H](C)CC(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1 523111254 IBFZWOABKBGRMD-MSOLQXFVSA-N 348.490 5.224 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 539497210 YOCSPCROMONZAV-VLIAUNLRSA-N 336.435 5.199 30 20 EKED C=CCCCSCc1csc(-c2cccc(OC)c2OC)n1 563770430 PLWUBOQKXUXCHA-UHFFFAOYSA-N 335.494 5.027 30 20 EKED N#Cc1ccc2c(c1)[C@@H](NC1(c3ccc(Cl)c(Cl)c3)CC1)CC2 589342746 INGNCPNPFVYKNX-SFHVURJKSA-N 343.257 5.131 30 20 EKED Cc1ccc(CN(C(=O)CCCCC#N)[C@H]2CCc3ccccc32)cc1 593964982 PSYPNRDDFLNAJM-QFIPXVFZSA-N 346.474 5.095 30 20 EKED CCCCc1noc([C@@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)n1 609850360 TYJRSCZVHQDHSJ-OAHLLOKOSA-N 347.418 5.091 30 20 EKED N#CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)c1 730151697 PNYQKUNYHSXLLU-KTKRTIGZSA-N 345.423 5.214 30 20 EKED C=CCCCCCN(C)C(=O)c1cc2c3ccccc3n(C)c2s1 739654511 OOTPTSIIMFLGPW-UHFFFAOYSA-N 340.492 5.211 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2cccc(F)c2)s1 750907975 ZZTSEZIKVUDPFE-ALCCZGGFSA-N 329.421 5.215 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc(CCC(F)(F)F)cc1 753138443 NZEWKDSUWWYRED-UHFFFAOYSA-N 344.336 5.186 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 766022981 YRVQUXMLVXTMAK-WZONZLPQSA-N 344.458 5.842 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3sccc3Cl)c2)s1 785474523 JWWCFENGTVLISG-UHFFFAOYSA-N 344.892 5.291 30 20 EKED Cc1cccnc1[C@@H]1CCCC(=NNc2nc3ccccc3s2)C1 799105447 XQJFMJVZSPISEG-CQSZACIVSA-N 336.464 5.125 30 20 EKED CCCC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 800386327 JAWUICWKOXIWCL-NEPJUHHUSA-N 348.418 5.091 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)s1 802833574 OOMMFVDNYKFMFS-CAOSSQGBSA-N 344.524 5.223 30 20 EKED Cc1ccc(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 814209477 BAMICKGFKIGPBK-IBGZPJMESA-N 337.492 5.025 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N(C)C)cc1 815635461 DARPLTIZQZXLNX-YADHBBJMSA-N 335.495 5.228 30 20 EKED N#CCCCn1cc(-c2nc(C3CCCCCC3)no2)c2ccccc21 904685251 HEPQVDDJOORRTN-UHFFFAOYSA-N 348.450 5.433 30 20 EKED CC(C)[C@@H]1/C(=C\c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776308781 MUXKDUNGYOWEPC-YZILGEIOSA-N 346.382 5.151 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1cccc(CCC(=O)O)c1 1776786018 CJGBNDNBLPYXCQ-INIZCTEOSA-N 333.472 5.029 30 20 EKED N#CCCCOc1cccc(/C=C(\Cl)c2nc3ccccc3o2)c1 171148783 QVQMESBOWJBHIP-SSZFMOIBSA-N 338.794 5.247 30 20 EKED N#CCCCCSc1nnc(-c2ccc(F)cc2)c2ccccc12 180377841 RBOCKELCSSNSPJ-UHFFFAOYSA-N 337.423 5.222 30 20 EKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C#N)cc1 182102814 CXBZPBLJBSQTNI-YVEFUNNKSA-N 336.332 5.042 30 20 EKED CCc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)s1 208160638 FMMHXJCVNMOCQQ-LUAWRHEFSA-N 325.458 5.330 30 20 EKED N#Cc1cc(Cl)ccc1CSCc1ncccc1C(F)(F)F 432235757 MAOIKSJDUNQBNX-UHFFFAOYSA-N 342.773 5.059 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 437470094 GCFVPMIVRJYSEM-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H](Nc1cccc(COc2cccc(F)c2)c1)c1ccc(C#N)cc1 439551363 PHOBRWUEJBLHSZ-MRXNPFEDSA-N 346.405 5.449 30 20 EKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ccccn3)o2)cc1 442641844 BARYABPCEAHKPH-KRWDZBQOSA-N 344.414 5.129 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 449447162 WMYIWDNVNKUQKI-VIBAHUMZSA-N 336.401 5.013 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(Cl)c1 464974560 RPHFQXCXJHFOEW-LLVKDONJSA-N 348.830 5.126 30 20 EKED Cc1c([C@@H](C)NC(=O)C[C@@H](CC#N)c2ccccc2)oc2ccccc12 474950117 VFUAWMXUHXBYST-SJLPKXTDSA-N 346.430 5.006 30 20 EKED CSc1ccc(Cl)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 475179860 XQUWLLPQLSXJOH-CQSZACIVSA-N 344.867 5.088 30 20 EKED C=CCC[C@H](CCC)Nc1ccc(NC(=O)CC(F)(F)F)cc1 510935810 UEUOIMGKXIOHAC-ZDUSSCGKSA-N 328.378 5.124 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(Cl)cc1)c1ccccc1 533883799 COMGLYREVIOASQ-JXFKEZNVSA-N 339.866 5.363 30 20 EKED Cc1cccc(C(NCc2ccc(CC#N)cc2)c2cccc(C)c2)c1 543149778 IPXCVVOCSMLOEI-UHFFFAOYSA-N 340.470 5.249 30 20 EKED CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1cccc2ccccc12 547954826 KUSZIPCMQXVBCT-UHFFFAOYSA-N 334.806 5.032 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(N2CCCCCC2)cc1C 552649099 ZHLVQLPFRCLRIQ-UHFFFAOYSA-N 326.484 5.082 30 20 EKED C[C@@H](NCc1cc2c(s1)CCCC2)c1ccc(C#N)cc1Cl 555783919 ZSNRLHVHBHXUAJ-GFCCVEGCSA-N 330.884 5.003 30 20 EKED CC(C)[C@H](C#N)c1ccc(-c2ccccc2OC[C@H]2CCOC2)cc1 592987215 XHACBYYTDMMDNM-UWJYYQICSA-N 335.447 5.032 30 20 EKED C[C@@H](SCC1(C#N)CCC1)c1nnc(-c2ccc3ccccc3c2)o1 601055855 CYTRPCVXLDKUHM-CQSZACIVSA-N 349.459 5.378 30 20 EKED N#CC1(C(=O)Nc2cccc(CSC3CCCC3)c2)CCCCC1 610123052 WZEKNUSDFIFGAR-UHFFFAOYSA-N 342.508 5.275 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1cccc(-c2nccs2)c1 611482450 IRVLSCUBHJBTSX-LJQANCHMSA-N 331.444 5.171 30 20 EKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1ccccn1 673812003 MWGUJEAKTHPCIE-INIZCTEOSA-N 348.789 5.017 30 20 EKED C#Cc1cccc(NC(=S)Nc2cc(Cl)c(C)c(Cl)c2)c1 726482073 YMORABUVCJJKRZ-UHFFFAOYSA-N 335.259 5.092 30 20 EKED O=C1/C(=C\c2cc(C(F)(F)F)ccc2F)CCc2sccc21 733206288 FYNNMEZIWGXVSL-CLFYSBASSA-N 326.314 5.119 30 20 EKED Cc1cccc(COc2ccc(C(=O)/C=C/c3scnc3C)cc2)c1 742434902 PQIUEKBNMJXNPT-ZHACJKMWSA-N 349.455 5.235 30 20 EKED C#CC[C@@H](N[C@@H](C)c1ccc(OCC(F)(F)F)cc1)c1ccccc1 773118053 YJWJXZYXGJXWNI-HNAYVOBHSA-N 347.380 5.043 30 20 EKED CCCC[C@](C)(F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 850770898 DKXYXLCOEVABIR-ZBEGNZNMSA-N 338.835 5.044 30 20 EKED C=CCC1(c2nc(-c3ccc(-c4ccccc4)cc3)no2)CCOCC1 904549393 ROMZMJIYONMGMK-UHFFFAOYSA-N 346.430 5.028 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2CCCCC2)cc1 915353578 PCFGGXFHSAYRFE-OAQYLSRUSA-N 347.462 5.044 30 20 EKED CCC(CSc1ccc(Cl)cc1)=NNc1cccc(C(=O)O)c1 1776036851 FTLLFTCFHRRNDJ-UHFFFAOYSA-N 348.855 5.008 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 131100657 SDVQIMSSRUUVDQ-UHFFFAOYSA-N 341.373 5.200 30 20 EKED CC(C)(C#N)c1ccccc1CNc1cccc(Oc2ccccn2)c1 131815897 YFVADDHHXFYJAO-UHFFFAOYSA-N 343.430 5.287 30 20 EKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1ccc(Cl)cc1Cl 235554406 LDLAILPZDSVOLI-LURJTMIESA-N 332.643 5.148 30 20 EKED C[C@@H]1CC(C)(C)CC[C@@H]1/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330010845 IIVJCAVVSPHEPK-MFNRNEDNSA-N 334.504 5.083 30 20 EKED CCC(O)=Nc1ccc(C)c(N=C(O)N[C@@H]2C[C@H]2C2CCCCC2)c1 330282989 AZTRLYQXVGRJKE-FUHWJXTLSA-N 343.471 5.097 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(C#N)c1 464486209 WQYMWLSDJZFKJR-MRXNPFEDSA-N 332.447 5.152 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(C)cc(C)cc2[nH]1 476789911 FWMYXLBVNQAWKN-UHFFFAOYSA-N 346.474 5.889 30 20 EKED C[C@H](NC(=O)C1(C#N)CCCCC1)c1ccc(Oc2ccccc2)cc1 506272053 PVPLMXGECIXGPA-KRWDZBQOSA-N 348.446 5.130 30 20 EKED C[C@@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1ccc(C#N)cc1 513974773 SGSDMEWSUGQQHE-CQSZACIVSA-N 347.443 5.169 30 20 EKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc2ccccc12 537042199 ZTTTUDDFTYHIDS-QGZVFWFLSA-N 328.459 5.492 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 540604858 ALUCFZLUQNYVIX-OXQOHEQNSA-N 332.472 5.254 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(F)cc1Cl 546756731 UHUMXLSCYKPARD-LBPRGKRZSA-N 334.847 5.343 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H]3CCc4ccc(C#N)cc43)oc12 562095475 CJEDKGDZJUHJKR-AUUYWEPGSA-N 346.430 5.041 30 20 EKED Cc1nc(SCCC(C#N)(c2ccccc2)c2ccccc2)[nH]c1C 568299647 NZHSLXJUOQHHOF-UHFFFAOYSA-N 347.487 5.019 30 20 EKED N#CCCCCC(=O)N(Cc1cccc2ccccc12)C1CCCC1 593973659 PKQWBDHTXODECV-UHFFFAOYSA-N 334.463 5.195 30 20 EKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1cccc(C#N)c1 603645317 GVRHDZZXYXHTGE-LLVKDONJSA-N 348.233 5.090 30 20 EKED CC1CCC(C)(NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 609436821 VEZFIHASAUWTLQ-XAUUPUKJSA-N 345.512 5.171 30 20 EKED C[C@@H](CCC(C)(C)C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609929965 QVJSNLGKEZZVRK-CABCVRRESA-N 347.528 5.275 30 20 EKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3Cl)c2)cc1 609985898 PKOOLTOLBKUOHA-UHFFFAOYSA-N 347.805 5.208 30 20 EKED CCCCCCCCC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 754717176 OXTZQFNMLTUZIE-UXHICEINSA-N 349.490 5.255 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3cccc(Cl)c3o2)n1 783106691 KEXRPWDSMQYHMR-LLVKDONJSA-N 344.823 5.156 30 20 EKED Cc1cc(C)cc(NC(=S)N[C@H](CCCC#N)c2ccccc2)c1 814210394 OBBRKFOIZKHMDI-LJQANCHMSA-N 337.492 5.025 30 20 EKED CC/C(=C\C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 817318637 FKPUXNDNKQCXAG-APOCOGJHSA-N 332.447 5.031 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(C(C)(F)F)c1 1776784738 OXIDWBBLHBKWQA-KRWDZBQOSA-N 341.442 5.092 30 20 EKED N#CCC[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1 164293060 ITOQNJHIFSZNSL-KRWDZBQOSA-N 329.325 5.034 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2cccc(CSC3CCCC3)c2)CC(O)=N1 329678909 QOJSEZWDCJOOHW-UKRRQHHQSA-N 346.496 5.205 30 20 EKED C=CCN(C(=O)c1ccc(C=C)cc1)c1nc(-c2ccccc2)cs1 431025555 ZAOKXYGUMGZQOR-UHFFFAOYSA-N 346.455 5.286 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1ccccc1OCc1ccccc1 442872951 JLTGEBNOKIXETL-XEVCZEQESA-N 348.490 5.246 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@@H]1C(C)C 455245942 MFGQEWIOROVUDZ-FQEVSTJZSA-N 340.511 5.581 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)NCCc1cccc(C#N)c1 466817170 ROSRIRVUMGMXQK-UHFFFAOYSA-N 349.478 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccccc1F 475550957 UXHCRURLVMERKW-UHFFFAOYSA-N 340.442 5.042 30 20 EKED C=C[C@@H](CC(=O)Nc1ccccc1-c1csc(C)n1)c1ccccc1 477692862 IEBOLUIBCDIBKD-INIZCTEOSA-N 348.471 5.417 30 20 EKED C=C(C)[C@H](NCc1ccc(OC)c(Cl)c1)c1ccc(F)c(F)c1 479420895 MPZMWPHHPFIJHT-SFHVURJKSA-N 337.797 5.034 30 20 EKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccccc2F)cc1 479510218 FMMCGLMDAUKBMF-UHFFFAOYSA-N 348.402 5.101 30 20 EKED N#C[C@@H](C(=O)c1ccc(F)c2ccccc12)c1nccc2ccccc12 483989397 VODJHQRQKIHQTI-LJQANCHMSA-N 340.357 5.017 30 20 EKED C=CCC[C@H](NCC1CC(OCC)C1)c1ccc(C(F)(F)F)cc1 509019978 AXPYQAOUGVUUHM-UYJHFMRCSA-N 341.417 5.117 30 20 EKED N#Cc1ccc(SCc2cc(-c3ccc(Cl)cc3)no2)cc1 509636297 OWZBHERIMPCKSQ-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(O[C@@H](C)CC)cc1 510986304 VCQWFYQPXQHNNE-HNNXBMFYSA-N 344.480 5.146 30 20 EKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H](c2nc3ccccc3s2)C1 527482130 PYKFHXDXHNGVDW-MAUKXSAKSA-N 347.487 5.109 30 20 EKED CC[C@@H](C)Cc1c(C)sc2nc(SCCCCC#N)nc(O)c12 539548850 VAKRWGVWVQSWRY-LLVKDONJSA-N 349.525 5.080 30 20 EKED C=CCC[C@H](NCc1cccc(NC(=O)CC(C)C)c1)c1ccco1 575010386 ONQJFIMKXXNOBY-IBGZPJMESA-N 340.467 5.061 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccc(C#N)cc1 728442140 XGPLACSWQTTYAB-KHPPLWFESA-N 348.402 5.025 30 20 EKED CCCCCCOc1cccc(CN[C@H](C)c2ccc(C#N)cc2)c1 747094193 FBKVRBXSVFEXTL-GOSISDBHSA-N 336.479 5.368 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1ccc(C2SCCS2)cc1 768360063 ZVKHEUPTXFIYEM-UHFFFAOYSA-N 349.521 5.042 30 20 EKED CC(C)(C#N)CCOC(=O)[C@@H](Sc1ccccc1)c1ccccc1 776357967 WKSYZEYGQQKOSA-SFHVURJKSA-N 339.460 5.003 30 20 EKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792094011 LNXLHBAWHLMNOA-OAQYLSRUSA-N 342.442 5.167 30 20 EKED Cc1nccn1-c1ccc(C(=O)/C=C/c2ccc(C(F)F)cc2)cc1 794940614 BSEOXGVTHMHYQX-NYYWCZLTSA-N 338.357 5.014 30 20 EKED CC(C)c1ccc(C2(O)CCC(Nc3ccc(CC#N)cc3)CC2)cc1 816569240 DIPBKBRHTYYERU-UHFFFAOYSA-N 348.490 5.118 30 20 EKED COc1ccc2cc(C(=O)/C=C\c3ccc4ncccc4c3)ccc2c1 916136942 HDMSKCOFZXQYDZ-WZUFQYTHSA-N 339.394 5.293 30 20 EKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1cccc(C(=O)O)c1 1776037280 SVIFDPVSIVBBFK-UHFFFAOYSA-N 349.434 5.022 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1c(CC)cccc1CC 62374395 JVICEVBLMFRKKH-UHFFFAOYSA-N 336.479 5.074 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cc(F)ccc1F 108407515 BVQHZOYRXQHCPB-QWHCGFSZSA-N 332.419 5.390 30 20 EKED CC(C)Oc1ccc(NCc2ccc(O[C@@H](C)C#N)cc2)cc1Cl 178802974 QCXJZEMGXDBTKI-AWEZNQCLSA-N 344.842 5.030 30 20 EKED Cc1cc(C#N)ccc1CN[C@H](C)c1sc(-c2ccccc2)nc1C 186329254 DTSRZNCTEYGIKW-OAHLLOKOSA-N 347.487 5.149 30 20 EKED C[C@@H](SCc1nc(C#N)cs1)c1ccc(C(F)(F)F)cc1 419407461 WNLBWAHUSIALEM-SECBINFHSA-N 328.384 5.028 30 20 EKED Cc1ccccc1[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)C(C)C 438846745 KRMYSFQTHOAFLG-RTWAWAEBSA-N 349.478 5.036 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)Nc2cccc3ccsc23)cc1 443831903 YXRAUPJENFOLPK-UHFFFAOYSA-N 335.432 5.346 30 20 EKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc(C#N)cc3)s2)cc1 505768252 IGNNZLFHXQQBGO-CYBMUJFWSA-N 349.459 5.172 30 20 EKED C=CCN(Cc1ccccc1)[C@@H](C)c1nc2ccccc2n1C(F)F 506263370 IWEFELPKYYTYAN-HNNXBMFYSA-N 341.405 5.181 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc3c4c(cccc24)CC3)n1 531331218 HENLNCJZOQCJLE-QGZVFWFLSA-N 346.455 5.008 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c2ccccc12 551221093 AQBLUAQDLXIGBA-HXOBKFHXSA-N 346.449 6.065 30 20 EKED Cc1cc(Sc2ccccc2)ccc1NC(=O)CCCCCC#N 588153983 GMIQVOMHYDVLOC-UHFFFAOYSA-N 338.476 5.559 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Oc1cccc(F)c1 588891105 YSYKOCUWEJXHBH-UHFFFAOYSA-N 326.371 5.031 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)Oc2c(Cl)cccc21 729150645 LGRYBSYRBQZFQX-MLPAPPSSSA-N 345.832 5.141 30 20 EKED CCCCCC[C@H](CC)C(=O)Nc1nc(C)c(SCC#N)s1 735002626 LEFDOBBPOYVDQP-ZDUSSCGKSA-N 339.530 5.002 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc2cc(O)ccc2c1 749893658 JGPHLLPYKKZAAA-PKNBQFBNSA-N 341.366 5.097 30 20 EKED CCCCCCCCC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 754717178 OXTZQFNMLTUZIE-WOJBJXKFSA-N 349.490 5.255 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(Cl)c(Cl)cc1O)c1ccncc1 774185491 CAMZWADOFDXACA-MEDUHNTESA-N 337.250 5.062 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2C[C@H](C(C)C)c3ccccc32)c1 774243406 KJZBLQLPGQALEN-YSZBQJHXSA-N 348.490 5.342 30 20 EKED CC(CCCC(F)(F)F)=NNc1ncc(C(F)(F)F)cc1Cl 774308378 CGMVTTLTZGDOQX-UHFFFAOYSA-N 347.690 5.274 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCc3cc(SC(F)F)ccc32)cc1 775378656 NEJIWHZUPAXATN-GOSISDBHSA-N 344.430 5.040 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2cc(Cl)cc(C(F)(F)F)c2)cn1 780185948 AOYRFJJTBUMKPA-ONEGZZNKSA-N 342.748 5.032 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1cc2ccccc2o1 796992042 LAWZHGNGXMKTNG-KTKRTIGZSA-N 349.386 5.592 30 20 EKED CCCC[C@](C)(F)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 850762861 PRHFJDOFPUTXNH-BEFAXECRSA-N 344.455 5.213 30 20 EKED Fc1ccc(CON=Cc2ccccc2C(F)(F)F)c(Cl)c1 852191352 LCCZJLHQSYMMFB-UHFFFAOYSA-N 331.696 5.049 30 20 EKED C=C[C@H](CC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 126343095 MIFPRJBHRCDNHV-OAHLLOKOSA-N 347.380 5.480 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 159276194 KYWCYUUZZOTQJE-INIZCTEOSA-N 345.512 5.148 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Cl)nc1 180220898 XZTFDMSRHMWXCP-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C[C@@H](SCc1nnc(-c2ccccc2)s1)c1cccc(C#N)c1 190827301 DNSKJRRAUWORKR-CYBMUJFWSA-N 337.473 5.071 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(F)[C@H](C)C1 290074659 CNEKIACLIPQZIE-CQSZACIVSA-N 336.426 5.048 30 20 EKED OC(=Nc1cccc(C(F)F)c1)C1CCC(/N=C(/O)C2CC2)CC1 330029487 QBRYFYWXBLPBSH-UHFFFAOYSA-N 336.382 5.138 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F 466426941 UKFPRICSSIHUQR-BXUZGUMPSA-N 333.781 5.004 30 20 EKED C[C@@H](c1cccc(C(F)(F)F)c1)N(CCCC(C)(C)C#N)C1CC1 472428187 DMTXWCGYGDUQNC-AWEZNQCLSA-N 338.417 5.561 30 20 EKED CCCN(C(=O)Nc1ccc(F)c(C#N)c1)[C@H](CC)c1ccccc1 481680789 ACQNSJJJOGGZEL-LJQANCHMSA-N 339.414 5.093 30 20 EKED C=CCC[C@H](N[C@@H](C)[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 507511412 OCYJIGNHJLWSRY-ZVZYQTTQSA-N 341.417 5.117 30 20 EKED N#CC1(CCCSCCc2ccc3ccccc3c2)CCOCC1 507696158 ZXLOUVKRVVFYPF-UHFFFAOYSA-N 339.504 5.216 30 20 EKED CC(C)(C)CCC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 523102016 MYDMFIGDIFUZAW-UHFFFAOYSA-N 338.476 5.150 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1cc(C)ccc1C)c1ccccc1 534725325 GJZDVRCRJAMPIA-DENIHFKCSA-N 333.475 5.327 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCCC(C)(C)C1 535157964 RICFIUZNOQWHNE-LSDHHAIUSA-N 330.497 5.236 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@H](c2ccccc2)CC1)c1ccccc1 535340012 MAHHRHRGWNNLDI-DENIHFKCSA-N 333.475 5.143 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(-n2cccn2)cc1)c1ccccc1 540150299 HOHWKHFUYVRCMG-GCJKJVERSA-N 331.463 5.230 30 20 EKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 614179887 QRUUHXVRZZCONM-LJQANCHMSA-N 326.871 5.382 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1nc(-c2ccccc2)cs1 732571203 NKWZPLFECHWQGG-PKNBQFBNSA-N 342.423 5.254 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)s1 736434833 WNIZOLXGFYQRDB-ALCCZGGFSA-N 344.867 5.471 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2cnn(C(C)C)c2)cc1 741466822 AGFPGRWVBADCNL-JLHYYAGUSA-N 346.430 5.036 30 20 EKED N#Cc1csc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1 754689791 MWRWIRGFZBKWHM-DUXPYHPUSA-N 341.741 5.188 30 20 EKED C[C@H](Nc1cccc(C(F)F)c1Cl)c1ccc(OCC#N)cc1 757661863 UKRXFQUXLKBTEV-NSHDSACASA-N 336.769 5.353 30 20 EKED CC[C@@H](C)c1ccc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 767968073 FHYWTGLKNDENCX-QGZVFWFLSA-N 344.458 5.001 30 20 EKED N#CCOc1cc(F)ccc1NCc1cc(-c2ccccc2)cs1 779609218 JWWSBXKFUMBXJG-UHFFFAOYSA-N 338.407 5.069 30 20 EKED C#CCCCCCC(=O)N1CCCCC[C@H]1/C=C/c1cccs1 783474365 DXRJKEZPFFLPLW-JJJPLKNQSA-N 329.509 5.116 30 20 EKED Cc1oc2ccccc2c1C(=O)/C=C\c1cc(C(=O)O)c(Cl)s1 1777559912 XZBDWZDZICQNHT-SREVYHEPSA-N 346.791 5.050 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1c(C(C)C)cccc1C(C)C 78439720 RZMOLOHIIWCOQD-UHFFFAOYSA-N 343.515 5.727 30 20 EKED CCOc1ccc([C@@H](NCCCCC#N)c2ccccc2Cl)cc1 180429067 ZBADWJWOOCYLIF-HXUWFJFHSA-N 342.870 5.112 30 20 EKED CC#CCCCC(=O)Nc1ccccc1-c1nc2ccccc2s1 185001079 OKQUSVRVSLKXQM-UHFFFAOYSA-N 334.444 5.095 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccco2)C1 365124149 JMXNFIOJXKYWJM-KRWDZBQOSA-N 338.451 5.153 30 20 EKED FC(F)c1cccc(NCC#Cc2ccc(C(F)(F)F)cc2)c1 443543945 RIOPVXUIVZQARW-UHFFFAOYSA-N 325.280 5.107 30 20 EKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 467706771 YKRDTMNQYSVULB-CRAIPNDOSA-N 349.434 5.003 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1[C@H]2CCCC[C@H]21 468055629 APRKCGMTDPIZLG-KXTWHKPSSA-N 346.430 5.034 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(F)c(Cl)c1 468991274 LWLNFKWKMOXSCL-GFCCVEGCSA-N 334.847 5.485 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)F)cc1 476113424 WFSXPZQPQHZBGV-UHFFFAOYSA-N 329.390 5.728 30 20 EKED C=C[C@@H](CC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1)c1ccccc1 495359597 SMKZFZIYMBVFJW-AVRDEDQJSA-N 331.459 5.100 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCCC(C)(C)C 521812130 HMAPTHIHADWDCH-OAHLLOKOSA-N 347.528 5.419 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(C)(C)OC1(C)C 529137912 SLVVEGFGXHVRLO-QGZVFWFLSA-N 329.484 5.071 30 20 EKED Cc1nc(SCC2(C#N)CC2)c2cc(-c3ccccc3)sc2n1 538658574 AEOMZQWNHCEZNF-UHFFFAOYSA-N 337.473 5.063 30 20 EKED CC(C)Sc1ccc(Cl)cc1NC(=O)C1(C#N)CCCCC1 609218517 OICQLVQTMGQCPM-UHFFFAOYSA-N 336.888 5.253 30 20 EKED C=CCn1c(S[C@H](C)c2cccc(F)c2)nnc1-c1ccccc1 615345403 FKSUFMUDQXFNLE-CQSZACIVSA-N 339.439 5.124 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cc2oc3ccccc3c2cc1OC 726871760 IKDOTFKREPZJIN-UHFFFAOYSA-N 338.407 5.025 30 20 EKED C=CC[C@@H](N[C@H]1CCCc2c1sc1ccccc21)c1ccncc1 766023030 ZPXCXTMIESUXDA-MOPGFXCFSA-N 334.488 5.581 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1ccc(N2CCCCC2)cc1 782887193 IRVSZVBKRGCYKA-XFXZXTDPSA-N 342.442 5.121 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](CCC(C)C)c2ccoc2)c1 796815410 DMGAGIYVXHDZMH-CTNGQTDRSA-N 340.467 5.228 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 800576135 BEEDYEPRJIRJEY-LJQANCHMSA-N 340.854 5.438 30 20 EKED O=C(/C=C\c1ccc(Br)s1)c1ccccc1Cl 916135335 SKOFTBDSGSPUSH-ALCCZGGFSA-N 327.630 5.060 30 20 EKED CC(CCCCCCC(=O)O)=NN[C@H](C)c1ccc(C(C)C)cc1 1776106004 MZCSUUFJLILARB-QGZVFWFLSA-N 332.488 5.262 30 20 EKED Cc1cc2occ(CC(=O)Nc3ccc(C(C)(C)C#N)cc3)c2cc1C 29152922 KARPTOOEMTULIZ-UHFFFAOYSA-N 346.430 5.032 30 20 EKED C=CCn1c(S[C@@H](C)c2cccc3ccccc23)nnc1C1CC1 63415612 KWPNUUJBTYHDFG-AWEZNQCLSA-N 335.476 5.348 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3cc(F)ccc3s2)n1 80455146 SSMOWWKTJDWAIX-LBPRGKRZSA-N 344.436 5.110 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(SC(F)F)cc1 90665478 KGXDZDSICCRVRW-RDTXWAMCSA-N 346.446 5.697 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)c3ccc(C)o3)cc2)o1 98042514 UTOCENHRUQRYIA-HWAYABPNSA-N 346.382 5.282 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1c(F)cccc1F 108408207 UVNUNOMENDUQSD-QWHCGFSZSA-N 332.419 5.390 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccc(-c2cccnc2)cc1 187439310 KQBUTMKJOYMPRX-OAHLLOKOSA-N 347.849 5.124 30 20 EKED C[C@@H](SCCC(=O)Nc1ccccc1Cl)c1cccc(C#N)c1 190891678 TYILCIOCZCYFAB-CYBMUJFWSA-N 344.867 5.035 30 20 EKED CC(C)c1ccccc1NC(=O)CS[C@@H](C)c1cccc(C#N)c1 190914550 IQYSHIMXWOKGAW-HNNXBMFYSA-N 338.476 5.115 30 20 EKED CCCOc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 326590423 GEFMRGZCTHGRCR-KRWDZBQOSA-N 338.451 5.331 30 20 EKED CC(O)=Nc1ccccc1C/C(O)=N/C[C@@H]1C[C@H]1C1CCCCC1 329352503 UPAAFHPLFOODTM-ROUUACIJSA-N 328.456 5.010 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCc3cc(Cl)ccc32)c1 391076159 JPHQACBEAUOQRO-LJQANCHMSA-N 326.827 5.122 30 20 EKED CC(C)CN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCC1 458800657 LQHAOWGZTRQVCY-FQEVSTJZSA-N 341.499 5.032 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 464650902 SBPABBXEMIGYPM-MRXNPFEDSA-N 334.419 5.200 30 20 EKED N#Cc1ccc(SCc2coc(-c3ccccc3)n2)c(Cl)c1 465389077 QMXWZJMBAHEKRI-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nc(-c2cccs2)no1 465389316 RKATYLBJTJIUPN-SECBINFHSA-N 347.852 5.176 30 20 EKED CC(=O)c1ccc(OCc2ccc(-c3ccccc3C#N)cc2)c(F)c1 482225381 ZFXUCXUPRZVXSR-UHFFFAOYSA-N 345.373 5.146 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccccc1 488683722 GJSJZDUTBQGTSM-HXUWFJFHSA-N 346.430 5.257 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)cc1 505038319 IKCVKIJVQNSNJL-OAHLLOKOSA-N 326.415 5.169 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccccc1F 505057516 JPSFZSUHBPJPRP-HNNXBMFYSA-N 326.415 5.169 30 20 EKED C=CCN(CC=C)C(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 522483262 BTYUSOJVIKASQN-UHFFFAOYSA-N 331.868 5.191 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(S[C@H](C)CC)cc2C)CC1 524151818 ZPODWNCZVAFTSE-OAHLLOKOSA-N 332.513 5.316 30 20 EKED CCCC[C@H](CC)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 524210466 DBYOSFABRIDQCU-HOTGVXAUSA-N 332.513 5.483 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc2ccccc2o1 530447270 AVZXMEUIXCINSJ-UHFFFAOYSA-N 348.446 5.606 30 20 EKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)CC1 590355942 FAFXFZFVOIGEAJ-UHFFFAOYSA-N 345.229 5.293 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2CCCCC2)cc1 915088188 JERPGOWUNMQZHD-OAQYLSRUSA-N 332.447 5.251 30 20 EKED C[C@@H]1CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 920791685 CEIGTVHOSJHFPB-HYVNUMGLSA-N 338.476 5.203 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cccc(-c2ccoc2)c1 89804508 HZLSWCWHSWUQBK-UHFFFAOYSA-N 348.427 5.205 30 20 EKED CCCCCCCCCN(C)C(=O)Nc1cccc(NC(C)=O)c1C 128292663 HLWQUZFJYZQSTI-UHFFFAOYSA-N 347.503 5.168 30 20 EKED Cc1cccc([C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 151866584 VLNIWYHEKCNTNH-HZPDHXFCSA-N 338.476 5.132 30 20 EKED Cc1ccc(C(=O)[C@H](C#N)c2ccccn2)c(Sc2ccccc2)c1 181484666 GWRHCGVRAIJRKC-GOSISDBHSA-N 344.439 5.031 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)ccc2SC1 329025205 VCCFBYJSPQFLHV-NWANDNLSSA-N 344.480 5.575 30 20 EKED CC[C@H](C(=O)Nc1cccc(C#N)c1C)c1cccc(C(F)(F)F)c1 432340727 OQSFGIVPWSSLDW-INIZCTEOSA-N 346.352 5.018 30 20 EKED Cc1cc(CCCC(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)s1 439782148 NYQDRZCKKDAGQE-UHFFFAOYSA-N 340.492 5.128 30 20 EKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 445616604 QZXDEBJSKLVVAS-DNVCBOLYSA-N 335.513 5.053 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cccc2ccsc12 466436840 RDFINLIVUVJFEB-UHFFFAOYSA-N 338.457 5.159 30 20 EKED N#Cc1ccc(C(F)(F)F)nc1SCc1ccc(C(F)F)cc1 488746453 CTQRETQIJMJHIL-UHFFFAOYSA-N 344.308 5.202 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cscc1C 489089214 PZQLKURLMSTJDJ-UHFFFAOYSA-N 328.481 5.230 30 20 EKED CCN(Cc1cccc(-c2ccncc2)c1)[C@@H](C)c1ccc(C#N)cc1 508604172 MCJCYPRRMQEVAU-SFHVURJKSA-N 341.458 5.203 30 20 EKED CC(C)(C#N)CCCCN1CCC([C@H](F)c2ccccc2F)CC1 511104386 FHFOWLCAAKZZRO-IBGZPJMESA-N 334.454 5.268 30 20 EKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2cc(C#N)ccc2C)cc1 531320550 VKPPPGHUUDVXFC-DYESRHJHSA-N 347.462 5.180 30 20 EKED C=CCC(CC=C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C 536820897 IRGAFBASWCNWAB-LBPRGKRZSA-N 338.278 5.208 30 20 EKED C[C@@H](Sc1cccc(Cl)c1C#N)c1nc(-c2ccccc2)no1 537848466 DMAPSDMXHBSGDN-LLVKDONJSA-N 341.823 5.115 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-c3ccccc3)o2)cc1 543152099 GIAFCWMHNMDKBW-UHFFFAOYSA-N 330.387 5.000 30 20 EKED CCC[C@H](C)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944688 TYRLJGPIWSWSEU-IRXDYDNUSA-N 349.478 5.116 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCCC2 550829465 HUHVRJKXMQZLKZ-QFBILLFUSA-N 338.520 5.713 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccc(C)cc2)C1 554576259 SXXZWEBFUANBFC-HXUWFJFHSA-N 334.463 5.135 30 20 EKED C[C@H](Nc1ccc(F)cc1C#N)c1ccc(Oc2cccnc2)cc1 576975376 PDQZBGCATUAATP-AWEZNQCLSA-N 333.366 5.058 30 20 EKED C=CCCC(=O)N(Cc1ccc(-c2ccc(F)cc2)s1)C(C)C 588033495 BAQMVKWRSMBYNB-UHFFFAOYSA-N 331.456 5.257 30 20 EKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)CC(C)(C)C#N)c1 593298505 OYLFCTHKJZISIP-UHFFFAOYSA-N 340.398 5.113 30 20 EKED CSc1cccc(CNc2ccccc2SC[C@@H](C)C#N)c1 594704313 AFCUEMDCZRHASQ-AWEZNQCLSA-N 328.506 5.272 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3ccc(CC#N)cc3)sc2c1 609148728 DFXSZVWMWOVUFU-UHFFFAOYSA-N 340.835 5.182 30 20 EKED CCC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 614179321 OBWXBRJGEWOUQC-HXUWFJFHSA-N 342.433 5.397 30 20 EKED CC(C)CCN(CCC#N)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 619804270 JKDASYWZMDSOMX-UHFFFAOYSA-N 349.906 5.431 30 20 EKED CC(C)(C)Sc1ccc(NC(=S)Nc2ccccc2C#N)cc1 726748640 YEZUAPJAOQOARE-UHFFFAOYSA-N 341.505 5.258 30 20 EKED CCCCCC[C@H](CC)C(=O)N(Cc1ccc(C#N)cc1)C1CC1 740922414 DZKBSLYNKCKMLM-IBGZPJMESA-N 326.484 5.046 30 20 EKED CC(=NNc1c(C)cc(C)cc1C)c1[nH]c(-c2ccccc2)nc1C 743445142 GHKLUFHQTNRZGW-UHFFFAOYSA-N 332.451 5.146 30 20 EKED CCCC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccccc1 746046576 AGKGJKVKDRVYEF-IRLDBZIGSA-N 336.479 5.389 30 20 EKED COc1cc(/C=C\C(=O)c2c(C)[nH]c3ccccc23)ccc1SC 746342714 ZHLMDTKJFVBQHH-NTMALXAHSA-N 337.444 5.103 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1ccc(F)c(Cl)c1Cl 762455171 PRYASFCNVYSVGU-SNVBAGLBSA-N 339.197 5.035 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](CCC)c2ccccn2)cc1 765734727 CQBYJULYZPDASI-OXQOHEQNSA-N 344.886 5.405 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc2cc(Cl)ccc2o1)c1ccncc1 776158518 UGLCCMPPOJTRGK-SUMWQHHRSA-N 326.827 5.449 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(SC(F)(F)F)cc2)cc1 796968700 BJTQFVSXJOUAKU-BJMVGYQFSA-N 333.334 5.066 30 20 EKED Cc1csc([C@@H](C#N)C(=O)[C@@H](CC(C)C)c2ccc(Cl)cc2)n1 850736417 JTBVTUHYRUUBLX-HOTGVXAUSA-N 346.883 5.111 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2c(F)ccc(C(=O)O)c2F)cc1 1776699994 MMGARCAAZLPOIC-LMMOQWNQSA-N 344.357 5.073 30 20 EKED CN(C(=O)c1cc2sc3ccccc3c2s1)c1cccc(C#N)c1 63325917 ZJAOWEJEDGETEI-UHFFFAOYSA-N 348.452 5.264 30 20 EKED N#CCCC[C@@H](NC(=O)c1cccc(C2CCC2)c1)c1ccccc1 352205151 CQIYMHFCBXDDCJ-OAQYLSRUSA-N 332.447 5.119 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](SC)c1ccccc1 415517154 KUCDAGYMICQQTB-FQEVSTJZSA-N 339.504 5.581 30 20 EKED N#CCCC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 431510931 JCVILIZHUOFCHK-INIZCTEOSA-N 329.787 5.095 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(C#N)cc1 439559512 ACLUVCZJBQLDFL-MRXNPFEDSA-N 346.405 5.449 30 20 EKED CC[C@H](NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1)c1ccc(C#N)cc1 447526232 BZEROMZQVUGHBR-XPWALMASSA-N 348.490 5.075 30 20 EKED Cc1cc(F)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482296527 RVZDVJSTLYQZGH-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CCN(Cc1cccc(OCCCC#N)c1)Cc1ccc(Cl)s1 506084649 DIMPIQSJGPTPCI-UHFFFAOYSA-N 348.899 5.106 30 20 EKED C=CCCCCCN(C)C(=O)c1sc(-c2ccc(F)cc2)nc1C 523511166 YVDMDXKBJWVJNW-UHFFFAOYSA-N 346.471 5.076 30 20 EKED CCSc1ccccc1[C@@H](C)Nc1cccc(OCCCC#N)c1 538526453 IUHYQDPOVYGSSO-MRXNPFEDSA-N 340.492 5.654 30 20 EKED Cc1sccc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 550198602 AZCVLBKMQWOQBB-HNNXBMFYSA-N 332.472 5.446 30 20 EKED C=CCC[C@H](C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 567022947 QUDYBSHXCJNCMH-HNNXBMFYSA-N 349.808 5.966 30 20 EKED C=CCOc1ccccc1CNc1ccc(Oc2cccnc2)cc1 572351079 GHEWJSYRJHBGRN-UHFFFAOYSA-N 332.403 5.051 30 20 EKED N#Cc1c(F)cccc1CNc1ccccc1SC1CCCC1 600850266 UMVGJPHKCZERFS-UHFFFAOYSA-N 326.440 5.344 30 20 EKED CCCC[C@H](CC)CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609435448 OOWJGOHXCAQZJA-HOTGVXAUSA-N 347.528 5.419 30 20 EKED CC(C)(C)C1C/C(=C/c2nccs2)C(=O)/C(=C\c2nccs2)C1 730086155 YGPYUHPSSFOESS-MIMPSMLTSA-N 344.505 5.092 30 20 EKED Cc1cccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)c1 731322331 XGSPIRTWRIARCL-AWEZNQCLSA-N 341.505 5.198 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 733679894 GREXDSISQAXBHO-RBUKOAKNSA-N 334.463 5.408 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3c[nH]c4ccccc34)s2)cc1 734304228 GEXLCRYEOXPTHH-ZHACJKMWSA-N 344.439 5.496 30 20 EKED N#C[C@@H](C(=O)/C=C\C1CCCCC1)c1nc2cc(Cl)ccc2s1 735593346 KDKPMAWKEVANLX-QPBFKRLHSA-N 344.867 5.262 30 20 EKED Cc1ccc([C@@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)cc1 740874441 SMOABLFYCAJSJN-JOCHJYFZSA-N 346.861 5.399 30 20 EKED CC(=NNc1nncc2ccccc12)c1ccc(-c2ccccc2)s1 744664479 CEZZMUQLUUGBRY-UHFFFAOYSA-N 344.443 5.194 30 20 EKED CC(C)c1ncc(/C=C\C(=O)c2ccccc2C(F)(F)F)s1 758423633 NXMTUKIYCSJJRI-FPLPWBNLSA-N 325.355 5.181 30 20 EKED CCC(CC)(CC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 761049520 XVSBZHIFOKIXGH-GFCCVEGCSA-N 334.872 5.342 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)c(F)c1 776741868 KELXVNYXOUMVSL-HXPMCKFVSA-N 346.396 5.414 30 20 EKED Fc1cc(Cl)c(NN=C2CCC3(CCCO3)CC2)c(Cl)c1 788025838 ZFOOQHVDRGWHSH-UHFFFAOYSA-N 331.218 5.024 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1n[nH]c(C2CC2)c1C 806451464 GIAGLGLKHWYOCY-UHFFFAOYSA-N 338.455 5.091 30 20 EKED C[C@H](Nc1ccc(OCc2ccccc2F)cc1)c1cccc(C#N)c1 864008781 OYWSXPVLWGJNOM-INIZCTEOSA-N 346.405 5.449 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)cc1 1776013448 ATXSDKQDSPHJNH-KBXCAEBGSA-N 330.472 5.415 30 20 EKED O=C(/C=C\c1ccc(/C=C/C(=O)c2ccccc2)cc1)c1ccccc1 32224561 ISDFLLZGOWAGAF-JRDMOELTSA-N 338.406 5.479 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C)c1Cl 189902015 CZFPDJXELSYDMA-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C[C@H](S[C@@H](C)c1nc(Cc2ccccc2)no1)c1cccc(C#N)c1 190891353 CLTCJNMPJXVIBB-GJZGRUSLSA-N 349.459 5.087 30 20 EKED CCCCC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccccc1 236686312 VSXANMVCPRPOCG-AVRDEDQJSA-N 336.479 5.389 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2cccc(COC3CCCCC3)c2)CCC1=O 328954128 MTEJYRCVEUKXIC-DOTOQJQBSA-N 343.467 5.129 30 20 EKED OC(C[C@H]1CCOC1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329808988 BXVGIQUOMDRPBC-CYBMUJFWSA-N 348.418 5.009 30 20 EKED CC(C)(C#N)CCCN[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F 445990806 CQAZGKFZODTGBM-DOTOQJQBSA-N 338.417 5.261 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 455144902 RNMSFSNVBFYIBH-KBPBESRZSA-N 341.842 5.006 30 20 EKED CCCCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C(C)C 458799096 JFPMNVTYRIQVPM-IBGZPJMESA-N 329.488 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCC[C@H]1SCC 475559076 BSPYQMKWMSIUBY-ZWKOTPCHSA-N 346.540 5.334 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(Cl)c1 476090709 LTMXAWDBOACFHS-UHFFFAOYSA-N 327.855 5.753 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)c1ccc2ccccc2c1OC(F)F 514684026 HGIYOGBCVPFYKF-CQSZACIVSA-N 346.421 5.422 30 20 EKED C=CCCNc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 524841673 CMPSYOUUNSQWBQ-UHFFFAOYSA-N 326.293 5.020 30 20 EKED C[C@@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1ccc(C#N)cc1 537296009 QJEGMFWKNYMPDT-HZPDHXFCSA-N 340.426 5.869 30 20 EKED C[C@@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)c(F)c1 545273995 KOUKNHHQXXQVJY-LLVKDONJSA-N 349.236 5.344 30 20 EKED CCCC(C)(C)N(Cc1cccs1)C(=O)c1cccc(CC#N)c1 558815703 GKAHNMVUVYPMPA-UHFFFAOYSA-N 340.492 5.035 30 20 EKED CN(Cc1ccc(C(C)(C)C#N)cc1)[C@H]1CCCC[C@H]1C(F)(F)F 589749325 MWEXOXSMJNXCSP-SJORKVTESA-N 338.417 5.041 30 20 EKED Cc1ccc(-c2ccc(CNCc3ccc(C#N)c(Cl)c3)o2)cc1 619749074 ZVDJHKOLMHWANT-UHFFFAOYSA-N 336.822 5.070 30 20 EKED Cc1ccc(N(C(=S)Nc2ccc(C#N)c(Cl)c2)C(C)C)cc1 726490043 HGTNKMSLSCJMNB-UHFFFAOYSA-N 343.883 5.132 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(F)cc1 731321263 POAVESYZGDWSRW-GFCCVEGCSA-N 345.468 5.029 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ccc(Cl)cc2)n1 747197911 NVNREYMSZOUPTC-HNNXBMFYSA-N 346.883 5.119 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccc(Cl)c(Cl)c1 754710666 WXIWBDVVDJPINX-UHFFFAOYSA-N 334.124 5.425 30 20 EKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(Cl)c(F)c2)c1 765612339 GMVWZZHFKPWWAI-RMKNXTFCSA-N 343.785 5.058 30 20 EKED Cc1ccc(NC(=S)N[C@@H](CCCC#N)c2ccccc2)cc1C 814209473 AYOLJQAZHMAZCF-IBGZPJMESA-N 337.492 5.025 30 20 EKED N#C[C@H](C(=O)c1csc(Cl)c1)c1nc(-c2ccccc2)cs1 191375925 SOBKOQRJPLBJCS-GFCCVEGCSA-N 344.848 5.015 30 20 EKED C=CCn1c(S[C@@H](CC)c2ccc(F)cc2)nnc1-c1ccco1 303840246 LYCCTXKOVVYQGM-INIZCTEOSA-N 343.427 5.107 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@@H]3CCC(=O)[C@H](C)C3)n2)s1 328920601 LWNAGNCERXASIV-GHMZBOCLSA-N 348.493 5.027 30 20 EKED COc1ccc2c(c1)[C@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340451739 OVIYIDKYQYQJCR-FGZHOGPDSA-N 334.463 5.097 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Cl)c(F)c1 442872930 OFQTZUSPFWCNLG-GFCCVEGCSA-N 334.847 5.343 30 20 EKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(-c2ccccc2Cl)o1 477777017 NCVVAMVALWRYJX-UHFFFAOYSA-N 344.842 5.002 30 20 EKED N#Cc1cc(Cl)ccc1CNc1ccc(Oc2ccccn2)cc1 478368890 JSAHWAVGISTLHJ-UHFFFAOYSA-N 335.794 5.011 30 20 EKED Cc1cc(CN[C@@H](C)c2ccc(C#N)cc2)ccc1-c1ccccc1 488201205 ZTYKTUUISGPGIP-SFHVURJKSA-N 326.443 5.385 30 20 EKED N#Cc1ccc(CSCc2csc(-c3cccs3)n2)c(F)c1 493988754 HSHVMYQFWIWIMW-UHFFFAOYSA-N 346.477 5.316 30 20 EKED C[C@H](CCCC(F)(F)F)NCc1cc(F)cc(C(F)(F)F)c1 494840976 WZELXDNUYLTSCQ-SECBINFHSA-N 331.275 5.055 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](NCc1cccc(OCCCC#N)c1)CC2 495150344 JKJJQTNQVQDIMR-QHCPKHFHSA-N 348.490 5.270 30 20 EKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1c(F)cccc1F 507622625 UUDZVUZYOMLSDG-NNDYNSRJSA-N 340.417 5.020 30 20 EKED Cc1ccc(NCc2cccc(C#N)c2)c(OCc2ccccc2)c1 513577748 WGEOZMPOUVDNEP-UHFFFAOYSA-N 328.415 5.058 30 20 EKED CC(C)(C#N)CCCN[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 531648610 UGZIJDBWCOUPES-LJQANCHMSA-N 344.861 5.488 30 20 EKED C[C@H](NCc1ccc(C#N)o1)c1ccc(-c2ccc(Cl)cc2)s1 537343724 MUSXHFMBJLETGQ-LBPRGKRZSA-N 342.851 5.384 30 20 EKED N#Cc1ccc(C(=O)N(c2ccsc2)C2CCCCC2)cc1Cl 566891114 HWUVZHOMUVGPOB-UHFFFAOYSA-N 344.867 5.253 30 20 EKED C=C(C)CN(CC)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C 588309450 KTVRTCVJGAUCHR-MRXNPFEDSA-N 342.405 5.010 30 20 EKED C=CCCCN(C)C(=O)c1sc2cccc(Cl)c2c1Cl 605644451 JDWLALBGILLTEZ-UHFFFAOYSA-N 328.264 5.246 30 20 EKED C=CCCC[C@H](C)NC(=O)c1ccccc1SCc1ccco1 678881287 CYWPRTSFIWEOOF-HNNXBMFYSA-N 329.465 5.047 30 20 EKED CC(Cc1cccs1)=NNc1nc(Cl)c(Cl)cc1Cl 729636248 XJDUTHAVUQPWIY-UHFFFAOYSA-N 334.659 5.134 30 20 EKED CC(=NNc1nccc2sccc12)c1cccc(Cl)c1Cl 734979332 GDYNOZDGLLDQQL-UHFFFAOYSA-N 336.247 5.439 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccc(C)cc1 747197636 KZFUOFVPFAPDJP-NVXWUHKLSA-N 340.492 5.335 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(O)c(Cl)c1 768756243 KZCNWPMPUYESTF-XQRVVYSFSA-N 347.848 5.127 30 20 EKED C[C@@H](Nc1cccc(-c2cccs2)c1)c1ccc(OCC#N)cc1 777625430 NIYOTRMERVFRDD-OAHLLOKOSA-N 334.444 5.491 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CCCC)ON=C(C)C 789887981 HLORUQVRGTUHET-LJQANCHMSA-N 344.499 5.448 30 20 EKED 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CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 756223916 HUCUKIOHBKADDX-HNAYVOBHSA-N 328.415 5.238 30 20 EKED CC[C@H](C)[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 780311447 CCRPBJKXRFZURB-YWPYICTPSA-N 346.883 5.322 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 788595549 KTJYEACJQODLLC-YIYPIFLZSA-N 346.883 5.296 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccc(F)cc1 789723210 WXXQEGRONZQZQB-INIZCTEOSA-N 339.454 5.495 30 20 EKED Cc1sccc1CNc1ccc(OCc2cccc(C#N)c2)cc1 816565578 UGLVZTXGBJYERD-UHFFFAOYSA-N 334.444 5.119 30 20 EKED CC[C@@H]1c2ccccc2CN1C(=O)N[C@@H](CCCC#N)c1ccccc1 895042011 QHYWLQIDNCKNSA-LEWJYISDSA-N 347.462 5.098 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3c[nH]c4ccccc34)cs2)cc1 918711770 ACQBWUTUUVGSFD-KHPPLWFESA-N 344.439 5.496 30 20 EKED CCC(C)(C)[C@H]1CCc2nc(N=C(O)C3CCC(=O)CC3)sc2C1 329234142 MNPZVGGOZHTKOU-ZDUSSCGKSA-N 348.512 5.032 30 20 EKED C=CCCc1ccccc1NC(=O)c1occc1COc1ccccc1 410349977 RUVJGTZIJOTMOE-UHFFFAOYSA-N 347.414 5.230 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 439446984 RDDXPFRLCUAIMJ-OAHLLOKOSA-N 347.849 5.124 30 20 EKED N#CC[C@H](CC(=O)N[C@@H](c1ccccc1)C1CCCC1)c1ccccc1 475028985 HOVMCBHVVMPRFZ-GGAORHGYSA-N 346.474 5.122 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1nc(-c2ccccc2)cs1 482911744 SOHXEZSNBHFOOG-UHFFFAOYSA-N 340.492 5.019 30 20 EKED C=CCC[C@H](NCc1cccc(NC(=O)[C@H](C)CC)c1)c1ccco1 513678532 OQMZHHJBEZYANH-APWZRJJASA-N 340.467 5.061 30 20 EKED C=CC1CCN(C(=O)c2cc3sc4ccccc4c3s2)CC1 520328276 XBAYOFYOLVINFR-UHFFFAOYSA-N 327.474 5.154 30 20 EKED CCC[C@@H](C(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccccc1 520973887 CCPBGQLBHGNJKU-JOCHJYFZSA-N 348.490 5.127 30 20 EKED COc1ccc(Cl)cc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 550826138 AJJPGDMZZKPIBP-BEFAXECRSA-N 342.870 5.434 30 20 EKED C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554391605 ULBUVNARSGMAKI-RDJZCZTQSA-N 341.499 5.166 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)c1cccs1)CC2 575841201 SRZDVCCMXVWGFM-RTWAWAEBSA-N 344.483 5.181 30 20 EKED N#CC1(c2cccc(-c3cccc(C(F)F)c3F)c2)CCOCC1 600848658 GVTFVJKBHAGVCN-UHFFFAOYSA-N 331.337 5.002 30 20 EKED N#CCCSc1ccccc1NCc1c(Cl)cccc1Cl 609385869 PMESPDQRUYRXAC-UHFFFAOYSA-N 337.275 5.611 30 20 EKED C=CCCOc1ccccc1-c1ccc([C@@H](N)CC(F)(F)F)cc1 629735749 FIBOPJWZOGGNPX-KRWDZBQOSA-N 335.369 5.261 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1c(C)noc1C 682777222 IJGMFULSDOIQAO-ZDUSSCGKSA-N 341.455 5.026 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1ccc2nc(Cl)ccc2c1 732678212 WXPUFJCLXVVHNC-UHFFFAOYSA-N 342.870 5.097 30 20 EKED CC[C@H](C)N(Cc1ccccc1)Cc1cc(Cl)ccc1OCC#N 735306771 UJEDWNFMZGJRSH-INIZCTEOSA-N 342.870 5.043 30 20 EKED C=CCCCCCN(C)C(=S)Nc1cccc(C(F)(F)F)c1 739455357 ALAQAVCNYISAEZ-UHFFFAOYSA-N 330.419 5.080 30 20 EKED C[C@@H]1C/C(=C\c2cccc(OCCCC#N)c2)C(=O)c2ccccc21 751537728 ZJFNPSZZWOQDAV-WDMNMGCXSA-N 331.415 5.143 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](c2ccc(F)cc2)C(C)C)n1 756571977 QSAFDGXVWAFDLA-RDJZCZTQSA-N 344.455 5.022 30 20 EKED CC[C@H](CC#N)NC(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 771752597 CORRQSDYQBDEDI-QGZVFWFLSA-N 341.842 5.129 30 20 EKED CC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCCC1 781452865 YHIZSUHDQXNHBU-LBPRGKRZSA-N 332.856 5.096 30 20 EKED CC(=NNc1ncnc(Cl)c1C(C)C)c1oc2ccccc2c1C 797404335 CPOFOIZFROCJSH-UHFFFAOYSA-N 342.830 5.144 30 20 EKED CCc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776974844 SFSANLTYJKTAGD-WDZFZDKYSA-N 346.382 5.103 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1nc(C(C)(C)C)cs1 121811497 UHJMLCYTPSBBPY-CYBMUJFWSA-N 345.537 5.447 30 20 EKED Cc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 122517789 JBKDVTHYUQRKHK-GFCCVEGCSA-N 344.867 5.153 30 20 EKED CC[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1Cl 180557417 KDZJSHUPZSOFMI-GOSISDBHSA-N 349.261 5.137 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(OCC#N)cc1 181623177 XBJQNQPSPNJGED-VGSWGCGISA-N 334.463 5.171 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCCCC(C)(C)C#N 183712006 CJJQNOAWWQRVQJ-AWEZNQCLSA-N 327.497 5.099 30 20 EKED N#Cc1ccc(CNCc2ccccc2-c2ccc(Cl)cc2)cc1 237804049 XMTWCRPJGYBOQY-UHFFFAOYSA-N 332.834 5.168 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CC[C@@H]4CCCC[C@H]4C3)c(F)cc2CC1 328765257 GTILGACWCNXNSO-KCQAQPDRSA-N 344.430 5.554 30 20 EKED CC(O)=Nc1ccc(C/C(O)=N/C2CCC3(CCCCC3)CC2)cc1 329970723 XISJPGKYJUMSDG-UHFFFAOYSA-N 342.483 5.687 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 410348427 JQCUGMMMRRAKPW-LSDHHAIUSA-N 325.374 5.112 30 20 EKED Cc1ccccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437463097 QLYXJAPUIXGBHF-UHFFFAOYSA-N 346.361 5.050 30 20 EKED Cc1ccc(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)cc1C 442912305 CZMJLQOQQASECO-AWEZNQCLSA-N 335.432 5.078 30 20 EKED CC1(C#N)CCC(Nc2ccc(COCc3ccccc3)cc2)CC1 449055281 KHAVLIZXMBRCSV-UHFFFAOYSA-N 334.463 5.288 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458805191 UFPQCOQZWLBXGF-RXVVDRJESA-N 349.478 5.133 30 20 EKED CCc1ccc(Cl)c(CC)c1NC(=O)[C@H](C)c1cccc(C#N)c1 463105846 MCYYKCINVPPWKF-CYBMUJFWSA-N 340.854 5.079 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC(C)C)c1cccs1 515850381 APXSTIZICHAEQO-SFHVURJKSA-N 342.508 5.233 30 20 EKED C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)c1ccc(C#N)cc1 522822831 WJMGMQIVKLACAN-VIFPVBQESA-N 342.773 5.479 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cc(OC)ccc1OC)c1ccccc1 539045948 DAPJEVFPLULSDR-JXFKEZNVSA-N 325.452 5.062 30 20 EKED COc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542018009 HMUAAKFKNZZVDE-QGZVFWFLSA-N 342.442 5.085 30 20 EKED Cc1ccc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 542994268 JSTYBZXGSMDSIB-SJORKVTESA-N 330.431 5.539 30 20 EKED C=CCCC(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 588015466 VXSZGHHDKVGWME-UHFFFAOYSA-N 336.460 5.490 30 20 EKED N#C[C@H](Cc1ccccc1)SC(c1ccccc1)c1ccccc1 603451593 IBTSFGOTGZPFHM-NRFANRHFSA-N 329.468 5.644 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2)o1 618805182 DQRZHXKKKGLQLN-MGPUTAFESA-N 328.415 5.156 30 20 EKED C=CCOc1cccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)c1 620514364 SOTPHWFWNDEJLR-QHCPKHFHSA-N 347.433 5.270 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2scnc2C)o1 734305827 GAIGFRRUQGWOPA-QPJJXVBHSA-N 327.380 5.055 30 20 EKED COc1ccccc1/C=C/C=C1\C(=O)c2ccsc2S[C@H]1C 742436397 JPPIPZDXIWUQLH-NJAUFBTJSA-N 328.458 5.073 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cc(F)ccc1F 757476619 XIBFUNBUZJPRLU-XQRVVYSFSA-N 333.384 5.046 30 20 EKED FC(F)(F)CON=C1CCC(c2cccc(C(F)(F)F)c2)CC1 761827456 GYBNYWBVQOCERD-UHFFFAOYSA-N 339.279 5.298 30 20 EKED C#CCCCCC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 773316296 LZDQACIVWBYQMI-UHFFFAOYSA-N 344.505 5.043 30 20 EKED Cc1ccc2c(C)cc(NN=C3CCC4(CCCO4)CC3)nc2c1C 788016766 XWEGIZTZMVZXSQ-UHFFFAOYSA-N 337.467 5.051 30 20 EKED C=CC[C@H](NC[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 809621197 WVWFUDCPSWIMEZ-KSSFIOAISA-N 334.385 5.111 30 20 EKED CC(=NNc1ccc(Cl)nc1)c1sc(-c2ccccc2)nc1C 814858963 KACPGIPWDRUCNB-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CC(C)c1ccccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 857585525 BAAHYWMMJWRWBA-OAHLLOKOSA-N 338.476 5.314 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)C(C)(C)CC)c1 1776789187 UGUMIBRXRIBGQL-IBGZPJMESA-N 349.515 5.015 30 20 EKED C=CCN(C(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccccc1 5050724 PZJXCTIGKPWIAG-UHFFFAOYSA-N 347.439 5.140 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1cccc(-c2ccncc2)c1 157256074 DBJDGODLYTTZNN-BQYQJAHWSA-N 346.455 5.369 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cccc(C(F)(F)F)c2)cc1 325108904 CHGGDWNOMAXTSI-CQSZACIVSA-N 335.369 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc([C@@H](C)N)cc1 415582898 PYDKZBPWYGNYTC-OAHLLOKOSA-N 337.467 5.202 30 20 EKED C=CCC[C@H](N[C@@H](C)c1nc(-c2ccncc2)cs1)c1ccco1 428446835 KQYCNHXFYPKIAF-HOCLYGCPSA-N 339.464 5.156 30 20 EKED CC1(C#N)CCC(N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 449299626 BCDXTIIGFXKPNW-CAXWJHAQSA-N 337.294 5.301 30 20 EKED C=C[C@](C)(CC)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 467848355 CGFQCPGSBIIYNY-AUSIDOKSSA-N 346.474 5.018 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)Cc1cc2c(ccc3ccccc32)o1 471163771 BCLDCAUYHMCDIQ-UHFFFAOYSA-N 348.446 5.059 30 20 EKED Cc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cccc1C(F)(F)F 476352372 HJKFTVAIPJRIBT-UHFFFAOYSA-N 346.352 5.067 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1ccccc1)c1ccco1 481934605 SRCCTBKMCNKFSD-JTHBVZDNSA-N 342.442 5.298 30 20 EKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 484259150 VSWYORUEFLUXDS-IAGOWNOFSA-N 345.364 5.028 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2)cc1F)c1ccc(C#N)cc1 503568333 HQIJFTWLDUTKLD-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(O)ccc1Cl 506045355 CTIFOIDUPWVRKL-UHFFFAOYSA-N 329.827 5.150 30 20 EKED C=CCC[C@H](N[C@H](C)[C@@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 507511410 OCYJIGNHJLWSRY-KYJSFNMBSA-N 341.417 5.117 30 20 EKED CC(C)c1ccc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 518849833 ASOSNSVFFXJRPU-QGZVFWFLSA-N 347.245 5.111 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)C)oc1C 552195543 QKSBROTXKGNAMW-UHFFFAOYSA-N 325.452 5.816 30 20 EKED CCCOc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 557508815 UNRMWPKLPKHPIY-AOMKIAJQSA-N 334.463 5.075 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc[nH]c3C(C)C)n2)cc1 563241873 JMJAGTZKJCMJKF-INIZCTEOSA-N 349.459 5.060 30 20 EKED CC(C)CCc1ccccc1NC(=O)c1cc(C#N)ccc1Cl 583828223 PZUAEKHQXQABTO-UHFFFAOYSA-N 326.827 5.053 30 20 EKED N#CCCCCCC(=O)Nc1cccc(CSC2CCCC2)c1 588158804 OHVHQTZZEMXPOP-UHFFFAOYSA-N 330.497 5.275 30 20 EKED CCCC(=O)Nc1ccc(Cl)c(N[C@@H](C)c2cccc(C#N)c2)c1 600852321 PCABSIKERMQKDE-ZDUSSCGKSA-N 341.842 5.123 30 20 EKED CCCc1sc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1CC 613290792 LKTVPXVPYDXTGA-MRXNPFEDSA-N 348.471 5.301 30 20 EKED N#Cc1cccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)c1 727266677 CJOUMRKAOTWCBP-ALCCZGGFSA-N 335.712 5.127 30 20 EKED CSc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 728439052 CYQOYVPBYLHYOL-TWGQIWQCSA-N 343.498 5.490 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CC[C@@H](C)C3)n2)cc1 759538944 NYVDPVZKSBJKRD-HLLBOEOZSA-N 338.476 5.121 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1csc2ccccc12 775665933 BSJUUCLUGIMSRD-OAHLLOKOSA-N 334.488 5.553 30 20 EKED C=CC[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccncc1 782443956 DVSSCXILMHBRTR-NRFANRHFSA-N 343.430 5.247 30 20 EKED C#CCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 790090130 MNWLEUKDPCYDII-UHFFFAOYSA-N 332.230 5.402 30 20 EKED CC(C)c1occc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 794930207 DEADJUVVXARMOI-HXUWFJFHSA-N 344.414 5.311 30 20 EKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1O 810221193 MILAHCDPOFSTLE-SJCJKPOMSA-N 348.368 5.085 30 20 EKED CCCCCCCC[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1C 820845094 TZBIHAYNHHKISE-OAHLLOKOSA-N 332.488 5.279 30 20 EKED Cc1ccsc1-c1nnc(SCCCCC2(C#N)CCC2)o1 901488115 FUGZVGMQEDJBAE-UHFFFAOYSA-N 333.482 5.063 30 20 EKED CC(C)c1ccc(NC(=S)Nc2ccccc2C#N)c(C(C)C)c1 915999282 LAGFPIOCOKHAQA-UHFFFAOYSA-N 337.492 5.614 30 20 EKED CC(=NNc1ncc(Cl)cc1Cl)c1ccc2ccccc2c1O 916316939 QLVYHKUILLGTGX-UHFFFAOYSA-N 346.217 5.083 30 20 EKED O=C(/C=C\c1cccc2c1OCCCO2)c1ccc(Cl)cc1Cl 917143099 BETXLLZPQLAIED-YVMONPNESA-N 349.213 5.051 30 20 EKED Cc1cccc2c(C(=O)/C=C/c3ccc4oc(C(=O)O)cc4c3)coc12 1777448782 DQZSNFMPUBAQNR-FNORWQNLSA-N 346.338 5.082 30 20 EKED Cc1ccc(-c2csc(/C=C/c3ccc(O[C@@H](C)C#N)cc3)n2)cc1 110657035 CLMOJWUWLJYOBR-MZTACXPWSA-N 346.455 5.580 30 20 EKED C[C@@H](Cc1nnc(S[C@H](C)c2ccc(C#N)cc2)o1)c1ccccc1 118172851 DORSHPJBJAYQCS-LSDHHAIUSA-N 349.459 5.141 30 20 EKED CC[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177750259 MMZWWMQWHCZHLZ-GOEBONIOSA-N 344.505 5.014 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCc2ccccc2C1 191443868 KQBZSUHYJGNQLX-UHFFFAOYSA-N 348.490 5.519 30 20 EKED N#Cc1cc(F)ccc1NCc1ccc(-c2nc3ccccc3s2)o1 327027343 KTGNOKVXXCVKFU-UHFFFAOYSA-N 349.390 5.179 30 20 EKED C[C@H](/N=C(/O)[C@@H]1C[C@@]12CCOc1ccccc12)c1cc2ccccc2o1 329689677 GIXMLVSBGXCOQV-ICSGCJEQSA-N 347.414 5.191 30 20 EKED Cc1nc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 367805150 VYVXBIXQGVAYLI-CABCVRRESA-N 347.487 5.402 30 20 EKED CC(C)(c1ccc(NCc2cc(C#N)ccc2F)cc1)C(F)(F)F 432324651 HXPIWBDMNVXTHK-UHFFFAOYSA-N 336.332 5.149 30 20 EKED CC[C@H](N[C@@H](CC)c1ccccc1OC(F)F)c1ccc(C#N)cc1 447527727 GZVCFFLOBQJBSI-ROUUACIJSA-N 344.405 5.352 30 20 EKED CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NCCCCC#N 471817686 VNEXXDYVXAALBC-SFHVURJKSA-N 349.906 5.153 30 20 EKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cccc2ccccc12 474205556 KBFOGOVJXQSTDO-PXNSSMCTSA-N 342.442 5.105 30 20 EKED C[C@H](C(=O)Nc1cccc(Nc2ccccc2)c1)c1cccc(C#N)c1 486350780 NDAOPVRYMVYOLG-INIZCTEOSA-N 341.414 5.044 30 20 EKED CCN(Cc1csc(-c2ccccc2)n1)[C@@H](C)c1ccc(C#N)cc1 497594131 QODUSRGVNQXZMJ-INIZCTEOSA-N 347.487 5.265 30 20 EKED N#Cc1ccc(C[S@](=O)Cc2ccc(C3CCCCC3)cc2)cc1 505746597 YHDWQLJMVMPSMM-DEOSSOPVSA-N 337.488 5.055 30 20 EKED C[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 518780038 BJHYZRVOHYNWCS-AWEZNQCLSA-N 336.822 5.322 30 20 EKED Cc1ccc2cc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)ccc2n1 536973154 PAGLERQTYWMLRA-UHFFFAOYSA-N 349.459 5.026 30 20 EKED Cc1cc2cc([C@H](C)NC3(c4cccc(C#N)c4)CC3)oc2cc1C 551817619 PZHDDWLOQXVAQL-INIZCTEOSA-N 330.431 5.261 30 20 EKED C[C@H](N[C@@H](C)c1ccncc1F)c1ccc(-c2cccc(C#N)c2)cc1 559834336 VCLNWVYEGJMQNP-HOTGVXAUSA-N 345.421 5.171 30 20 EKED CC[C@@](C)(C#N)C(=O)N[C@H](C)c1ccc(-c2ccc(Cl)cc2)s1 567376047 UCSNQFRIWHCJGL-XIKOKIGWSA-N 346.883 5.186 30 20 EKED C=CCC[C@@H](Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccco1 570810650 WEAZPVSXZCIDQA-LJQANCHMSA-N 340.467 5.188 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(Cl)c1 606538493 UHJPVVZGISZVBL-UHFFFAOYSA-N 341.263 5.275 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)N(CC(C)C)c1ccc(C#N)cc1 609694205 BDRKRQHDMDLRFD-GOSISDBHSA-N 334.463 5.050 30 20 EKED C[C@@H](SCc1coc(-c2cccs2)n1)c1ccc(C#N)cc1 609825379 UKIZDQGMPWGURJ-GFCCVEGCSA-N 326.446 5.269 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)cc(Cl)c1 619755940 ZVAXSSWNILFKTN-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C=CC[C@H]1CCCN(C(=O)Nc2cc(OC)c(Cl)cc2C2CC2)C1 667304084 LFAHGPDLVWVQOY-ZDUSSCGKSA-N 348.874 5.046 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@H]1C 669727765 WCVWEHKWIHKRIS-OAHLLOKOSA-N 338.426 5.096 30 20 EKED Cc1ccc(-c2ncc(/C=C3\Cc4cc(F)ccc4C3=O)s2)cc1 734305503 WGSCHUMFWVPZGC-XNTDXEJSSA-N 335.403 5.080 30 20 EKED C=C(C)COc1cccc(NC(=S)N[C@H](CC)c2cccs2)c1 734379638 XHTXEMOMAZMJDR-MRXNPFEDSA-N 346.521 5.141 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1O 841755541 IUHYZOLVYNMQMZ-KSSFIOAISA-N 328.843 5.131 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc2ccccc2c1O 841763359 VWZHPUBDMJHYPU-OYHNWAKOSA-N 342.442 5.145 30 20 EKED Clc1ccc(C=NOCc2csc(-c3cccs3)n2)cc1 920399633 XRIKBTUSRLSSMH-UHFFFAOYSA-N 334.853 5.076 30 20 EKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(-c2nccs2)cc1 920944321 UTCBGMHGEIRTMI-UHFFFAOYSA-N 349.242 5.573 30 20 EKED C=CCN(C(=O)c1ccc(C)s1)c1nc(-c2ccccc2)cs1 14723861 AOOIEDMERJIUOV-UHFFFAOYSA-N 340.473 5.013 30 20 EKED C=CCCC[C@@H](C)NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C 181398411 ANDUMSJYBKCSIP-UKRRQHHQSA-N 337.533 5.022 30 20 EKED CCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(F)cc1F 181893836 DDMRKFYORJEPQD-VLIAUNLRSA-N 344.405 5.059 30 20 EKED COc1cc(C(=O)/C=C/C(C)=C\c2ccccc2)ccc1OC(F)F 207627651 HBWICEDXRRCBIJ-TXXRRDSISA-N 344.357 5.139 30 20 EKED Cc1c(C(=O)/C=C/c2cnc(C(C)(C)C)s2)oc2ccccc12 303788557 PVOTUJBLJDWJTJ-MDZDMXLPSA-N 325.433 5.391 30 20 EKED Cc1ccc(C)c2c(C)c(/C(O)=N/[C@H]3CCCC34CCOCC4)oc12 328684706 WZEMJWMJVBIJTO-INIZCTEOSA-N 341.451 5.012 30 20 EKED N#CCSc1cccc(/C(O)=N/[C@H]2CCCCC23CCCC3)c1 329603274 GFLJUMOWOFVZKA-KRWDZBQOSA-N 328.481 5.110 30 20 EKED N#CCCC[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)c1ccccc1 352191679 HNPZDQFESHKQAX-KRWDZBQOSA-N 347.245 5.158 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC 413751507 UVTKDTDFRDYNGK-VQTJNVASSA-N 349.474 5.289 30 20 EKED C=C(C)[C@H](NCc1ncc(C(C)(C)C)s1)c1ccc(F)c(F)c1 447892195 GPBBWUHWZUNLET-KRWDZBQOSA-N 336.451 5.126 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)CC(C)(C)C 467495665 WKVVVNINAXICCE-CQSZACIVSA-N 347.528 5.417 30 20 EKED CC[C@@]1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 467898072 KJWAJTJGIXLADI-NRFANRHFSA-N 349.434 5.004 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(F)c(Cl)c1 468952104 JTADFJDPDGXELM-GFCCVEGCSA-N 334.847 5.343 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1 495531528 SQULBADZMOZVQM-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2F)nnc1-c1ccoc1C 501470416 INONTDJJJWRGIK-CYBMUJFWSA-N 343.427 5.025 30 20 EKED C=CCOc1cccc(NC(=O)N(Cc2ccc(C)s2)C(C)C)c1 509231617 CAUIYJQWYJGZRD-UHFFFAOYSA-N 344.480 5.064 30 20 EKED C[C@@H]1CC[C@@H](C)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 510048762 IHFFJFWSAZVSIR-HZPDHXFCSA-N 349.434 5.003 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 559863756 MDHQNQMRHRQIIM-JKSUJKDBSA-N 332.900 5.877 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@H]3CCc4ccc(C#N)cc43)oc12 562095478 CJEDKGDZJUHJKR-LIRRHRJNSA-N 346.430 5.041 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cncnc1C)c1ccc(C(F)(F)F)cc1 570739744 SRIBXBBLAVXLQE-RDTXWAMCSA-N 349.400 5.162 30 20 EKED COc1ccc(-c2ccc(-c3noc(CCCCCC#N)n3)cc2)cc1 589132407 QVKCKHUKJFTQFC-UHFFFAOYSA-N 347.418 5.039 30 20 EKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cc2ccccc2s1 594924335 MAWHGSKXRRKVKJ-HNNXBMFYSA-N 332.472 5.307 30 20 EKED C[C@@H](Sc1nnc(CCC2CCCCC2)o1)c1ccc(C#N)cc1 609813728 JVRXEKIDABOJRB-CQSZACIVSA-N 341.480 5.307 30 20 EKED O=C1/C(=C/c2cc(C(F)(F)F)ccc2F)CCc2sccc21 733206289 FYNNMEZIWGXVSL-VQHVLOKHSA-N 326.314 5.119 30 20 EKED Cc1ccsc1C(=O)/C=C\c1cn(C)nc1-c1cc2ccccc2o1 733748619 FBOZEPXMDJTJEQ-FPLPWBNLSA-N 348.427 5.099 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cnc(C2CCCC2)s1 754711757 AHLGCUDQGHWEGD-UHFFFAOYSA-N 340.370 5.232 30 20 EKED CCC[C@H](N[C@@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902786761 SJQSACAFLHWKLQ-GUYCJALGSA-N 347.384 5.164 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2ccccc2F)s1 915987947 OBUQRBPYGPGTDK-VURMDHGXSA-N 329.421 5.215 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1C 1776089593 ZHNPSWUKOAFCII-KBXCAEBGSA-N 344.499 5.724 30 20 EKED CC1(C)OB(CC/C=C/[C@@H](c2ccccc2)C(F)(F)F)OC1(C)C 2332239997 KRFMEQARNHAICD-JQVXPOPVSA-N 340.194 5.371 30 20 EKED CCOc1cc(/C=C/C(=O)c2ccc3ccccc3c2)ccc1OC 6354951 VJIDEBSOALWJTF-XYOKQWHBSA-N 332.399 5.143 30 20 EKED Cc1ccc(Cl)cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 131862221 LIIDDDZDJCYADO-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccccc2[C@H]1C 191428392 LIALUHGIUACVAL-QGZVFWFLSA-N 348.490 5.690 30 20 EKED O=C(/C=C\c1csc(Br)c1)c1cc2ccccc2o1 216438169 ULRCGAVKPKAOEJ-WAYWQWQTSA-N 333.206 5.153 30 20 EKED CC1(C)CC[C@H](NCc2cccc(OCCCC#N)c2)c2ccccc21 236749657 PBBWGRHMBOAPMQ-QFIPXVFZSA-N 348.490 5.271 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CC1=CCCCC1 303322920 RQZSPOMOLZNOPT-UHFFFAOYSA-N 346.430 5.488 30 20 EKED OC1=Nc2cc(Cl)cc(N=C(O)[C@@H]3C[C@H]3C3CCCCC3)c2OC1 329205146 DHQCAEGWOAOUMX-QWHCGFSZSA-N 348.830 5.125 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1nc(-c2ccncc2)cs1)c1ccco1 428446834 KQYCNHXFYPKIAF-GOEBONIOSA-N 339.464 5.156 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCCCc1cccc(F)c1 486201091 UBUAXKBCIKHGFP-HNNXBMFYSA-N 328.456 5.122 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 523090623 NXWVGHHCNQQBHA-CQSZACIVSA-N 348.427 5.154 30 20 EKED C[C@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1cccc(C#N)c1 547395457 GCEHMYAGFKNMAN-LBPRGKRZSA-N 331.246 5.205 30 20 EKED CC(C)N(CCCCC#N)Cc1ccc(-c2cccc(F)c2)s1 608832703 KQZSKQIDRPKDLO-UHFFFAOYSA-N 330.472 5.458 30 20 EKED CC(C)(C#N)CCCSc1nc2ccc(C(F)(F)F)cc2[nH]1 610480064 MMRWSFFRUTXRNM-UHFFFAOYSA-N 327.375 5.004 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(-c2ccncc2)c1 619755193 BXKOOQUOTPISPK-OAHLLOKOSA-N 347.849 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(CC(F)F)C1 646375050 RXMVVPFMQZSPKD-UHFFFAOYSA-N 336.426 5.048 30 20 EKED C[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 734079635 FCVSLNSNUFUUMB-BXUZGUMPSA-N 346.883 5.342 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3ccccc3)n1)CC2 741847620 IZEUETAZYPWBRY-LFIBNONCSA-N 347.439 5.031 30 20 EKED C=CCN(C(=O)Nc1cccc(COc2ccccc2)c1C)C(C)C 746738989 DDTUUOJMFSWEQQ-UHFFFAOYSA-N 338.451 5.002 30 20 EKED C#CCOc1ccc([C@H](C)Nc2ccc(-c3nc(C)c(C)o3)cc2)cc1 777649272 CZXUYBMIELLKBO-INIZCTEOSA-N 346.430 5.144 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](F)CC1CCCCC1 793469344 SJIZQVZZSKSSAU-HOCLYGCPSA-N 348.487 5.328 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nc2ccccc2s1 796752807 JHFHWNUCUTZCBB-ZJIFWQFVSA-N 338.476 5.079 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCO2 815636043 NXXHZCZSXUXOAG-SFTDATJTSA-N 334.463 5.097 30 20 EKED CCCCCCCCC(=O)N1CCC(c2c[nH]c3ncccc23)CC1 919750034 OYLXNQFPFIVMNQ-UHFFFAOYSA-N 341.499 5.020 30 20 EKED O=C(/C=C\c1c(Cl)nc(Cl)n1-c1ccccc1)c1cccs1 920063062 WXEBTOUTHYICLG-HJWRWDBZSA-N 349.242 5.137 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccc(C#N)cc1 79647987 PRNQSJKSYUHFTC-HNNXBMFYSA-N 338.476 5.109 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(C)[C@H](C)CC#N 86285241 DYYNINSPGHPVIE-CQSZACIVSA-N 341.842 5.081 30 20 EKED COc1cccc(/C=C\C(=O)c2cc3ccccc3o2)c1OC(C)C 211794147 MZMUJRGXGJACBM-QXMHVHEDSA-N 336.387 5.125 30 20 EKED COc1ccc2c(c1)CCC[C@H]2N[C@@H](CCCC#N)c1ccccc1 340446772 HEWPFWZVEJTTAK-FCHUYYIVSA-N 334.463 5.097 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1F 359386846 CYBOZSAVXITIJG-ZWKOTPCHSA-N 330.834 5.565 30 20 EKED CC(C)(c1ccc(NCc2ccc(C#N)c(F)c2)cc1)C(F)(F)F 432326181 ANRJMKAREPYGFT-UHFFFAOYSA-N 336.332 5.149 30 20 EKED C[C@H](C#N)CSc1ccccc1NCC#Cc1cccc(Cl)c1 448058953 VADLGAOJOJLGQE-OAHLLOKOSA-N 340.879 5.055 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 464447931 UIFQHVKUUOZOBX-DYVFJYSZSA-N 333.884 5.209 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 466426943 UKFPRICSSIHUQR-RISCZKNCSA-N 333.781 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC1CCCCC1 475573668 MKUNXIWLOMHEPD-UHFFFAOYSA-N 328.500 5.583 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 489041116 NTYISIKVMFMWLP-KRWDZBQOSA-N 333.353 5.090 30 20 EKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 512668547 VPCFNPZYGIOORK-VXGBXAGGSA-N 336.332 5.128 30 20 EKED CSc1ccc(C)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1 539174381 PBVDHQKRWPHHBZ-UHFFFAOYSA-N 344.505 5.200 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 539495787 DUDFXWUKVQEXAG-ZHRRBRCNSA-N 346.861 5.652 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)o1 540627688 DFIFNPKLAFABQZ-XZOQPEGZSA-N 342.442 5.102 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 559863754 MDHQNQMRHRQIIM-HOTGVXAUSA-N 332.900 5.877 30 20 EKED C=CCC[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1)c1ccco1 568306361 DCVUCOYFFGBQLS-QGZVFWFLSA-N 336.391 5.244 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1cccc(Cl)c1)c1ccc(C#N)cc1 609825588 HBIRADOALWVQFQ-QWHCGFSZSA-N 344.867 5.033 30 20 EKED CN(CCC(C#N)(c1ccccc1)c1ccccc1)Cc1ccsc1 611567890 IDDCYUDQTHVPJU-UHFFFAOYSA-N 346.499 5.080 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C(C)C)cc1 615468707 RCCUIMMBIDJIQZ-UHFFFAOYSA-N 326.415 5.169 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(SC(F)F)cc1 740765542 FVBRDGMZLYSOIO-KTKRTIGZSA-N 341.382 5.446 30 20 EKED COCc1cccc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)c1 742435064 RLCOVWKADDDHJW-BJMVGYQFSA-N 348.414 5.086 30 20 EKED CC1(C)CCC[C@H]1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772162964 WYHVSEFZLFIPFO-UXHICEINSA-N 332.447 5.107 30 20 EKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217090 BPGXOUHAXJUEBE-UKRRQHHQSA-N 340.389 5.273 30 20 EKED COc1cccc2cc(/C=C/C(=O)c3cc4cccc(OC)c4o3)oc12 916130436 VFYTYHXGRVINHV-MDZDMXLPSA-N 348.354 5.092 30 20 EKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1ccc2ccccc2n1 48854873 LNZPSIJQKDIMDU-HNNXBMFYSA-N 346.773 5.124 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(N2CCCCC2)cc1 90665261 YKAKEPSVVCSGCL-WMZHIEFXSA-N 347.506 5.373 30 20 EKED N#CCCC[C@H](NCc1cccc(C(F)(F)F)c1)c1ccccc1 353911412 BXHLVDHDSYHKOU-SFHVURJKSA-N 332.369 5.230 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(F)c1Cl 463462021 SUWYNEYVVJLBCG-UHFFFAOYSA-N 344.238 5.022 30 20 EKED C=CC[C@@H](CC)NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 466538883 JOFRFIJCZVHDEI-QGZVFWFLSA-N 346.430 5.093 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1)c1nc(-c2ccc(Cl)cc2)no1 505078967 XFKFUANXCHGRJN-LLVKDONJSA-N 341.823 5.115 30 20 EKED CC(C)Sc1ccc([C@H](C)Nc2ncc(C#N)cc2Cl)cc1 505575649 BUFQWSJIAYJDTR-LBPRGKRZSA-N 331.872 5.280 30 20 EKED C=CCOc1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 518804024 ZQTBMPACQNPAHY-QHCPKHFHSA-N 347.433 5.270 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1ncc(-c2ccccc2)s1 539407682 JXNHTQKMAWADKM-UHFFFAOYSA-N 347.487 5.092 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc(F)c(OC)c1)c1ccc(F)c(F)c1 547829948 YFOMACVMWQRKEC-HXPMCKFVSA-N 335.369 5.081 30 20 EKED N#CCCC[C@@H](NCC1CCC(C(F)(F)F)CC1)c1ccccc1 556907938 HKUGKXJJRFYVRF-VMWRSERWSA-N 338.417 5.380 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cncnc1C)c1ccc(C(F)(F)F)cc1 570739742 SRIBXBBLAVXLQE-KSSFIOAISA-N 349.400 5.162 30 20 EKED N#CCCCCCC(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 588748759 ZOCPIYOMOCCNHT-UHFFFAOYSA-N 332.403 5.512 30 20 EKED CC(C)Oc1ccc([C@H](C)NCc2ccc(CC#N)cc2)cc1Cl 592391483 YFLGNWVNGIHTDM-HNNXBMFYSA-N 342.870 5.044 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)s1 609407970 KLAVFNTUEKXDPB-RBUKOAKNSA-N 346.455 5.078 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)[C@H](C)c1c(Cl)cccc1Cl 615926002 SOSCNXIPILQNJD-GFCCVEGCSA-N 341.282 5.028 30 20 EKED Cc1ncsc1C(=O)/C=C\c1ccc(Cl)c(C(F)(F)F)c1 727264383 QBGVTAOPLKDSOG-HYXAFXHYSA-N 331.746 5.020 30 20 EKED CCCCC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 776155211 DCBCJHGJSUMKAK-XMSQKQJNSA-N 336.479 5.561 30 20 EKED O=C(/C=C\c1cccnc1)c1ccc(-c2ccccc2Cl)s1 915113912 XYWBDZLCUKNPHN-FPLPWBNLSA-N 325.820 5.360 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1C 916850001 XSOXAPCRZRIFCF-BQYDLMEBSA-N 340.426 5.050 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cl)ccc1Cl 43154834 XJCSFPZBTVYPEK-UHFFFAOYSA-N 341.263 5.275 30 20 EKED Cc1nc(C)c([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 180221585 QUAJUXCDCAYLOQ-AWEZNQCLSA-N 347.487 5.149 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)c(Cl)c1)c1ccccc1 431689432 BMJAAONDMQOLQM-QGZVFWFLSA-N 345.805 5.036 30 20 EKED Cc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 432468993 BADZCEYFVCTWSX-QGZVFWFLSA-N 341.842 5.205 30 20 EKED C=C[C@H](CC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C)c1ccccc1 466901073 NCEHNANYLPZNFQ-KNKQGSTJSA-N 333.475 5.141 30 20 EKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 467611049 QKWJYKUIBZVQGY-QAPCUYQASA-N 349.434 5.003 30 20 EKED COCC[C@@H]1CCC[C@@H]1N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 502413093 HRCDZGRASARRFI-HYVJGQCMSA-N 348.490 5.081 30 20 EKED CCc1cccc(C)c1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 519905503 OTIXGCRXCRWUKM-UHFFFAOYSA-N 349.478 5.119 30 20 EKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)c(F)c1 537400193 NIOWIUKONFPHQS-CWTRNNRKSA-N 328.818 5.153 30 20 EKED CC[C@H](Nc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1 571746716 REURBTALDDHOCB-QFIPXVFZSA-N 346.430 5.431 30 20 EKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 594922144 HSVZPGIYPDLQGU-AWEZNQCLSA-N 344.380 5.111 30 20 EKED N#CC1(c2ccc(CN[C@@H]3CCCc4sc(Cl)cc43)cc2)CC1 594940433 CNAWNNJXKPLYGQ-MRXNPFEDSA-N 342.895 5.124 30 20 EKED C[C@H](Nc1ncc(C#N)cc1Cl)c1cccc(Cl)c1Cl 609797584 RDHRMDMCUYAZMB-QMMMGPOBSA-N 326.614 5.087 30 20 EKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1ccc2ccccc2n1 675907326 SSSOYTAMTOXWJY-AWEZNQCLSA-N 344.395 5.046 30 20 EKED Cc1nc(/C=C/c2ccsc2)sc1C(=O)/C=C/c1ccsc1 726849142 XDIHEBKCCFAFMV-ZUVMSYQZSA-N 343.498 5.641 30 20 EKED Oc1cccc(C=Nc2cccc(CSC3CCCC3)c2)c1O 740763589 LZSHFPHOWYZTSD-UHFFFAOYSA-N 327.449 5.024 30 20 EKED C[C@H](CC#N)NC(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 775540388 KREWNICYCPQXLG-LLVKDONJSA-N 348.233 5.084 30 20 EKED C#CCCCCCC(=O)N1CCc2cc(Cl)cc(Cl)c2[C@H]1C 779980617 JRCHOZDUHWBBQG-CYBMUJFWSA-N 338.278 5.023 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1ccccc1OC 789723432 YCRPMJDWHYWJFA-ICFOKQHNSA-N 349.474 5.589 30 20 EKED C(=NOCc1ccccc1)c1ccc(-c2nc3ccccc3s2)o1 839421877 QAMCTJKDLJLDGT-UHFFFAOYSA-N 334.400 5.107 30 20 EKED C=CCCC[C@@H](Nc1cccc([C@@H]2CCC(=O)N2)c1)c1ccccc1 883229533 LMPMHYQAESQRMN-RTWAWAEBSA-N 334.463 5.147 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2)cc1 915087493 UFJMITLOISBZCL-FQEVSTJZSA-N 346.817 5.248 30 20 EKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)CC(C)C)c1 1776787421 HUAVBCRBFUJJSB-IBGZPJMESA-N 349.515 5.015 30 20 EKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 14426906 IAWJHOXZYCJKLT-UHFFFAOYSA-N 344.439 5.270 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 41537683 NGXUOHCXMPKDOI-QAPCUYQASA-N 346.455 5.180 30 20 EKED C=CCOc1ccccc1CNc1cccc(COCc2ccco2)c1 236678690 IRCLMLSKNXEENK-UHFFFAOYSA-N 349.430 5.173 30 20 EKED OC(=Nc1cccc2oc(C(F)(F)F)nc12)[C@@H]1CCCC(F)(F)C1 328773854 HMOYMAGEGRANFY-MRVPVSSYSA-N 348.271 5.260 30 20 EKED C=CCCc1ccccc1NCc1cccc(C(=O)N2CCCCC2)c1 409847058 IFNQDZSYUJCQQJ-UHFFFAOYSA-N 348.490 5.043 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1CCC(C)(C)CC1 426377769 DVHWXXKQWIWCKK-CQSZACIVSA-N 330.497 5.236 30 20 EKED CCCc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)sc1C 430602462 LDZDZGVISYYDIX-CYBMUJFWSA-N 346.521 5.253 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C#N)cs2)c(C)c1 437571750 XGHRTVVWTPCSJQ-GFCCVEGCSA-N 330.478 5.071 30 20 EKED CCc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 452138786 KKJLTAYTBQSYFH-IBGZPJMESA-N 346.430 5.160 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C(C)(C)C1 475553650 ZKFXWWKUKXVBIY-INIZCTEOSA-N 328.500 5.438 30 20 EKED C=CCOc1ccc(CN[C@H](c2cccs2)C2CC2)cc1Cl 521823074 AFRYISZWYRNPDF-SFHVURJKSA-N 333.884 5.207 30 20 EKED CCc1ccc(-c2noc(CS[C@@H](C)c3ccc(C#N)cc3)n2)cc1 522840981 GALCHKAFJLFYLA-AWEZNQCLSA-N 349.459 5.165 30 20 EKED CC(C)c1cc(Cl)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 529853693 PTSPBOCRBIJLOV-UHFFFAOYSA-N 338.838 5.271 30 20 EKED C=C[C@H](CC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F)c1ccccc1 533937479 ZSWVZLCTHZCLIX-CSODHUTKSA-N 337.438 5.095 30 20 EKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N 538072981 CGFSMLVFZJNJMR-NEPJUHHUSA-N 344.505 5.029 30 20 EKED CC(C)[C@H]1C[C@@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542948400 UPTMCCHHLHCICS-PDIWNELESA-N 348.490 5.079 30 20 EKED Cc1ccc(SC2CCCC2)c(C(=O)NCC(C)(C)CCC#N)c1 582147556 VLEWIOWLIVUJRM-UHFFFAOYSA-N 344.524 5.090 30 20 EKED C[C@@H](Oc1ccccc1NC(=O)CCCCCC#N)c1ccccc1 588927917 CFTFYMXAFBQRBD-QGZVFWFLSA-N 336.435 5.239 30 20 EKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(C)c1C 606757647 IMICVEQJVGROJA-UHFFFAOYSA-N 349.352 5.139 30 20 EKED Cc1ccc(-c2ccsc2C(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610363455 XGUQXXIHWVQOHJ-OAHLLOKOSA-N 346.455 5.086 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OCCC)cc1C 615567071 ZTFZQOLNFHGSRS-UHFFFAOYSA-N 338.451 5.004 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCC[C@@H]3C)n2)cc1 769282460 ODRXZLYLZGENNP-USXIJHARSA-N 338.476 5.121 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCc3c(C)ccc(C)c32)c1 769962472 IKNQPYPOGLEDNZ-UGKGYDQZSA-N 348.490 5.152 30 20 EKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)CCC2 776168228 ACNOLEMOVYQWFQ-GAJHUEQPSA-N 348.490 5.441 30 20 EKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cc2ccccc2s1 780188963 SJOGVDBWUJSXRN-WAYWQWQTSA-N 348.452 5.316 30 20 EKED C#CCCCCCC(=O)Nc1ccccc1NCc1ccccc1C 782775665 HPUBORHXHJWWSW-UHFFFAOYSA-N 334.463 5.129 30 20 EKED CCCCCCCC[S@](=O)[C@@H](C)c1nc(-c2ccccc2C)no1 790139739 MMOBLQHHQAFAJK-FYSMJZIKSA-N 348.512 5.215 30 20 EKED C=C(C)C(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 819945086 FDZAUKBLEMXFES-CQSZACIVSA-N 344.867 5.242 30 20 EKED C[C@H](CC(C)(C)C#N)OC(=O)c1ccc(C2SCCCS2)cc1 851213050 COXURJNYAAIBDV-CYBMUJFWSA-N 349.521 5.040 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1 1776806026 VFLYVLOCUHJJSZ-VAWYXSNFSA-N 336.431 5.240 30 20 EKED C=C(C)CN(CC)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 60624977 OXLYEFBFSYDQAZ-UHFFFAOYSA-N 349.430 5.050 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(F)cc1F 108408293 BNNOTSPMHSNHJO-STQMWFEESA-N 332.419 5.390 30 20 EKED COc1ccc(-c2csc(CN[C@H](C)c3cccc(C#N)c3)c2)cc1 181850249 DDHVRDRGDYNASY-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1cccnc1)C1CC1 355590015 YWRCKPSRLSVKQK-HXUWFJFHSA-N 349.478 5.206 30 20 EKED C=CCCc1ccccc1NC(=O)c1cnc(-c2ccsc2)s1 410366147 NJNKXTPFEXAADV-UHFFFAOYSA-N 340.473 5.243 30 20 EKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc2ccccc12 474205554 KBFOGOVJXQSTDO-FXAWDEMLSA-N 342.442 5.105 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480673663 SBUMZDOJLIKNIM-YJYMSZOUSA-N 346.377 5.149 30 20 EKED Cc1ccc(-c2cc(CSCc3ccc(F)cc3C#N)on2)cc1 488532977 XRGTWHNWRCNYFE-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1C(F)F 504786588 QRYPKOZXIBZWHF-INIZCTEOSA-N 336.426 5.190 30 20 EKED N#CCCCCNc1nc(C2CC2)nc2scc(-c3ccccc3)c12 505598865 YTKUZIMLNRILHS-UHFFFAOYSA-N 348.475 5.341 30 20 EKED N#Cc1ccc(S[C@H](C(=O)Nc2ccccc2)c2ccccc2)cc1 509641994 WFHXFUQUNGWGLA-FQEVSTJZSA-N 344.439 5.030 30 20 EKED C[C@H](NCc1ccc(OC2CCCCC2)cc1)c1cccc(C#N)c1 540594825 PTYZTLUBMJLKNP-KRWDZBQOSA-N 334.463 5.121 30 20 EKED CCC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550836526 RFTYXZOJXMCAJD-SFTDATJTSA-N 340.898 6.206 30 20 EKED N#CCCC[C@H](NC1CC(c2cccc(Cl)c2)C1)c1ccccc1 559864074 RKNOGQJJPLRRCS-MNLRITNHSA-N 338.882 5.611 30 20 EKED C[C@H](NCc1ccc(F)c(-c2cccs2)c1)c1cccc(C#N)c1 610344907 LVOYDFZQRJGVHW-AWEZNQCLSA-N 336.435 5.277 30 20 EKED Cc1ccc(-c2nc(/C=C3\CCc4cc(O)ccc4C3=O)cs2)cc1 726427673 SPYYZUNOABSHKO-MHWRWJLKSA-N 347.439 5.037 30 20 EKED CC(=NNc1ccccn1)c1c(F)cccc1O[C@@H](C)c1ccccc1 730140912 CBQSYNVWELRRKZ-INIZCTEOSA-N 349.409 5.197 30 20 EKED CCCCC1CCC(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)CC1 735792583 MRDPOSPLCUZGGC-JCYILVPMSA-N 337.467 5.044 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(SCC(F)F)cc1)c1ccccc1 773115650 NRLDSINSDSKVGH-KXBFYZLASA-N 345.458 5.459 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC2CCC2)c2ccccc2)c1 776165067 NVCGIJBALRLOKZ-GMAHTHKFSA-N 348.490 5.389 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3cccc(F)c3F)cs2)cc1 776267885 IEDKGQRSMKAHGL-KTKRTIGZSA-N 341.382 5.293 30 20 EKED CCCCCCC[C@H](C)CN[C@H]1CCN(C(C)=O)Cc2ccccc21 779021038 XCTLQZONZURXQB-AVRDEDQJSA-N 344.543 5.066 30 20 EKED C[C@H](SCC(=O)Nc1ccc2ccccc2c1)c1cccc(C#N)c1 785537165 MTGQJZWIWABXKK-HNNXBMFYSA-N 346.455 5.144 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)c1ccnc(O)c1 798231177 RNIGMCSVKIKTFL-FNORWQNLSA-N 341.819 5.065 30 20 EKED CSC1(C=NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 814948878 JNKAQZYEITVZPV-UHFFFAOYSA-N 342.308 5.018 30 20 EKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccsc3)cc2)c1 1777686064 BQASFPSPFAPMLT-TWGQIWQCSA-N 334.396 5.009 30 20 EKED C=CCN(Cc1cccs1)C(=O)c1cc(C2CC2)nc2ccccc12 60678042 VUIIBZRXNRYHES-UHFFFAOYSA-N 348.471 5.002 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](CC)c2ccncc2)cc1 163810684 GNOYJAGQGHZHBR-DNVCBOLYSA-N 330.859 5.015 30 20 EKED FC(F)Oc1ccccc1C=NOCc1ccc(Cl)c(Cl)c1 250207988 WWRIWUKUEHFFNB-UHFFFAOYSA-N 346.160 5.146 30 20 EKED CC(O)=Nc1ccc(S[C@H](C)/C(O)=N/[C@H]2CC23CCCCC3)cc1 329122632 RGKPTACKKDDHAG-DYVFJYSZSA-N 346.496 5.454 30 20 EKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC(C)(C)C1 416805856 FHSOERUJKUWPBW-AWEZNQCLSA-N 345.512 5.123 30 20 EKED CC(C)[C@@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 460341494 BSRHMRXIGYNHNG-OAHLLOKOSA-N 340.854 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCC[C@H](C)C1 475581110 DVBYGQURHPXXCQ-FUHWJXTLSA-N 328.500 5.581 30 20 EKED C[C@H](Sc1nc(C(F)(F)F)ccc1C#N)c1ccc(F)c(F)c1 488765117 MIJRCYJLTADMOP-QMMMGPOBSA-N 344.308 5.104 30 20 EKED CC1CCN(c2cccc(N[C@H](C)c3ccc(C#N)cc3F)c2)CC1 512275667 ARRODDDXCXUJHC-MRXNPFEDSA-N 337.442 5.107 30 20 EKED N#Cc1cnc(N[C@@H](Cc2ccccc2)c2ccccc2)c(Cl)c1 513635757 RCFNECYWZRUNAB-IBGZPJMESA-N 333.822 5.003 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H]1CCCC[C@H]1C 519423848 GKAHRTFMUIAGAI-BZUAXINKSA-N 330.497 5.093 30 20 EKED C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 535654423 FFLGMJCHLIBPAR-HZPDHXFCSA-N 349.434 5.003 30 20 EKED Cc1ccsc1[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 538113883 PLNOEZJEALJIAA-INIZCTEOSA-N 332.472 5.446 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 539052279 TWDRPIKUKLONIF-UGSOOPFHSA-N 333.262 5.689 30 20 EKED CC(C)c1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)C(C)C)cc1 603650885 KNRBTADDUYVZSE-OAQYLSRUSA-N 349.478 5.395 30 20 EKED CC[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(C)cc1 609967825 JMOAXWOLWZOWSN-NRFANRHFSA-N 348.490 5.188 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)cc1Cl 618807470 ZVKADAABUIVMMM-ADLMAVQZSA-N 331.246 5.203 30 20 EKED C[C@@H](Nc1ccc(N(C)Cc2ccccc2)cc1)c1ccc(C#N)cc1 743471726 CULMDLCVYUXBEA-GOSISDBHSA-N 341.458 5.368 30 20 EKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2ccc(F)cc2F)ccc1OC 749450692 CVSQGPJWYVSNNJ-NEXMIYJRSA-N 346.373 5.047 30 20 EKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1ccc(F)cc1F 751521039 DBPSSRQOVKTTFG-UTCJRWHESA-N 339.316 5.062 30 20 EKED CCC(=NN(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 772989079 CLUNSWKTRCACMP-UHFFFAOYSA-N 325.415 5.511 30 20 EKED C[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1nc2ccccc2s1 795796872 UZURJDPTJWUPCB-RDTXWAMCSA-N 347.487 5.286 30 20 EKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1ccc(F)c2ccccc12 808121041 VXZRSYUIPWIJLO-VIFPVBQESA-N 331.803 5.134 30 20 EKED O=C(/C=C\c1csc(Br)c1)c1c(F)cccc1Cl 809158955 GEPBYNSQYAYABH-PLNGDYQASA-N 345.620 5.199 30 20 EKED N#CCCC[C@@H](NCc1ccc(SC(F)F)cc1)c1ccccc1 814303704 AGBRJMIGAKVALW-GOSISDBHSA-N 346.446 5.526 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)cc(C#N)cc1C 907676022 GSPWVIVIZPBFEM-UHFFFAOYSA-N 346.474 5.208 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCC1CCC(C(C)C)CC1 1776783227 KOEHCZMLQNWMGK-ACBHZAAOSA-N 325.537 5.242 30 20 EKED CC(C)(C#N)CCCSc1nn(-c2ccccc2)c(=S)s1 177182615 OPIWPHVLEWFLQO-UHFFFAOYSA-N 335.523 5.085 30 20 EKED CC#CCCCC(=O)Nc1c(Cl)cc(C(F)(F)F)cc1Cl 411112462 JHEYQINATSKUBM-UHFFFAOYSA-N 338.156 5.144 30 20 EKED CC(C)(c1ccc(NCc2ccc(C#N)cc2F)cc1)C(F)(F)F 428527794 BSNQGGMDTNSQAE-UHFFFAOYSA-N 336.332 5.149 30 20 EKED CCc1ccc(CC)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 433001031 HCWDLNKSPQTOAH-HXUWFJFHSA-N 349.478 5.368 30 20 EKED Cc1ccc(-c2ccc(CN(C(=O)CCCC#N)C(C)C)s2)cc1 463575425 RIAXOWQMHBAJJV-UHFFFAOYSA-N 340.492 5.154 30 20 EKED C=CCOCCCC(=O)Nc1ccc(SC2CCCCC2)cc1C 463633659 GNAMUOMXVHONFH-UHFFFAOYSA-N 347.524 5.341 30 20 EKED Cc1cc(C(F)(F)F)ccc1CN[C@H]1CCCc2cc(C#N)ccc21 467404762 ZSIOBUUTXCVQAK-IBGZPJMESA-N 344.380 5.053 30 20 EKED C[C@H](C#N)C(=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 469223448 HSPMFLSFOBXCGY-MRXNPFEDSA-N 326.399 5.119 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)C[C@H](CC#N)c1ccccc1 475364941 CDQWYBHLCFLRDT-LEWJYISDSA-N 334.463 5.074 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@H](OCC)C(C)C 475568757 FQGFSRAZVSTDRP-IBGZPJMESA-N 346.515 5.111 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccc2s1 476124911 ZGRRYXATKZGMJJ-UHFFFAOYSA-N 335.472 6.006 30 20 EKED COc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(C#N)cc1F 512666273 JOQUPJAZEKQMOK-FOIQADDNSA-N 340.442 5.144 30 20 EKED N#Cc1cccc(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2)c1 527036943 XBRUEGXGTRIFCV-UHFFFAOYSA-N 346.817 5.060 30 20 EKED C=CC[C@@H]1CCN(C(=O)Nc2cccc(CSC(C)C)c2C)C1 599753874 XSCRRMROFGNCOO-MRXNPFEDSA-N 332.513 5.067 30 20 EKED C[C@@H](NC(=O)CC1CCC(c2ccccc2)CC1)c1cccc(C#N)c1 610361349 ADOHVKLEYLXIJP-MPQSDHOMSA-N 346.474 5.100 30 20 EKED C=CCC[C@H](N[C@H](C)c1c[nH]nc1C)c1ccc(C(F)(F)F)cc1 679357086 VMRPKACUUPSAOV-PXAZEXFGSA-N 337.389 5.095 30 20 EKED COc1ccc2oc(C(=O)/C=C/c3ccc4ncccc4c3)c(C)c2c1 729151950 ZBJXVXNYEKTWQL-RMKNXTFCSA-N 343.382 5.194 30 20 EKED CCCCCCCC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 731643942 LPKALLCWGPRSKL-OAHLLOKOSA-N 327.255 5.035 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2ccc(C#N)cc2)o1 734303406 NVCKNMLZDXTSOG-LUAWRHEFSA-N 331.346 5.162 30 20 EKED FC(F)Oc1ccccc1CON=Cc1cccc(Cl)c1Cl 735488514 SEABTPCQZHDYIN-UHFFFAOYSA-N 346.160 5.146 30 20 EKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 739155485 IFYDPKADBKRGRL-QAPCUYQASA-N 346.430 5.321 30 20 EKED CCCc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 746659179 JYLAMDAMQQVLRO-UHFFFAOYSA-N 349.478 5.201 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ccc(Cl)cc2)n1 747197912 NVNREYMSZOUPTC-OAHLLOKOSA-N 346.883 5.119 30 20 EKED N#Cc1cccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)c1 750917326 SJBSDPJBKWPATF-DHDCSXOGSA-N 341.382 5.085 30 20 EKED Oc1ccc2ccccc2c1/C=N/[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 753996979 ZNOCLJUFCKMQMM-IWGJDDPLSA-N 349.405 5.024 30 20 EKED N#Cc1ccc(F)c(CN[C@@H]2CCCc3c2sc2ccccc32)c1 773029050 ATDBRMVDMPTMDR-GOSISDBHSA-N 336.435 5.079 30 20 EKED O=C1/C(=C\c2ccc3cnccc3c2)CCc2[nH]c3ccc(F)cc3c21 782323267 LWDXBNJJBOFKAA-GDNBJRDFSA-N 342.373 5.068 30 20 EKED CCC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccsc1 785566554 GJKKCTWTHMTUCO-MJGOQNOKSA-N 328.481 5.060 30 20 EKED C=CCCCCC[C@@H](C)N[C@H](C(=O)O)c1cccc2ccccc12 902565142 JSCJEUUXKPGDKJ-UZLBHIALSA-N 325.452 5.080 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)cc(Cl)cc1C 1776783258 LMJBWGOIRQGTCE-KRWDZBQOSA-N 339.907 5.250 30 20 EKED CCC[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 59281312 ULHNSKXFKVWCHV-RDTXWAMCSA-N 340.854 5.370 30 20 EKED Cc1cc2cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)oc2cc1C 124593365 ZVDFODOAJPGEJN-CQSZACIVSA-N 338.432 5.120 30 20 EKED Cc1ccccc1[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)C(C)(C)C 181866637 BVDNQLRCAOEMLI-DYESRHJHSA-N 336.479 5.335 30 20 EKED C=C(C)[C@@H](NCc1ncc(-c2cccs2)o1)c1ccc(F)c(F)c1 187761034 VYJHRICADYKWJB-GOSISDBHSA-N 346.402 5.088 30 20 EKED Cc1ccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)o1 303688274 LYBPQNNACUADQC-UHFFFAOYSA-N 333.416 5.247 30 20 EKED CC(O)=Nc1ccc(C)cc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329086531 UVCRVUSKSJORDY-GVDBMIGSSA-N 328.456 5.797 30 20 EKED Cc1ccc(-c2nnc(SCCCCC(C)(C)C#N)o2)cc1C 436141871 OXIHIWRLRAOUQB-UHFFFAOYSA-N 329.469 5.166 30 20 EKED CC(C)(C)[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1ccccc1 437404015 ISIXIWOGHMFXEL-SFHVURJKSA-N 344.405 5.037 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466230948 APKZMLSRRUFNIG-DLBZAZTESA-N 332.447 5.005 30 20 EKED CC(C)c1ccc2c(c1)[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)CC2 476876666 HSOOHBSQSXNUSP-UNMCSNQZSA-N 346.474 5.001 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(Cl)cc1OCC 486421300 CFGVIYHSSYCWKY-UHFFFAOYSA-N 347.867 5.269 30 20 EKED CCSc1cccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 506724572 MADFUDZOHSNWOW-UHFFFAOYSA-N 339.464 5.244 30 20 EKED CC(C)CCC[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 523006381 AYVSZSJVUSSDJO-CVEARBPZSA-N 347.528 5.275 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc2cc(OC)ccc2c1 532466518 VJNVLKMMVDXXJF-WAIKUNEKSA-N 344.458 5.522 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(F)cc1 539217111 JVEQRKXEFMHZQU-INIZCTEOSA-N 330.406 5.215 30 20 EKED C=CCCCC(=O)N1CCC(c2ccc(Cl)cc2Cl)CC1 557294830 DBZAAHBJNKIRFF-UHFFFAOYSA-N 326.267 5.056 30 20 EKED CC(C)c1ccsc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592973290 BXSNSJFLPSQIRL-LBPRGKRZSA-N 344.436 5.110 30 20 EKED C=CC1CCN(C(=O)Nc2cc(F)ccc2Oc2ccccc2)CC1 601157163 FPDXPZVLDFBOKT-UHFFFAOYSA-N 340.398 5.048 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cccc(C)c2C)c1 727284674 KFPWVXSIXBTKIO-UHFFFAOYSA-N 326.465 5.067 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 737502280 GDDBNTHJUSWXMR-BEFAXECRSA-N 346.455 5.146 30 20 EKED C=CC[C@@H](NC(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1ccncc1 737854600 KKYPSCKJMJLSRL-DYESRHJHSA-N 336.479 5.132 30 20 EKED COCc1cccc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)c1 742435071 RLCOVWKADDDHJW-YHYXMXQVSA-N 348.414 5.086 30 20 EKED COc1cc(C(C)=NNc2cccc(C)c2)ccc1SC(F)F 746484988 PUHVCGZUWHAINZ-UHFFFAOYSA-N 336.407 5.154 30 20 EKED C[C@H](N[C@@H](CC1CCCC1)c1ccccc1)c1ccc(OCC#N)cc1 776170317 OVEBFPSMJAEJNH-MBSDFSHPSA-N 348.490 5.561 30 20 EKED CC(=NNc1ccnc(F)c1)c1ccc(Cl)c(Cl)c1Cl 781134229 XHAIOLTVTZGNHQ-UHFFFAOYSA-N 332.593 5.017 30 20 EKED O=C(/C=C/c1scnc1C1CC1)c1cc2cc(Cl)ccc2o1 782306648 OTMLYMCPYAMIFW-GQCTYLIASA-N 329.808 5.316 30 20 EKED CCN(Cc1cc2ccccc2c(Cl)n1)[C@H](C)c1ccc(C#N)cc1 788479106 NVNRRBROOPPJOD-OAHLLOKOSA-N 349.865 5.343 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813218058 SAYGBYMPFDSMFN-BLLLJJGKSA-N 346.352 5.104 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1ccc(Br)cc1 834675321 GFBRNWWUHSHFAM-ALCCZGGFSA-N 327.630 5.060 30 20 EKED CC(C)c1ccc(C=NOCc2cc(-c3cccs3)on2)cc1 836714197 WIPMODWHWAHASQ-UHFFFAOYSA-N 326.421 5.077 30 20 EKED CCCCCCCCCC(=O)Nc1ccccc1-c1noc(C)n1 915866042 AVVLUXHTLRKFBY-UHFFFAOYSA-N 329.444 5.124 30 20 EKED C=CCC[C@H](CC(C)C)C(=O)Nc1cc(C(=O)O)c2ccccc2c1 1776166344 VVWMDDQNTUTRIJ-MRXNPFEDSA-N 339.435 5.105 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1sccc1C#N)C1CC1 52032408 UXZDKPNYZUEHKD-CQSZACIVSA-N 346.455 5.139 30 20 EKED CC(C)(C)c1c(CC#N)nc2ccc([N+](=O)[O-])cc2c1-c1ccccc1 60510996 XYAKIANVBSFDDW-UHFFFAOYSA-N 345.402 5.174 30 20 EKED COCCSc1ccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)cc1 78618393 GPWFQDMRPGHCNK-ZDUSSCGKSA-N 346.883 5.123 30 20 EKED C[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 181322670 NSAMOIHJWIHEMY-IRXDYDNUSA-N 327.431 5.032 30 20 EKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 410011304 RMKLHCWIOGLNAN-LLVKDONJSA-N 348.233 5.090 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474888150 NTDTXMMUZOYASX-XBVQOTNRSA-N 344.911 5.528 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1Cl 475545104 DFXIEINCIJQCBC-UHFFFAOYSA-N 342.870 5.514 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cccc(SCC)c1 485462218 BOWYDSPXRCITHA-UHFFFAOYSA-N 329.490 5.329 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2)cc1 520625169 PVHISMKJLPENFC-UHFFFAOYSA-N 347.349 5.134 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(Cl)c1Cl 574979664 XMLBWIIUUPQCFR-DIFFPNOSSA-N 331.246 5.203 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 580101751 HHNMIBCCOXGUED-WZONZLPQSA-N 328.459 5.926 30 20 EKED CC1=C(C)C[C@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 581192298 KUTOSUSOSJBLTC-HZPDHXFCSA-N 328.481 5.156 30 20 EKED C=C[C@](C)(CC)c1nc([C@@H](CCCOC)c2ccc(Cl)cc2)no1 583050685 CPRWPWIKKLAODZ-QFBILLFUSA-N 348.874 5.135 30 20 EKED C[C@H](NCc1ccc([C@H](C)C(F)(F)F)cc1)c1cccc(C#N)c1 590712590 PTENCIHFHMYTBZ-KBPBESRZSA-N 332.369 5.075 30 20 EKED CCOc1ccc(C(F)(F)F)cc1N[C@H](C)c1ccc(C#N)cc1 609825458 YHRAYGOYKXVHCF-GFCCVEGCSA-N 334.341 5.149 30 20 EKED Cc1ccc(-c2nc(/C=C3\Cc4cc(F)ccc4C3=O)cs2)cc1 734305006 DOLPCLXSDAGBCK-XNTDXEJSSA-N 335.403 5.080 30 20 EKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1csc2ccccc12 740050832 NBLSTESLFHEVNU-HNNXBMFYSA-N 330.497 5.350 30 20 EKED O=C(/C=C\c1cc2ccccc2o1)c1cccc(-c2ccncc2)c1 741473923 UVXURYVDRIKKGZ-HJWRWDBZSA-N 325.367 5.391 30 20 EKED CC(C)Oc1cccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745990515 ROZVGVKLFDMTDU-IZZDOVSWSA-N 343.426 5.432 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccc(Br)cc1)c1ccncc1 766020949 RPSJFHOZOASQDU-ZWKOTPCHSA-N 345.284 5.202 30 20 EKED CCc1ccc([C@@H](CC)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772984563 OLBADFLFNOVZAC-RBBKRZOGSA-N 336.479 5.171 30 20 EKED Cc1ccccc1[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 932392990 SSKCRCLJNNIOMF-CVEARBPZSA-N 338.476 5.132 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)[C@@H](C)c1ccc(CC(C)C)cc1 1776012437 SEXGQHCFPFZJDM-OAHLLOKOSA-N 338.451 5.175 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(F)c(C(=O)O)c1 1776064317 HXPPOLKPZKLVAI-GUYCJALGSA-N 348.462 5.554 30 20 EKED C=CCc1ccccc1/C=C/c1nc(C(=O)O)c(-c2ccccc2)s1 1776189046 DEMBWNVYSZBCPU-BUHFOSPRSA-N 347.439 5.407 30 20 EKED N#C[C@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 46441493 QUCLQCBTUORLIW-SNVBAGLBSA-N 347.226 5.093 30 20 EKED COc1ccc(Cl)cc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 90665057 KNAGMYFFAVFPIX-KSSFIOAISA-N 328.843 5.044 30 20 EKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)cc2)cc1 96721474 STOMUZBJXVJRBF-HXUWFJFHSA-N 347.462 5.225 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1 110968508 NMTUTOMKAJHALP-SAAWKEMMSA-N 332.428 5.271 30 20 EKED N#CCC[C@H](Nc1nc(C(F)F)nc2ccccc12)c1ccccc1 164346515 LMDVMBSAVHKWSF-HNNXBMFYSA-N 338.361 5.024 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccc(CCC(F)(F)F)cc2)cc1 175803260 IDADAEIWGMSRRJ-CQSZACIVSA-N 348.368 5.084 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1ccccc1F 188063677 ZWYJVRWRJZZJTE-UHFFFAOYSA-N 341.426 5.085 30 20 EKED Cc1nnc(S[C@H](C)c2cccc(C#N)c2)n1[C@H]1CCC[C@@H](C)C1 248923978 LGKPRLKLRGNWRN-LBTNJELSSA-N 340.496 5.063 30 20 EKED Cc1cccnc1[C@@H]1CCC[C@H](N[C@@H](CCCC#N)c2ccccc2)C1 340438998 BFBGEINYRUACAC-FSSWDIPSSA-N 347.506 5.441 30 20 EKED CC[C@H](N[C@H](c1cccc(C)c1)c1ccccn1)c1ccc(C#N)cc1 364662050 OWKKGRGTBOSTNI-JTHBVZDNSA-N 341.458 5.092 30 20 EKED COc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)c(Cl)c1 424302399 MCSRTAALNBOIEO-AUUYWEPGSA-N 328.843 5.044 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCCC1(C)C 467492042 KQISTZJVILDTIS-PBHICJAKSA-N 345.512 5.171 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)c2ccccc12 489889968 XMVPRXZGWMSSSO-KGLIPLIRSA-N 336.385 5.401 30 20 EKED C[C@H](Sc1ccc(C#N)cc1)c1nc(-c2ccc(Cl)cc2)no1 505078968 XFKFUANXCHGRJN-NSHDSACASA-N 341.823 5.115 30 20 EKED N#Cc1cccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1 515095785 PBODVRTYGPEAIH-GOSISDBHSA-N 331.246 5.106 30 20 EKED CC(C)C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 525336393 OHNIUFBREGLHNK-HXUWFJFHSA-N 334.463 5.256 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccc(Cl)cc1)C1CC1 540469288 ODDMZQVRBHJZNX-FQEVSTJZSA-N 338.882 5.382 30 20 EKED C=CCOc1cccc(NC(=O)N(c2ccccc2)c2ccccc2)c1 542986722 YRJPPOSMMPDVCD-UHFFFAOYSA-N 344.414 5.622 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(Cl)cc1Cl 566684867 CFHHUOQOMCFTRL-LBPRGKRZSA-N 331.246 5.205 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 588895863 DOYYJTYOKAJZEV-UHFFFAOYSA-N 342.826 5.545 30 20 EKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1nc(-c2cccs2)no1 609825203 LEAMLZAJPMYWBB-NEPJUHHUSA-N 341.461 5.225 30 20 EKED CCc1oc2ccccc2c1C=NNc1ccc(OC(F)F)cc1 726426823 ITNXPVMIGHLKDO-UHFFFAOYSA-N 330.334 5.043 30 20 EKED Cc1cccc(-c2n[nH]cc2/C=C\C(=O)c2cc3ccccc3o2)c1 728785565 LBAKARIYOGSHQB-KTKRTIGZSA-N 328.371 5.027 30 20 EKED COc1ccccc1/C=C/C=C\C(=O)c1ccc(SC)c(F)c1 741848124 WGQKERVAQFWOLQ-FSIVZHEYSA-N 328.408 5.009 30 20 EKED COc1ccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1F 747003737 NFCRJPSSKAWCLP-KXFIGUGUSA-N 325.166 5.037 30 20 EKED CC1(C)CCC(CC(=O)[C@H](C#N)c2nc3ccccc3s2)CC1 752474698 YCQGXOJZVJGJDI-AWEZNQCLSA-N 326.465 5.079 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(Cl)c(C(F)(F)F)c1 754690369 SJTKUSFFYDEUQI-XQRVVYSFSA-N 346.135 5.303 30 20 EKED C[C@@H](N[C@H](C)c1ccc(N2CCCCCC2)cc1)c1ccc(C#N)cc1 765332481 PSCQTJSMGMYAOK-RTBURBONSA-N 347.506 5.350 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(C(C)C)cc2)c1 772985270 VQTOHUGBBYPFGI-UWJYYQICSA-N 336.479 5.342 30 20 EKED CC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCCC1 780346925 VRJIOEDSFWONNE-HXUWFJFHSA-N 332.447 5.251 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1csc(C(F)(F)F)c1 925601012 JGDRKXQVKUPEIM-DOMZBBRYSA-N 338.398 5.463 30 20 EKED N#CCCC[C@H](NCc1cccc(-c2ccncc2)c1)c1ccccc1 353917994 WOJSEDUPCJWQFH-QHCPKHFHSA-N 341.458 5.273 30 20 EKED C[C@@H]1C[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccsc2S1 358346901 DELGUWZUKWGUOZ-KBRIMQKVSA-N 328.506 5.308 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(Cl)cc(F)cc1Cl 410349512 QAXOFDIWHIQWIL-UHFFFAOYSA-N 338.209 5.503 30 20 EKED C=CCC[C@H](NC(=O)c1ccccc1C(F)(F)F)c1ccccc1 435301070 VVWRGOMCLSEEGT-KRWDZBQOSA-N 333.353 5.143 30 20 EKED CC[C@@H](C(=O)Nc1cc(C#N)ccc1C)c1cccc(C(F)(F)F)c1 437546416 JXAGXBLBGYHEGD-MRXNPFEDSA-N 346.352 5.018 30 20 EKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 439586760 AENHDQIKAFWQPL-INIZCTEOSA-N 339.398 5.395 30 20 EKED CC[C@H](N[C@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 447593540 SQDYCNGTFDGZAQ-RISCZKNCSA-N 349.297 5.184 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCOc1ccccc1Cl 487374109 ILTLYXBKYROLLO-AWEZNQCLSA-N 346.883 5.225 30 20 EKED C[C@H](CC1CCCCC1)C(=O)Nc1ccccc1SCCC#N 510864331 SEKOCLMQOSWGDD-OAHLLOKOSA-N 330.497 5.237 30 20 EKED C=C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)c1ccccc1 513038152 QACVGMIKSCXFGT-TWHAJKEOSA-N 345.486 5.284 30 20 EKED C=CCn1c(SCc2ccc3ccccc3c2)nnc1-c1ccco1 523499469 QJTRWYOWJQFLLE-UHFFFAOYSA-N 347.443 5.170 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 538526481 JYNUHBPTKMEGKF-OAHLLOKOSA-N 334.872 5.647 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cs1 586752819 JWHHCYGHFVFVRW-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CCC[C@H](NC(=O)CCCCCC#N)c1cccc(C(F)(F)F)c1 588341090 XYESHUMFVKFBLM-INIZCTEOSA-N 340.389 5.137 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C#N)cc2)cc1 610271458 JOBNUTSEYMPLIF-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)c(F)c1 611465504 WDGOGRIHKGACQD-NEPJUHHUSA-N 336.332 5.128 30 20 EKED CC(C)Oc1cccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)c1 614180124 YIQXRLRPCZEXLD-QGZVFWFLSA-N 336.479 5.126 30 20 EKED COc1ccccc1-c1ccc(/C=C2/Cc3ccccc3C2=O)cc1 741468734 KHYCRLNEOYBTLP-RGEXLXHISA-N 326.395 5.185 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741845038 XTIZQWPNTWFHAK-BJMVGYQFSA-N 347.361 5.109 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccc(OC(F)F)cc1)c1ccncc1 766018379 HCYFRSYJSMTMKI-ROUUACIJSA-N 332.394 5.041 30 20 EKED Cc1ccc(NC(=S)N[C@H](CCCC#N)c2ccccc2)cc1C 814209474 AYOLJQAZHMAZCF-LJQANCHMSA-N 337.492 5.025 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)CCC(F)(F)CC1 850873653 NRYMIBIGEOIFCL-GFCCVEGCSA-N 340.439 5.048 30 20 EKED CCCC[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)C(C)C 857010642 STMMMGWTVRPBET-KBPBESRZSA-N 347.409 5.070 30 20 EKED COCCSc1ccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)cc1 78618397 GPWFQDMRPGHCNK-CYBMUJFWSA-N 346.883 5.123 30 20 EKED CCCCCCCCC(=O)Nc1cc(Cl)c(OC)cc1OC 104983750 LTLLTNBSSOHQTP-UHFFFAOYSA-N 327.852 5.046 30 20 EKED Cc1csc(-c2ccc(NCc3ccc(O[C@@H](C)C#N)cc3)cc2)n1 125045280 HLXAIRUNVVDMQD-HNNXBMFYSA-N 349.459 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(Cl)cc1F 189879311 VMMKXWOIBHMBKP-UHFFFAOYSA-N 349.808 5.722 30 20 EKED COc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc1N=C(C)O 329001567 LGWZWBAAAKJRAE-HYVNUMGLSA-N 344.455 5.498 30 20 EKED Cc1nc2cc(Cl)c(N=C(O)CCC3CCOCC3)cc2s1 330100667 DPXAISBXXRGTTQ-UHFFFAOYSA-N 338.860 5.053 30 20 EKED CCSc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430642505 OSZACZJGSVNHKN-AWEZNQCLSA-N 344.505 5.043 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cc(CC)ccc1CC 438857060 AQDPSUNOJHISSL-UHFFFAOYSA-N 328.481 5.093 30 20 EKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1nc(-c2ccccc2)no1 443144520 QAPROSWKONJUIF-KGLIPLIRSA-N 335.432 5.164 30 20 EKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1cccc(Cl)c1 460165203 FAXZIHJECAPRND-ZDUSSCGKSA-N 344.867 5.088 30 20 EKED CSc1ccc(Cl)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 475177706 ZPMVJINKARQFPJ-UHFFFAOYSA-N 344.867 5.115 30 20 EKED CC(C)(C#N)c1ccc(C(=O)N(c2ccccc2)C2CCCC2)cc1 483488395 XZHRSXKUJUNJHV-UHFFFAOYSA-N 332.447 5.077 30 20 EKED CCOc1cccc2cc([C@H](C)Nc3c(F)cc(C#N)cc3F)oc12 500505341 SHBAMFZSKWSWHH-NSHDSACASA-N 342.345 5.154 30 20 EKED C=CCC[C@H](NCc1cccnc1C)c1ccc(C(F)(F)F)cc1 532727063 RCBJCCJPQSMBKJ-SFHVURJKSA-N 334.385 5.206 30 20 EKED N#Cc1csc(CNCc2ccc(Sc3ccccc3)cc2)c1 533007710 JSJIQMMSYBJPRO-UHFFFAOYSA-N 336.485 5.061 30 20 EKED CC(C)CC1(C)CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 558193950 ZHSSEHUXEUPRFK-UHFFFAOYSA-N 341.499 5.168 30 20 EKED CC(C)Oc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1Cl 585764830 OVXPYEJCEDYOTK-LSDHHAIUSA-N 342.870 5.411 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1S[C@H](C#N)C1CCCCC1 609650915 RJGJDRSHLCHZQW-LJQANCHMSA-N 333.460 5.185 30 20 EKED N#C[C@H](C(=O)c1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 613403124 MKPPAYCYGNJRIL-GFCCVEGCSA-N 347.226 5.093 30 20 EKED CC[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(Cl)c1F 618801322 ACILSMJOUCLLGB-ROUUACIJSA-N 328.818 5.079 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619755770 RYBJCNAONNNLDL-LBPRGKRZSA-N 349.261 5.115 30 20 EKED Cc1ccc2sc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)cc2c1 685782631 ZIJWJQKQGSQEKG-MRXNPFEDSA-N 342.423 5.248 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(N2CCCCCC2)cc1 726365941 SIYSVGBBZCQRQZ-FMIVXFBMSA-N 340.854 5.012 30 20 EKED CC(=NNc1cccc(F)c1)c1csc(-c2csc(C)n2)c1 729142314 PUIDPWUQIKEANZ-UHFFFAOYSA-N 331.441 5.155 30 20 EKED C[C@@H](CC#N)OC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 733710586 CUJAZCZWZNHMFR-GUYCJALGSA-N 345.851 5.019 30 20 EKED COc1ccc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1F 734982096 WTBMPUCSTYMCQP-FNORWQNLSA-N 325.166 5.037 30 20 EKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 737502287 GDDBNTHJUSWXMR-KXBFYZLASA-N 346.455 5.146 30 20 EKED CC(C)Oc1ccccc1C=NOCc1ccc(C(F)(F)F)cc1 749355922 RONUCUOXVFTWKX-UHFFFAOYSA-N 337.341 5.043 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc2cc(O)ccc2c1 749893657 JGPHLLPYKKZAAA-LUAWRHEFSA-N 341.366 5.097 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(COC)c1)c1ccccc1 773074392 FYKFVXKBALFSIA-DYESRHJHSA-N 339.479 5.200 30 20 EKED Clc1ccc(C(Cc2ccccn2)=NOC2CCCCC2)cc1 777460249 WAZCXJCOJPXPRS-UHFFFAOYSA-N 328.843 5.031 30 20 EKED CC1(C)CCCC[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 789404832 FVUGFJGRVOSXBI-HZPDHXFCSA-N 338.476 5.203 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 792109039 FKUXIHUQRZULTO-HRAATJIYSA-N 337.467 5.193 30 20 EKED CCc1sc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 66800867 DSCAHXMILDMMGV-CYBMUJFWSA-N 344.505 5.266 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccccc2CCC(F)(F)F)cc1 153744623 UUXKIIXTHLDRKJ-AWEZNQCLSA-N 348.368 5.084 30 20 EKED N#CCCCCSCc1csc(Cc2ccc(Cl)cc2)n1 161534594 VTJGAEBQNRWYHU-UHFFFAOYSA-N 336.913 5.314 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 192938882 YPPOXQFKBMRHTG-OLZOCXBDSA-N 349.261 5.308 30 20 EKED N#CC1(CCCN2CCC[C@@H]2c2cccc3ccccc23)CCOCC1 281138776 ALOSPPHKGJTXBY-JOCHJYFZSA-N 348.490 5.077 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCC(C)(C)C#N 289490822 YFJGTMXVWJQQFY-HNNXBMFYSA-N 332.513 5.119 30 20 EKED C=CC[C@H]1N(C(=O)Nc2cc(SC)ccc2C)CCCC1(C)C 444944139 QPRKACYSDZYAPR-QGZVFWFLSA-N 332.513 5.316 30 20 EKED CC1(C#N)CCC(N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 449204395 JBECXDAOBYSBRG-LXPRWKDFSA-N 336.401 5.219 30 20 EKED CC(C)CC[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458806829 WOQNDFPDOAWVPL-VQTJNVASSA-N 341.499 5.032 30 20 EKED CCN(C(=O)c1sc2ccc(C)cc2c1C)c1ccc(C#N)cc1 485927760 RLYDGQLUETYJNB-UHFFFAOYSA-N 334.444 5.057 30 20 EKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)cc1 500781073 XFQMMRFDDFYHIJ-GOSISDBHSA-N 341.842 5.073 30 20 EKED C[C@H](CCC(F)(F)F)Nc1ccc(F)cc1OCCC(F)(F)F 504582526 NYOQGLDMPGCFQZ-SECBINFHSA-N 347.274 5.300 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(CC#N)cc1 541660602 OEAAYBYIMWYDEI-HNNXBMFYSA-N 347.487 5.035 30 20 EKED N#CCC1CCN(Cc2cccc(SCc3ccccc3)c2)CC1 553876757 ZYGBTJSYLXECQY-UHFFFAOYSA-N 336.504 5.105 30 20 EKED N#CC1(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CCC1 577244783 ANPFTGSYISUZMH-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C[C@@H](Nc1cccc(OCc2cccc(F)c2)c1)c1cccc(C#N)c1 600851427 YQLZKYVDOMGGNV-MRXNPFEDSA-N 346.405 5.449 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(C)c1 612303429 LYRQZRQWUUVRGT-DNVCBOLYSA-N 345.512 5.043 30 20 EKED C(=Nn1cnnc1-c1ccccc1)c1c2ccccc2cc2ccccc12 725856580 LGXJMVZMVNBPSG-UHFFFAOYSA-N 348.409 5.134 30 20 EKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccccc2)c1 728226656 HNXXKNLHDVBCTG-UHFFFAOYSA-N 342.467 5.072 30 20 EKED CC1(C)/C(=C/c2csc(-c3cccs3)n2)C(=O)c2ccccc21 728439942 HROSWTSKOCHGQW-XNTDXEJSSA-N 337.469 5.429 30 20 EKED O=C1/C(=C/c2nccc3ccccc23)Cc2c1ccc(Cl)c2Cl 740765805 UKHWVKPAMQEGJN-ZRDIBKRKSA-N 340.209 5.364 30 20 EKED COc1ccccc1[C@H](C)SCc1cc(Cl)ccc1OCC#N 742455701 SUPIRZPNUXADAY-ZDUSSCGKSA-N 347.867 5.245 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1Cl 745990591 VNGPNRUTQXEXAL-KRXBUXKQSA-N 349.817 5.307 30 20 EKED CC(=NNc1cc(F)c(F)c(F)c1)c1sc(C(C)(C)C)nc1C 747642675 SPTQQGDWMUIKKI-UHFFFAOYSA-N 341.402 5.002 30 20 EKED CCCCCC(C)(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 753221215 MYCWOTDPSOWDIT-HNNXBMFYSA-N 332.513 5.483 30 20 EKED CC(C)Oc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)c(Cl)c1 783316713 PGWMCRLPPIBIBB-CQSZACIVSA-N 344.842 5.203 30 20 EKED C=CC[C@H](C(=O)O[C@@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798671102 XMGICFGSDBPOOJ-BBRMVZONSA-N 349.352 5.065 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H]2CC(C)(C)CCc3ccccc32)cc1 799345217 VTAMXOUVRGMYTN-JTSKRJEESA-N 348.490 5.171 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1O 815597746 FEFVAGARSPHOHT-SUMWQHHRSA-N 348.368 5.107 30 20 EKED COc1cc(C)c([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1C 815635640 GXQROCLMYCBYHN-GHTZIAJQSA-N 336.479 5.398 30 20 EKED O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1cccs1 912773504 WEUMMPBUGAZQET-SOFGYWHQSA-N 341.413 5.281 30 20 EKED Cc1ccccc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 113570609 BZEOFKZBTFOQRX-AWEZNQCLSA-N 325.437 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)c1ccccc1 189893400 BLQPORIHTNGZLU-UHFFFAOYSA-N 329.390 5.269 30 20 EKED CCC(CC)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 392245967 PYAYYVBIHSRXNZ-HTAPYJJXSA-N 336.479 5.417 30 20 EKED COc1cc(CNc2ccc(C(C)(C)C(F)(F)F)cc2)ccc1C#N 440617896 LSDMRZXAWWXDBE-UHFFFAOYSA-N 348.368 5.019 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@H](C)c1ccc(C#N)cc1 508992511 AIKKZQPWXULBDL-QGZVFWFLSA-N 327.431 5.026 30 20 EKED C[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)c(F)c1 537406850 JKZISSMKPYGEFP-PIGZYNQJSA-N 346.858 5.238 30 20 EKED CCN(C(=O)CC/C=C\c1ccccc1)c1ccc(C#N)c(Cl)c1 538072901 XVEFUPOIHDVHFV-POHAHGRESA-N 338.838 5.058 30 20 EKED N#CCCCCN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538321560 OMSWKPXZJZKEQL-HNNXBMFYSA-N 330.781 5.093 30 20 EKED C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 540705222 FLHGGMOLWMLYCQ-HXOBKFHXSA-N 344.433 5.332 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 550827115 KIRLAAKPDHBVGA-HNAYVOBHSA-N 344.405 5.374 30 20 EKED N#Cc1ccc(Oc2nccc(Oc3ccccc3)n2)c2ccccc12 555269678 RTEXHKZEXNFNDZ-UHFFFAOYSA-N 339.354 5.086 30 20 EKED CC[C@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccc(C#N)cc1 562494919 FBAQPHMNBPCFSB-YWZLYKJASA-N 348.446 5.423 30 20 EKED Cc1cc([C@H](N[C@@H]2CCCc3cc(C#N)ccc32)C2CC2)ccc1F 584177090 JLYRPEYTVLUUPP-FGZHOGPDSA-N 334.438 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)C[C@H](C)O2 613900499 GHBNIYTZNMBWGI-HNNXBMFYSA-N 335.447 5.114 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccsc1 670017924 YBVKWRFYHGCFAR-AWEZNQCLSA-N 328.481 5.483 30 20 EKED C[C@@H]1C[C@H](CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)CC(C)(C)C1 727629219 PJDXFBJQMLEPNA-NUJGCVRESA-N 334.463 5.264 30 20 EKED C=C[C@H](CC(=O)O[C@H](c1ccccc1)c1cccnc1)c1ccccc1 759315107 NHQVXKZPZWXIBW-WZONZLPQSA-N 343.426 5.074 30 20 EKED CCCCCCCC[S@](=O)Cc1csc(-c2ccsc2)n1 790140631 VLVDIKZBEBEXFI-NRFANRHFSA-N 341.567 5.481 30 20 EKED C[C@@H](Nc1cc(C#N)ccc1C(F)(F)F)c1c(F)cccc1F 864002223 TWOMGPODZLBICI-SECBINFHSA-N 326.268 5.028 30 20 EKED C[C@H](N[C@H]1CCc2cccc3cccc1c23)c1ccc(OCC#N)cc1 866294641 KVZXGUSVHOWHID-AOMKIAJQSA-N 342.442 5.080 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2c(OC(F)F)ccc3ccccc23)cc1 916134118 BZIOLULCUONXLT-ZHACJKMWSA-N 349.336 5.209 30 20 EKED CCn1nc(C)c(C(=O)/C=C\c2ccc(-c3ccccc3)cc2)c1C 920927774 NJNRSBCMEZRSMR-QINSGFPZSA-N 330.431 5.083 30 20 EKED CC1(C)C/C(=C\c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776526669 PUEHIBNMXQOATN-JXMROGBWSA-N 346.835 5.047 30 20 EKED C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 122156972 HDDUKHIZNZHOFK-YVEFUNNKSA-N 328.868 5.099 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1cccc(C#N)c1 181887088 CTQHMWDWOZPPGB-OPAMFIHVSA-N 330.406 5.138 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(C(C)(C)C)c1C 188058853 CLIBOYAKIKEJCH-UHFFFAOYSA-N 339.483 5.051 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(C)c2ccccc12 188067728 XTKSENUATSJSAD-UHFFFAOYSA-N 332.447 5.283 30 20 EKED N#CCCCOc1cccc(CN[C@H](c2ccccc2)C2CCCC2)c1 237825191 VUSZPYGKFOBJIW-HSZRJFAPSA-N 348.490 5.390 30 20 EKED C[C@H](c1ccc(CNC2(c3cccc(C#N)c3)CC2)cc1)C(F)(F)F 295075740 WYZRRDHGOUYWED-CQSZACIVSA-N 344.380 5.003 30 20 EKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(C(C)C)c1 330323966 TXOXPWOXMQXWNA-OAHLLOKOSA-N 344.480 5.105 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C2CCC2)c1 463851229 QPBINUYSVQMZPI-UHFFFAOYSA-N 326.465 5.236 30 20 EKED C=C[C@](C)(CC)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 467848357 CGFQCPGSBIIYNY-WMZHIEFXSA-N 346.474 5.018 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 474078312 BAKDJCXGLGPIQF-CYBMUJFWSA-N 333.218 5.019 30 20 EKED CC(C)c1cccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)n1 474648077 FPXIGJHQJOJIEI-UHFFFAOYSA-N 347.443 5.057 30 20 EKED Cc1cc(Cl)cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 477114210 OKSOKFNUVCOZAS-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED N#Cc1cccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 538059677 FLTBPKVWSBHVTO-GOSISDBHSA-N 331.246 5.106 30 20 EKED C[C@H](NC[C@@H](C#N)CCC#N)c1ccccc1-c1ccc(Cl)cc1 538187146 VBLVVXYQVLPPJB-JKSUJKDBSA-N 337.854 5.101 30 20 EKED CCC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 538508715 ZXINPMVJGXWNDE-CWTRNNRKSA-N 332.369 5.168 30 20 EKED C[C@@H](NCc1ccc(OC2CCCCC2)cc1)c1cccc(C#N)c1 540594829 PTYZTLUBMJLKNP-QGZVFWFLSA-N 334.463 5.121 30 20 EKED C=CCCc1ccccc1NC(=O)c1oc2ccc(OC)cc2c1C 548771983 BXHQYLVUOBHWHJ-UHFFFAOYSA-N 335.403 5.121 30 20 EKED C=CCC[C@H](NCc1cc(F)c(C(F)(F)F)cc1F)c1ccco1 562060392 XTZANGXDUQYKDS-HNNXBMFYSA-N 345.311 5.374 30 20 EKED N#Cc1ccc(CN[C@@H](CC2CC2)c2ccccc2)c(C(F)(F)F)c1 589506611 JKHCINAEJYLBBC-IBGZPJMESA-N 344.380 5.208 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1 589540407 KYQPTXNNBSMOHQ-QGZVFWFLSA-N 339.266 5.035 30 20 EKED Cc1ccc(-c2cncc(F)c2)cc1N[C@H](C)c1cccc(C#N)c1 600853557 KUCOEAOPGXDGJO-OAHLLOKOSA-N 331.394 5.241 30 20 EKED CC(C)CCC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609930283 YJYBYXDRIDCXSR-CVEARBPZSA-N 347.528 5.417 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccsc1 727267748 PCRQXYHYWLEBIZ-UQCOIBPSSA-N 329.421 5.215 30 20 EKED COc1ccccc1/C=C/C=C1/C(=O)c2ccsc2S[C@H]1C 742436388 JPPIPZDXIWUQLH-LSBBLZSKSA-N 328.458 5.073 30 20 EKED C#CCCCCCC(=O)N(Cc1cccs1)c1ccc(F)cc1F 779857648 WTTRKBCPGNGUOZ-UHFFFAOYSA-N 347.430 5.143 30 20 EKED CC[C@H](C)[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 780311445 CCRPBJKXRFZURB-SLEUVZQESA-N 346.883 5.322 30 20 EKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1cnn(C(C)C)c1C 787152720 KSBNJEVGVBEQSP-UHFFFAOYSA-N 349.482 5.082 30 20 EKED Cc1cccnc1[C@H]1CCCC(=NNc2cccc3ncccc23)C1 799109084 UXTKNYRQODSUNP-INIZCTEOSA-N 330.435 5.064 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(SCC)c1 1776784016 SJQNSANGQRVDPH-QGZVFWFLSA-N 337.529 5.092 30 20 EKED CCCCCCCOc1ccc(/C=C\c2ncc(C(=O)O)s2)cc1 1776788258 VBKGVAHFTQVYEC-XFXZXTDPSA-N 345.464 5.361 30 20 EKED N#CCCCOc1cccc(CNc2ccc(CC(F)(F)F)cc2)c1 174449046 UMIPOHORCSOFDN-UHFFFAOYSA-N 348.368 5.086 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(Cl)c1 192970302 ZPELXWNRSVJFGI-IFXJQAMLSA-N 328.843 5.044 30 20 EKED C[C@H](Nc1ccc(OC2CCCC2)cc1)c1ccc(OCC#N)cc1 192993410 YRJKDFMYRPQROZ-INIZCTEOSA-N 336.435 5.083 30 20 EKED CC[C@H](NCc1cccc(OCCCC#N)c1)c1cccc(Cl)c1 236948232 INKFYEFIMCZGBR-FQEVSTJZSA-N 342.870 5.263 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cccc(C#N)c1 237786418 AKWDDNFTBWQOEH-HXUWFJFHSA-N 332.472 5.002 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 320977912 KYNOMZMZLIUKDH-IBGZPJMESA-N 328.843 5.586 30 20 EKED OC1=NCc2ccc(N=C(O)C3CCC(c4ccccc4)CC3)cc21 330240561 VXNNOZDAXKKFEM-UHFFFAOYSA-N 334.419 5.067 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340443156 FLNJWOBEIHTEHJ-PMACEKPBSA-N 326.871 5.816 30 20 EKED C=CCCCSCc1nnc(-c2ccc(Cl)cc2Cl)o1 437266971 HOGCDCJSDOBFFE-UHFFFAOYSA-N 329.252 5.243 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)c1cc2c(ccc3ccccc32)o1 442864058 BNFBYXKHBCTNOZ-GTPINHCMSA-N 332.447 5.567 30 20 EKED CC[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 447543180 REPZGOKHDLACTA-QZTJIDSGSA-N 342.895 5.489 30 20 EKED CC[C@H](C)[C@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458799927 KMOOSVLEQQERIS-DFQSSKMNSA-N 341.499 5.032 30 20 EKED CC(C)c1occc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 483493587 SBSLQTRITOCQTM-GFCCVEGCSA-N 344.823 5.156 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc(OCCC)cc1 485472082 VGSLCPDDUDLNFJ-UHFFFAOYSA-N 327.449 5.006 30 20 EKED N#CC1(CSc2nc(-c3ccccc3)c(-c3ccccc3)o2)CC1 500760784 ZDYPSLWECLTPBL-UHFFFAOYSA-N 332.428 5.404 30 20 EKED C=C[C@@H](CC(=O)N1CCC(c2ccccc2C)CC1)c1ccccc1 542564542 QCSVLIQOTZVGIG-IBGZPJMESA-N 333.475 5.061 30 20 EKED C=C[C@@H](Cc1nc(-c2ccccc2COC(C)C)no1)c1ccccc1 547055862 YAQJTNCMGYYKAF-KRWDZBQOSA-N 348.446 5.174 30 20 EKED C=CCC[C@H](Nc1cccc(OCc2cccnc2)c1)c1ccco1 560544086 OBYHTFYLGUTZAL-FQEVSTJZSA-N 334.419 5.373 30 20 EKED COc1cccc2c1CCC[C@H]2N[C@H](CCCC#N)c1ccccc1 581205748 OULAMKCBJNZUSC-NHCUHLMSSA-N 334.463 5.097 30 20 EKED CC(C)(C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603673298 ZZNMVGIEFGABCA-KRWDZBQOSA-N 340.854 5.370 30 20 EKED CC(C)c1ccc(NC(=O)CS[C@@H](C)c2ccc(C#N)cc2)cc1 609825757 RUWUNUDAMSNVEY-HNNXBMFYSA-N 338.476 5.115 30 20 EKED CC(C)CCC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609930287 YJYBYXDRIDCXSR-JKSUJKDBSA-N 347.528 5.417 30 20 EKED C#Cc1cccc(NC(=O)N2CCCCC[C@H]2c2cccc(C)c2)c1 735566046 UUYTXIKKMPLYBK-NRFANRHFSA-N 332.447 5.126 30 20 EKED COc1ccc2oc(C(=O)/C=C\c3nccc4ccccc34)c(C)c2c1 740765854 XURPKEFCXBKKTK-HJWRWDBZSA-N 343.382 5.194 30 20 EKED CCOc1ccccc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990163 MBXSJPBZYWFOEL-VAWYXSNFSA-N 329.399 5.043 30 20 EKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1Cl 747199237 RXJXJLIZCGOWJO-AWEZNQCLSA-N 346.883 5.037 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1cnc(-c2ccccc2)s1 754712289 JVFRXJFKESEYFO-UHFFFAOYSA-N 348.349 5.242 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 768388063 DTUMNRWLXUHTOU-ROUUACIJSA-N 337.463 5.084 30 20 EKED CC/C(C)=C(\C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 779857629 WMBUBFOSRRCIHS-WUKNDPDISA-N 348.446 5.017 30 20 EKED CC(C)c1ccc(/C=C\CC(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780166408 XAGHSXJVWMDRMK-JTGQJZMRSA-N 348.446 5.143 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)C1 780311334 AOPLIFCSCZHACZ-YQFWSFKMSA-N 338.476 5.059 30 20 EKED C#CC[C@H](N[C@H](C)c1cc(C)c(Br)s1)c1ccccc1 796340053 ILPKYGINGWAOBO-HIFRSBDPSA-N 348.309 5.234 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCCCC1 56800226 PHQVDYBRLMGMHU-UHFFFAOYSA-N 349.434 5.067 30 20 EKED N#CCCSc1ccccc1NC(=O)/C=C/c1ccc(Cl)s1 170971193 LCTXLEDDDWORJR-VQHVLOKHSA-N 348.880 5.059 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1CC(F)(F)F 174014051 HYQMYBBIUHQPKM-UHFFFAOYSA-N 328.378 5.002 30 20 EKED N#Cc1csc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 177686505 JEESLZIRKAEDEG-KRWDZBQOSA-N 344.892 5.214 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(C)cc1 189908775 PTHCMDASXNCUKD-KRWDZBQOSA-N 337.463 5.253 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1cccc(F)c1C#N 427834825 KSJYWKZVWKUKAE-UHFFFAOYSA-N 344.436 5.156 30 20 EKED CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480807785 XIJXGENTZLCXRO-QRWLVFNGSA-N 349.434 5.003 30 20 EKED C=CCCCC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1cccnc1 480826898 IJQXRKPQPCXNOY-FQEVSTJZSA-N 342.870 5.029 30 20 EKED C[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1F 512668523 VPCFNPZYGIOORK-NEPJUHHUSA-N 336.332 5.128 30 20 EKED C=CCCC(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 588030638 JXIMAXYWZNVQIJ-UHFFFAOYSA-N 334.246 5.165 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(C#N)c1 615982873 BAWWCOPYODIODX-MRXNPFEDSA-N 349.478 5.517 30 20 EKED CC(=NOCc1cc(-c2ccccc2)on1)c1cc2ccccc2o1 727437860 SSAICQIDDOYGHO-UHFFFAOYSA-N 332.359 5.029 30 20 EKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)(C)C 734706670 QXQSQFNBARFOON-BXUZGUMPSA-N 346.883 5.322 30 20 EKED Cc1cc(C)cc(-c2ccc(CNCc3ccc(C#N)cc3)cc2)c1 742367581 ZDIPZRFWRPWOLI-UHFFFAOYSA-N 326.443 5.132 30 20 EKED CCc1nc(C)c(C(C)=NNc2cc(C(F)(F)F)ccc2F)s1 753946086 FFAHBGQYXKKUFG-UHFFFAOYSA-N 345.365 5.008 30 20 EKED C#CC[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 758209720 KKXKZRCAKYJUAD-CQSZACIVSA-N 348.780 5.164 30 20 EKED C[C@H](N[C@H](C)c1ccc(N2CCCCCC2)cc1)c1cccc(C#N)c1 766348814 BPTVLGNONKJKSV-MOPGFXCFSA-N 347.506 5.350 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cncs1 767728993 MMWPKLJMMJVZLA-SREVYHEPSA-N 346.864 5.125 30 20 EKED CC(C)(C#N)CCCCOC(=O)c1cc(F)c(Cl)cc1Cl 768522487 DPJWUCPGTCGPOA-UHFFFAOYSA-N 332.202 5.009 30 20 EKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1ccc(O)c(Cl)c1 768756264 LOAIRQGXWVXRIS-CLFYSBASSA-N 341.819 5.065 30 20 EKED C#CCCCCC(=O)Oc1ccccc1-c1nc2ccccc2s1 773761634 HPIASUMDRWPCNI-UHFFFAOYSA-N 335.428 5.062 30 20 EKED COc1cc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc(OC)c1C(C)C 779184090 LEJSUBYVTJBKKH-ZDUSSCGKSA-N 342.414 5.011 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(Cl)cc1Cl 779712563 JESDPCFHBWQJCT-NWDGAFQWSA-N 335.234 5.457 30 20 EKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792103604 LJLIZOQKWKNMPZ-NHCUHLMSSA-N 342.442 5.241 30 20 EKED CC(C)Sc1cccc(Cl)c1CNCc1cc(C#N)ccc1F 793001276 MNDMIKBFSCUVDI-UHFFFAOYSA-N 348.874 5.141 30 20 EKED C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1nc2ccccc2s1 795796871 UZURJDPTJWUPCB-KSSFIOAISA-N 347.487 5.286 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 844255855 NAJRLBSIFCYMNI-BQYQJAHWSA-N 327.380 5.055 30 20 EKED Cc1cc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c(C)s1 920065212 RMBXAIXYGKAEDH-ARJAWSKDSA-N 331.487 5.446 30 20 EKED CC(C)[C@H]1/C(=C\c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776308585 FMWAAFKMRQWTDK-MYWXAZLQSA-N 346.835 5.119 30 20 EKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2)c1 1777686182 UQWSBYRYYOMSFS-FLIBITNWSA-N 334.396 5.009 30 20 EKED Cc1ccc(-c2ccsc2C(=O)Nc2cc(C#N)ccc2C)cc1 63961349 BSOPTXDPJALJGE-UHFFFAOYSA-N 332.428 5.156 30 20 EKED COc1ccc2oc([C@H](C)N[C@H](C)c3cccc(C#N)c3)c(C)c2c1 153714608 VWHYEVRIRWLLLZ-CABCVRRESA-N 334.419 5.033 30 20 EKED CC(C)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@H](C)c1ccccc1 410894867 WGBXMCTZWFWOJA-NQIIRXRSSA-N 334.463 5.072 30 20 EKED CC1(C)C[C@@H](c2ccccc2)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1 425124263 UJCFTBIURQTZCW-RTWAWAEBSA-N 346.474 5.074 30 20 EKED C=CC[C@H](C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccccc1 427529444 WIFXGZFFDRFGNZ-YJBOKZPZSA-N 337.467 5.030 30 20 EKED CC[C@@H]1CCCC[C@H]1N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458802302 PMXJHKUGSSHPKN-MISYRCLQSA-N 341.499 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COC1CCC(C)CC1 477000920 KQNNYCDICRZCCJ-UHFFFAOYSA-N 329.484 5.072 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(-c2cnc(C)o2)cc1)c1ccccc1 487545655 ZKWHCLUDWJEDHM-FQEVSTJZSA-N 346.430 5.339 30 20 EKED C[C@H](N[C@@H]1CCc2c(Cl)cc(Cl)cc21)c1ccc(C#N)cc1 507841897 PXNUEFNJUXICBS-BBATYDOGSA-N 331.246 5.203 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccccc1Oc1ccccc1 508080649 VUGBKEGICPGWAC-QGZVFWFLSA-N 328.415 5.201 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 536123059 LOHLEPXPNIGCJL-HNNXBMFYSA-N 334.444 5.109 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)NCc1ccccc1C(C)(C)C#N 540324097 OGEQMXNMEMGAHB-QGZVFWFLSA-N 336.479 5.126 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C(C1CCC1)C1CCC1 588925254 HJYCRCDKVDUQJP-AWEZNQCLSA-N 342.508 5.236 30 20 EKED Cc1cccc2sc(C(=O)N[C@@H](C#N)C3CCCCC3)c(Cl)c12 610502317 IVZSSMVGLIIXHQ-ZDUSSCGKSA-N 346.883 5.065 30 20 EKED CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1F 619755272 VKDARJZCLLTLDH-MRXNPFEDSA-N 337.225 5.245 30 20 EKED N#C[C@@H](C(=O)C1CCCCCC1)c1nc2cc(Cl)ccc2s1 726321940 CISWZRMRPIPVAM-ZDUSSCGKSA-N 332.856 5.096 30 20 EKED O=C(/C=C\c1cnc2ccc(Cl)cn12)c1ccc2ccccc2c1 737444022 MXBYSTLBISBCGM-HJWRWDBZSA-N 332.790 5.037 30 20 EKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc2ccccc2c1 753133272 AYKQAEQWZUTWQI-ZHACJKMWSA-N 342.423 5.254 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc2c(ccc3ccccc32)o1)c1ccncc1 776158359 SXXHKZGDOKPJGU-KKSFZXQISA-N 342.442 5.949 30 20 EKED CCOc1cccc(C=Nc2ccc3nc(C(F)F)sc3c2)c1O 794677324 UWJFUCMIFSQCDC-UHFFFAOYSA-N 348.374 5.089 30 20 EKED CC(C)(CC(=O)[C@H](C#N)c1nccc2ccccc12)C1CCCCC1 796900391 OZDLIOGMUFHELJ-IBGZPJMESA-N 334.463 5.408 30 20 EKED C=CCCc1ccccc1NC(=S)N[C@@H](CC)c1cccs1 799900540 MDOUESYDLDLHNF-HNNXBMFYSA-N 330.522 5.304 30 20 EKED CC(C)CCC(=NNc1cccc(C(=O)O)c1)c1ccc(Cl)cc1 1776036745 DHDGSRGWSFBWEE-UHFFFAOYSA-N 344.842 5.291 30 20 EKED CCCCCCCOc1ccc(CN[C@H](CCC(C)C)C(=O)O)cc1 1776786520 QEHDUVKPOVUEBN-HXUWFJFHSA-N 349.515 5.015 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc3ccccc23)c1 113952569 IAUALLHGPYMQJR-FXAWDEMLSA-N 344.458 5.372 30 20 EKED Cc1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)oc2c(C)cccc12 147966443 FKMDJSUFWGKUDJ-QGZVFWFLSA-N 340.382 5.088 30 20 EKED CC(C)(C#N)CCCNc1ccc(Oc2ccc(Cl)cn2)cc1 154181977 RZEVZUXHNVCTGA-UHFFFAOYSA-N 329.831 5.269 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)CCC[C@@H]1C 173122074 NGSPGTATYDWYTO-PMPSAXMXSA-N 345.512 5.123 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccco2)on1 188063636 MZSFSUHEITXQDW-UHFFFAOYSA-N 336.391 5.039 30 20 EKED CC(C)[C@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 236790935 ZEFYOXMYRTXOFT-SFHVURJKSA-N 332.369 5.064 30 20 EKED CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@H]2CCCCC23CCCC3)c1 329639162 WKZKIGLVNXUPNW-KRWDZBQOSA-N 348.874 5.756 30 20 EKED CC(C)Sc1c(Cl)cccc1NC(=O)c1cc(C#N)cs1 437690768 DHFZZOOFPVPJCD-UHFFFAOYSA-N 336.869 5.026 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCC#Cc1ccccc1Cl 446991272 WHYNCVSJYZKVFM-OAHLLOKOSA-N 340.879 5.198 30 20 EKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1cc2cccc(F)c2o1 473908288 DWLPPXQHNACJTN-SECBINFHSA-N 349.287 5.030 30 20 EKED CC(C)(C#N)CCCSCc1ccc(OCC(F)(F)F)cc1 480379548 AQXVIVKUTJQCRD-UHFFFAOYSA-N 331.403 5.191 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 490200973 JSNWTWRWRQICRD-ZDUSSCGKSA-N 335.781 5.576 30 20 EKED C[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1F 512626099 RYNNZIVRJQGFJV-GHMZBOCLSA-N 337.225 5.416 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1F 512641645 JBSAMKAVOINDBW-HXPMCKFVSA-N 346.396 5.414 30 20 EKED Cc1ccc(-c2nc(CS[C@H](C)c3ccc(C#N)cc3)co2)cc1 522841927 XOHGNJMJHBFYEH-OAHLLOKOSA-N 334.444 5.516 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)cc1 536725636 NPJDZVIFTLUMIC-MRXNPFEDSA-N 330.406 5.215 30 20 EKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536816406 MGSHNFUZMLUJCC-QAPCUYQASA-N 349.434 5.145 30 20 EKED CCN(CCC1CC1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 562165780 MAKHWLDKUGTRIM-UHFFFAOYSA-N 349.434 5.004 30 20 EKED CC[C@@H](C)c1ccc([C@@H](NCc2nc(C#N)cs2)C(C)C)cc1 571845044 NGWZQDUVRFDTRM-KUHUBIRLSA-N 327.497 5.015 30 20 EKED N#CCCC[C@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1 575079082 JTZPHZCVXJBCSB-SFHVURJKSA-N 333.262 5.518 30 20 EKED N#Cc1csc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c1 581339042 FQJMVLRWALLTEW-INIZCTEOSA-N 337.275 5.167 30 20 EKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccsc1 619747899 WORZZFYNJXUPGJ-INIZCTEOSA-N 348.471 5.050 30 20 EKED C[C@H](C(=O)OCCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 768728430 ISSYHVVMXCKYPS-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED CC(C)n1nccc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 794930931 HLHOXPHANRJMHK-UTCJRWHESA-N 343.641 5.320 30 20 EKED COc1ccccc1CON=CC(c1ccccc1)c1ccccc1 799118888 ZLYFJGZHEMDPTJ-UHFFFAOYSA-N 331.415 5.030 30 20 EKED N#CCCC[C@H](NCc1cc2ccccc2nc1Cl)c1ccccc1 814658494 FDWBHACLWUVODL-IBGZPJMESA-N 349.865 5.413 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C(F)=C/C2CCCCC2)s1 816068312 PLEFWPMFPDVUKY-CKXDQPNJSA-N 334.460 5.051 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CC[C@@H](C)c3ccsc32)c1 834650987 SNMKABHKPOHRFS-OGWOLHLISA-N 340.492 5.157 30 20 EKED Cc1ccc(N[C@H](C)CC2(C#N)CCOCC2)cc1-c1ccsc1 877839323 HJORHAJDZXBRAD-MRXNPFEDSA-N 340.492 5.234 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1C 916847268 BFZDORPENJOTHK-JJEJIETFSA-N 346.455 5.111 30 20 EKED C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2ccc(CCC#N)cc2)C1 932567026 JURSJAYGAPGDKV-UWJYYQICSA-N 347.462 5.148 30 20 EKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 59337553 IFFZBTYABSFELE-NSHDSACASA-N 348.233 5.090 30 20 EKED N#CCC[C@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1 130412584 BXOHLWCCCVYSMJ-QFIPXVFZSA-N 334.463 5.143 30 20 EKED CC(O)=Nc1ccccc1-c1noc([C@@H]2CCC[C@H]3CCCC[C@H]32)n1 329720886 BTAHJNFKIWISRK-BZUAXINKSA-N 339.439 5.418 30 20 EKED Cc1cc(Cl)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1C 352217497 KFUBNRDOMKTNSD-IBGZPJMESA-N 340.854 5.122 30 20 EKED C=C(C)C[C@H](C)C(=O)N1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 466650554 JIKHIWYTTMZBFY-JKIFEVAISA-N 339.401 5.217 30 20 EKED CC(C)(C)OC1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1 469296208 RIACJMCHFUSROX-UHFFFAOYSA-N 348.490 5.005 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@]12CCc1ccccc12 476151307 NZXDFDZHQUAIKV-QPPBQGQZSA-N 345.486 5.381 30 20 EKED Cc1ccc(C)c([C@H]2CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)c1 476315941 VWPMTFKVMPCFTO-IFMALSPDSA-N 346.474 5.055 30 20 EKED C=C(C)[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 480669535 BVEZLXPUWTZLBK-YJYMSZOUSA-N 346.377 5.149 30 20 EKED COc1cc(N[C@@H](C)c2ccc(C#N)cc2F)cc(OC)c1C(C)C 512289578 TUKZYHOCVBGSKG-ZDUSSCGKSA-N 342.414 5.011 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 536835231 WJYVEMKDDABNFW-YLJYHZDGSA-N 330.431 5.642 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(SCC(F)(F)F)cc1 558236661 BNNACAPRDWYKSS-ZDUSSCGKSA-N 344.446 5.322 30 20 EKED COc1ccc2ccccc2c1CN(CCCCC#N)C1CCCC1 609075652 OUGLPEQOIKOCAC-UHFFFAOYSA-N 336.479 5.287 30 20 EKED O=C(/C=C\c1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1 727976371 QUUDDVSBUIYNHD-PLNGDYQASA-N 330.227 5.019 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCC(C)(C)C)n2)cc1 729070610 SAFJHYGOGHVDJM-MRXNPFEDSA-N 340.492 5.511 30 20 EKED CCCC(C)(C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734928599 IHRDGMHDFMCYPC-LJQANCHMSA-N 335.451 5.042 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc(COC2CCCC2)cc1 739426988 POPVQJNQBZAWAG-UHFFFAOYSA-N 346.430 5.150 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(Cl)c(Cl)c1 740764334 RPLDJXFZPKPHER-BQYQJAHWSA-N 328.198 5.438 30 20 EKED Cc1ccc(-c2ncc(/C=C3\CCc4c(O)cccc4C3=O)s2)cc1 742434231 DHDZNHIDJNOPDO-RVDMUPIBSA-N 347.439 5.037 30 20 EKED COc1ccc(/C=C/C(=O)c2c(C)nn(C(C)C)c2C)c2ccccc12 746345594 IFQHNGLKLWEWKD-ZRDIBKRKSA-N 348.446 5.139 30 20 EKED C[C@@H](CCC1CC1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 769223594 SRHJNXTYSQRVFY-HRAATJIYSA-N 347.462 5.042 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@H]1c1cc(C)no1 775147067 RQVZMKDWEYCMQY-WMZOPIPTSA-N 334.504 5.423 30 20 EKED CC[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797572630 DWWJILLSTGLYMJ-GDBMZVCRSA-N 340.492 5.201 30 20 EKED Cc1oc(-c2ccccc2)nc1CON=Cc1ccc(C(C)C)cc1 818263319 ANEZLDVHKLRJSQ-UHFFFAOYSA-N 334.419 5.324 30 20 EKED CCCN(CCC)c1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1 915224779 MEHNVDXNJQSFMV-GOSISDBHSA-N 335.495 5.035 30 20 EKED C=CC[C@@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1ccncc1 925075309 NSZDTDBNEKUERA-BXUZGUMPSA-N 326.387 5.130 30 20 EKED CC1(C)/C(=C\c2csc3ccc(C(=O)O)cc23)C(=O)c2ccccc21 1776515342 MCXRJFFAIDOCNZ-YVLHZVERSA-N 348.423 5.157 30 20 EKED N#CCCCN(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 64632454 SBVOHQVSGZASCU-UHFFFAOYSA-N 348.368 5.234 30 20 EKED Cc1nc(C(C)C)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 90665314 RMNNZEQQVHNHPW-YOEHRIQHSA-N 327.497 5.271 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(SC(F)F)cc1 90665477 KGXDZDSICCRVRW-KBXCAEBGSA-N 346.446 5.697 30 20 EKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)C1=CCCCC1 330012525 KRQMLFAZIHGCGA-UHFFFAOYSA-N 346.515 5.395 30 20 EKED CC(C)(C#N)CCCCN1CCSC[C@H]1c1ccc(Cl)cc1 444643081 SMCWPQBERWPYCV-KRWDZBQOSA-N 336.932 5.150 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC[C@@H]1CCC2(CCCCC2)O1 466847467 SMVSAHKULRURRR-IRXDYDNUSA-N 344.524 5.232 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 466873057 NIJZVJFGQHKSSZ-GFCCVEGCSA-N 329.362 5.033 30 20 EKED Cc1cc(Cl)c(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1Cl 483807117 MEFCGRVDRAWCFA-CQSZACIVSA-N 347.245 5.328 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCCC[C@H]1c1ccccc1 505000777 JYKIWPSQSJOBGE-NRFANRHFSA-N 334.463 5.564 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ncccc1C)C(C)C 505030286 URRDRLWENHHZCD-LJQANCHMSA-N 337.467 5.027 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)c1 515775190 GLKZFJAORNKAHR-QGZVFWFLSA-N 349.478 5.330 30 20 EKED C[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)c(F)c1 538508167 ZOUIYZYKDUDWBL-WDEREUQCSA-N 337.225 5.416 30 20 EKED CCOc1cccc2cc([C@@H](C)NC3(c4cccc(C#N)c4)CC3)oc12 551806115 JUGREZDDCAMHQM-OAHLLOKOSA-N 346.430 5.043 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1c(Cl)cccc1Cl 557508782 SZNPFVNJFFOZRQ-GOSISDBHSA-N 331.246 5.032 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C#N)cc2)cc1 610271459 JOBNUTSEYMPLIF-QGZVFWFLSA-N 342.442 5.085 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCSc2ccc(Cl)cc21 618803801 IWTPRLLABKMDCD-MSOLQXFVSA-N 340.879 5.026 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)CC(C)C)n2)cc1 727953452 BDZKYPBFGPHSKQ-WBVHZDCISA-N 340.492 5.367 30 20 EKED CC(C)Oc1cccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745990516 ROZVGVKLFDMTDU-WDZFZDKYSA-N 343.426 5.432 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C)cc3)o2)c1 750894667 BALIJGBNCARCEO-BENRWUELSA-N 345.398 5.110 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3coc(-c4ccccc4)n3)oc2c1 754824036 HRXOGOJITHXGLF-MDZDMXLPSA-N 329.355 5.292 30 20 EKED CC1(C)CC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 768869313 USTUJVLLONQQPR-VQTJNVASSA-N 347.462 5.042 30 20 EKED Cc1nc(-c2ccc(N[C@@H](C)c3ccc(C#N)c(F)c3)cc2)oc1C 777652722 NWWNPOPGPWDSKE-ZDUSSCGKSA-N 335.382 5.142 30 20 EKED C#CC[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccccc1 782473398 UGLDLQIWPCSPAV-JOCHJYFZSA-N 340.426 5.299 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 844255856 NAJRLBSIFCYMNI-FPLPWBNLSA-N 327.380 5.055 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1)c1nc2ccccc2s1 860451888 PFFBAZXJQNJWHE-BRWVUGGUSA-N 346.455 5.056 30 20 EKED C[C@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1cc(C#N)ccn1 902993866 XRXBGAWREGSIRG-BBATYDOGSA-N 346.261 5.062 30 20 EKED Fc1cc(F)c(F)c(Oc2ccc(C(F)(F)F)c(Cl)n2)c1F 913396462 NEXSHSPRPINJLM-UHFFFAOYSA-N 345.601 5.103 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 916286772 USZCUARTOMDRIB-UHFFFAOYSA-N 329.325 5.090 30 20 EKED CCC(CC)[C@@H](NC(=S)Nc1ccccc1C#N)c1cccs1 920996225 XDSYIQYHUCSQRN-QGZVFWFLSA-N 343.521 5.084 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)cc1 1776013452 ATXSDKQDSPHJNH-KSSFIOAISA-N 330.472 5.415 30 20 EKED CC(C)[Si](C#Cc1c(F)ccc2cccc(O)c12)(C(C)C)C(C)C 2332240172 DOHYFSCMTDZXIL-UHFFFAOYSA-N 342.530 6.254 30 20 EKED N#C[C@H](C(=O)c1cc2ccccc2o1)c1nc(-c2ccccc2)cs1 41536415 WTAISOJXXSNOBJ-OAHLLOKOSA-N 344.395 5.046 30 20 EKED CCCCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 173115788 GMQHXPHJDHBVMU-INIZCTEOSA-N 347.528 5.371 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1Cl 189874654 ZZXYNJZDIQUTRE-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cc2ccccc2s1 237607841 GZCGQTZPRXNEKZ-INIZCTEOSA-N 349.503 5.102 30 20 EKED CCOc1ccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)cc1OCC 303508209 SKCYDULLDDYIRB-ZDUSSCGKSA-N 344.842 5.182 30 20 EKED C[C@H](N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1cccc(C#N)c1 435659401 JFHXFAYBWOTONP-IXDGSTSKSA-N 344.380 5.174 30 20 EKED CCC[C@H](C)[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458798803 IPUZUCDRYVRJBT-IHPCNDPISA-N 341.499 5.032 30 20 EKED C=CCC(CC=C)c1nc(-c2cccnc2Oc2ccccc2)no1 467768872 MWWJLCQHROVKOZ-UHFFFAOYSA-N 333.391 5.160 30 20 EKED CC(C)(C#N)CCCSCc1csc(-c2ccccc2F)n1 480414314 UPQZUCQUPVTLCM-UHFFFAOYSA-N 334.485 5.512 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(OC)cc1 505011200 RNTLDVWJULXMAR-MRXNPFEDSA-N 338.451 5.039 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(CC#N)cc3)cc2)cs1 541325700 RANZUTIMSOJREQ-HNNXBMFYSA-N 347.487 5.035 30 20 EKED C=CCN(Cc1ccccc1F)Cc1nc(-c2ccsc2)oc1C 588671763 XBDFBANDAMZYSR-UHFFFAOYSA-N 342.439 5.039 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC1(CSC)CC1 596867647 SDYUDFLQOZUMFM-UHFFFAOYSA-N 346.540 5.193 30 20 EKED C=CCCCCCN(C)C(=O)[C@H](C)c1ccccc1C(F)(F)F 607838398 JJONMVNNHXGICW-CQSZACIVSA-N 327.390 5.014 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc2ccccc2c1 609387124 NVOVHJFVCDMXQA-IRXDYDNUSA-N 346.499 6.265 30 20 EKED Cc1cc(F)ccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609985831 MLGJJRVYBPRKPT-UHFFFAOYSA-N 345.377 5.002 30 20 EKED CCc1nc(C)c([C@H](C)N(C)Cc2ccc(C(C)(C)C#N)cc2)s1 614168748 SRLDQTJUSWIQKZ-HNNXBMFYSA-N 341.524 5.008 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc2cc(Cl)ccc2o1 619755340 XJYLXFXGBNFNCT-NSHDSACASA-N 345.229 5.462 30 20 EKED C=C(C)[C@@H](CO)Sc1nc(-c2ccccc2)c(-c2ccccc2)o1 677132234 YZXUNODILOUXMT-QGZVFWFLSA-N 337.444 5.038 30 20 EKED C=C(Cl)CNC(=O)Nc1ccc(Sc2ccccc2)cc1C 736969441 OXVFRCNAVJJIGU-UHFFFAOYSA-N 332.856 5.020 30 20 EKED C=CCSCCNC(=S)Nc1c(C(C)C)cccc1C(C)C 745019396 PJEGVCRQBVRORJ-UHFFFAOYSA-N 336.570 5.139 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cc(Cl)ccc1OCC)c1ccncc1 766019866 NNRXTZDJYWQFRD-KBXCAEBGSA-N 330.859 5.102 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(F)c(C#N)c1 791344403 LNPRGUAUVKQSJV-UHFFFAOYSA-N 342.439 5.149 30 20 EKED CC(C)n1nccc1/C=C/C(=O)c1ccc(Cl)c(C(F)(F)F)c1 794947031 SNABCTQTGVVLTD-GQCTYLIASA-N 342.748 5.032 30 20 EKED C#CCCCCCC(=O)N(C(CC)CC)[C@H]1CCCc2cccnc21 800958432 QJXMHJMBGWNPGO-FQEVSTJZSA-N 340.511 5.060 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc2c(c1)COC(=O)N2 862781067 AXUUPBGXTIUAMA-AWEZNQCLSA-N 332.444 5.074 30 20 EKED CCCCOc1ccc(/C=C\C(=O)c2ccc(F)cc2F)cc1OC 916128003 CMYADYZGJYKVFX-UITAMQMPSA-N 346.373 5.048 30 20 EKED CC(C)CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Cl)cc1 1776074103 IHJQTTBBHXBISB-UHFFFAOYSA-N 348.805 5.040 30 20 EKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(SC(C)C)cc1 1776086597 CYGZGTXYOMEUEM-UHFFFAOYSA-N 342.464 5.030 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc(F)cc1 1776131673 YNDMOPHMKSBOGG-AUWJEWJLSA-N 346.357 5.087 30 20 EKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1cccc(C(F)(F)F)c1 72054457 FNGJWDPCKCOIPL-SECBINFHSA-N 326.268 5.028 30 20 EKED CC(C)(C)CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 122081407 HKFWTCWRCCCUNW-LLVKDONJSA-N 348.418 5.091 30 20 EKED CC(C)c1nc(CNc2ccccc2S[C@H](C)CC#N)cs1 153882448 WDRYPHDFGMTSBK-CYBMUJFWSA-N 331.510 5.273 30 20 EKED Cc1ccccc1[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)C(C)(C)C 175986928 QZPUJITXCJWBAK-LAUBAEHRSA-N 336.479 5.163 30 20 EKED COc1ccccc1[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1 181942882 OVPKIXJBCYGOMQ-SBUREZEXSA-N 342.442 5.007 30 20 EKED CC/C=C/CCSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 185719225 FSMIEOJUMQJJLA-RGDDUWESSA-N 348.537 5.109 30 20 EKED Cc1ccc(C)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 303210695 RDRUVYCLKOTNEZ-UHFFFAOYSA-N 342.398 5.220 30 20 EKED COc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1N=C(C)O 329001570 LGWZWBAAAKJRAE-USXIJHARSA-N 344.455 5.498 30 20 EKED N#Cc1ccc(CSCc2ccc(Cl)c3cccnc23)c(F)c1 498122538 IMNLQEOEIWKYGK-UHFFFAOYSA-N 342.826 5.332 30 20 EKED C=CCC[C@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccccc1 515149644 GDYNVEAHMHQFQK-OALUTQOASA-N 325.427 5.119 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccc(-c3cnco3)cc2)CC1 535085687 URDRSVLKXJOPCT-UHFFFAOYSA-N 343.430 5.158 30 20 EKED Cc1cc(OCCC[C@H](C)NCC(C)(C)CCC#N)ccc1Cl 554367459 XOXKDXIWUSNTHS-INIZCTEOSA-N 336.907 5.116 30 20 EKED COc1ccccc1-c1ccc([C@H](C)Nc2cc(C#N)cc(C)n2)cc1 587985552 USBZVXXNKSMBHP-INIZCTEOSA-N 343.430 5.110 30 20 EKED N#CCCCCCC(=O)NCC1(c2ccccc2Cl)CCCCC1 588162895 PREXSLDXHQGLDH-UHFFFAOYSA-N 346.902 5.132 30 20 EKED N#Cc1cccc(CSCc2csc(-c3ccccc3F)n2)c1 609237956 DTZLUADCEYHJIA-UHFFFAOYSA-N 340.448 5.254 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(C)s1 609427387 LBPIYMNJXTUOJT-UHFFFAOYSA-N 348.427 5.281 30 20 EKED CCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613402948 KVWGLHCIZXLHCW-CQSZACIVSA-N 340.835 5.002 30 20 EKED CC(C)C[C@H](NCc1cc(Cl)ccc1OCC#N)c1cccs1 754297571 YFXLKZGYMHGOGQ-INIZCTEOSA-N 348.899 5.181 30 20 EKED CCC(C)(CC)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 767966398 PRJGZCUVEUCPLO-NSHDSACASA-N 348.418 5.091 30 20 EKED Cc1cccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 783593968 PJXNVNOMVSDEFS-KRWDZBQOSA-N 342.442 5.090 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N(C)C)cc1 815635458 DARPLTIZQZXLNX-FCHUYYIVSA-N 335.495 5.228 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nc3ccccc3s2)CCC(F)(F)CC1 850739752 NXKRLHMPEJYVLT-GFCCVEGCSA-N 348.418 5.078 30 20 EKED CCCCCCC[C@@H](C)CNc1ncnc2sc(C(=O)O)c(C)c12 1776782353 KYRVIKRVRQZOTR-GFCCVEGCSA-N 349.500 5.106 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc2ccccc12 1776783770 IOALZTSAGWAKAX-IBGZPJMESA-N 327.468 5.133 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)C(=O)N[C@@H](CCC#N)c1ccccc1 160598560 ZRSXKEJDBJLHIN-NQIIRXRSSA-N 349.478 5.042 30 20 EKED C[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(OCC#N)cc1 181724768 POAOAHHWRNVSSB-LSDHHAIUSA-N 336.460 5.215 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1 456383960 QDKRNYQTFDVJNH-LJQANCHMSA-N 349.902 5.157 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COC/C=C\c1ccccc1 476141058 IPRKIDGVAHRSCY-LCYFTJDESA-N 349.474 5.207 30 20 EKED C=CCCC1(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)CC1 476344552 ZDSOUTQFXWVNQR-UHFFFAOYSA-N 349.396 5.068 30 20 EKED C[C@@H]1CCC[C@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 482542052 FJQIEMNCVDALBI-APWZRJJASA-N 348.446 5.001 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 505062490 RXKZNBCUTZQOHN-HXUWFJFHSA-N 338.426 5.313 30 20 EKED C=CCC[C@@H](NCC1CC(OCC)C1)c1ccc(C(F)(F)F)cc1 509019976 AXPYQAOUGVUUHM-IUPXNIOVSA-N 341.417 5.117 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1F 512614949 XTFAXCHVATUVER-IVZQSRNASA-N 348.396 5.277 30 20 EKED N#Cc1cccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c1 515095786 PBODVRTYGPEAIH-SFHVURJKSA-N 331.246 5.106 30 20 EKED CCC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(OC)cc1 554180956 FYXUMDZQQFMFIE-NRFANRHFSA-N 338.451 5.331 30 20 EKED CC1(C)CCC[C@H]1N(Cc1ccccc1)C(=O)CCCCCC#N 588755600 RJJKGDFKDFAUBO-LJQANCHMSA-N 326.484 5.068 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccccc1COC(C)(C)CC 680491323 CAOJLEOTTCMFBU-MRXNPFEDSA-N 332.488 5.258 30 20 EKED CCCC1C/C(=C\c2cccnc2C)C(=O)/C(=C/c2cccnc2C)C1 728785235 AMUMEMMKUYIGDV-NNFYUIBOSA-N 346.474 5.340 30 20 EKED CC(=NOCc1cnc(C)s1)c1ccc(-c2ccc(F)cc2)s1 744179186 AQBJWXRXJYKEJC-UHFFFAOYSA-N 346.452 5.260 30 20 EKED Clc1ccc(C=NOCc2coc(-c3ccc(Cl)cc3)n2)cc1 749254017 KURXKCKPBSHZGG-UHFFFAOYSA-N 347.201 5.199 30 20 EKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2ccc(F)c(F)c2)ccc1OC 749453126 RDHVJVRGTLIFOL-WYOARUQKSA-N 346.373 5.047 30 20 EKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 750904782 IBUYTOPDGSBNAJ-VKDZAETISA-N 347.292 5.066 30 20 EKED C[C@@H](Nc1ccc(F)cc1OCC#N)c1cc(Cl)ccc1Cl 751525140 SVAVGCKXUNDHRP-SNVBAGLBSA-N 339.197 5.208 30 20 EKED COc1cc(C)ccc1C(=O)/C=C/c1csc(-c2ccccc2)n1 797285204 NFPJSCPAPFAQBN-PKNBQFBNSA-N 335.428 5.023 30 20 EKED Cc1ccsc1CCCC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567126 DJEVEEFJXIVYQS-ZDUSSCGKSA-N 346.521 5.010 30 20 EKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1c(F)cccc1Cl 809158941 FUUOWIFNEPVAIC-SNAWJCMRSA-N 349.839 5.560 30 20 EKED CC(C)[C@@H]1C[C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccccc21 858520453 ABNAYPFRGWGXQX-XGRCMKMKSA-N 334.463 5.124 30 20 EKED CC(C)[C@@H](N[C@@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902785225 CABRTXLQGQZCEM-SCLBCKFNSA-N 347.384 5.020 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)s1 915087217 RLQSIPKUFPKCRF-FQEVSTJZSA-N 346.455 5.273 30 20 EKED COc1cc(C=NNc2ccc(C)cc2)c(-c2ccccc2)cc1OC 915270048 LMGVUROMBBTCQA-UHFFFAOYSA-N 346.430 5.125 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)C12CC3CC(CC(C3)C1)C2 916259653 CAXCACNJPVWPKN-UHFFFAOYSA-N 346.858 5.042 30 20 EKED Cc1c(NN=C2CC[C@H](c3cccc(Cl)c3)C2)cccc1C(=O)O 1776088308 DIEOWZBXXSWOIR-AWEZNQCLSA-N 342.826 5.082 30 20 EKED CC(C)c1ccc([C@H](NCc2cccc(C#N)c2)c2cccs2)cc1 22817925 FXRYXOWDMHZZIL-QFIPXVFZSA-N 346.499 5.622 30 20 EKED Cc1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)o2)c(C)c1 118176677 RYULOGXJXPYVMR-CQSZACIVSA-N 335.432 5.078 30 20 EKED C[C@@H](Sc1nnc(-c2cc3ccccc3o2)o1)c1ccc(C#N)cc1 176801865 ZNYDVROWNSJCCU-GFCCVEGCSA-N 347.399 5.208 30 20 EKED COc1ccc2c(c1)CCC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 340446786 HEWPFWZVEJTTAK-VXKWHMMOSA-N 334.463 5.097 30 20 EKED CCc1cc(C)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)o1 429014607 ZEPZISUMBPTAAT-UHFFFAOYSA-N 336.416 5.003 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2ccc(COC(C)C)cc2)CCCC1(C)C 445235380 IMEUYWRCFYOCCE-IBGZPJMESA-N 344.499 5.210 30 20 EKED C=CCn1c(S[C@@H](C)c2cccc(C)c2)nnc1-c1ccoc1C 463038464 PTRYVYSELFRYJE-HNNXBMFYSA-N 339.464 5.194 30 20 EKED C=C(C)[C@@H](NCc1cnc(C2CCC2)s1)c1ccc(F)c(F)c1 479417119 SBXKVHSEJIEXKS-QGZVFWFLSA-N 334.435 5.096 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C[C@@H](C)C#N)C1CC1 513677555 YIQLNLKEIMBQIB-HNNXBMFYSA-N 327.472 5.089 30 20 EKED CCCc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518241119 XDYWWVBTTDETCV-OAHLLOKOSA-N 338.476 5.286 30 20 EKED FCCCCCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 551450515 HJJZESXCLROOHM-ZDUSSCGKSA-N 345.302 5.428 30 20 EKED CC(C)(CCC#N)CNC(=O)Nc1ccc2oc3ccccc3c2c1 562031030 MOXLCBGWRBECCY-UHFFFAOYSA-N 335.407 5.037 30 20 EKED COc1ccc(CC[C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 568891748 XYAXRDFXKOUFNN-PGRDOPGGSA-N 336.479 5.041 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc3sccc3s2)cc1 604170656 MTAWFNIOFDMLFH-UHFFFAOYSA-N 326.446 5.016 30 20 EKED CC(C)(C)OCc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 614058504 ALDGWYFQOCJLSD-UHFFFAOYSA-N 336.479 5.415 30 20 EKED C=CCOc1cccc(CN[C@H](C)c2ccccc2C(F)(F)F)c1 619775720 MKAFWXBYASWALE-CQSZACIVSA-N 335.369 5.121 30 20 EKED Cc1sc2ncnc(S[C@H](C#N)c3ccc(Cl)cc3)c2c1C 619863809 GQVUAVDGZMTOAQ-CYBMUJFWSA-N 345.880 5.319 30 20 EKED C=CCN(C(=O)N[C@H](C)c1ccccc1Oc1ccccc1)C(C)C 726272276 IFHLOSUSVVYMNQ-QGZVFWFLSA-N 338.451 5.146 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(OC)c(F)c1 726473988 CEOWCHDCAKLIJI-UHFFFAOYSA-N 340.508 5.214 30 20 EKED COc1ccc(CN[C@@H](C)c2ccc(-c3cccs3)cc2)cc1C#N 742369240 QBKKTANSDKCFDI-HNNXBMFYSA-N 348.471 5.146 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 756299229 COBUQLYOLSUWGR-BBRMVZONSA-N 326.465 5.270 30 20 EKED C=CC[C@@H](N[C@H]1CCSc2c(Cl)cccc21)c1ccncc1 766019865 NMLWVVKPCXIRIB-SJORKVTESA-N 330.884 5.179 30 20 EKED N#Cc1ccc(F)c(CN[C@H]2CCCc3c2sc2ccccc32)c1 773029057 ATDBRMVDMPTMDR-SFHVURJKSA-N 336.435 5.079 30 20 EKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 776081293 MQWAIRDXOSCHLW-UONOGXRCSA-N 347.409 5.214 30 20 EKED C[C@@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)c(F)c1 777061169 XBRSLPWEDCBTHQ-OAHLLOKOSA-N 338.426 5.330 30 20 EKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1cc2ccccc2s1 780188915 QGJPBDIBOBITMO-CMDGGOBGSA-N 348.452 5.316 30 20 EKED CCOc1ccc(O)c(C=Nc2ccc3nc(C(F)F)sc3c2)c1 794676385 NOPLFDLFLWOCMJ-UHFFFAOYSA-N 348.374 5.089 30 20 EKED COc1ccc(-c2nc(/C=C\C(=O)c3cccc(C)c3)cs2)cc1 797092220 WHUDNFZQJUTMEB-FLIBITNWSA-N 335.428 5.023 30 20 EKED C[C@@H](OC(=O)CCCCCC#N)c1ncc(-c2ccc(Cl)cc2)o1 805698173 VMODTWPMQDEVQM-CYBMUJFWSA-N 346.814 5.073 30 20 EKED CCCCCCC[C@@H](C)CNC(=O)Nc1ccc(NC(C)=O)c(C)c1 918031187 WHSSYAVFDATMDV-OAHLLOKOSA-N 347.503 5.072 30 20 EKED N#CCCCOc1cccc(/C=C/c2nc3cc(Cl)ccc3o2)c1 110425800 XFUJUFHKNCFDRU-RMKNXTFCSA-N 338.794 5.334 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(SCc2cccnc2)cc1 121665987 CDHSZFAKJMCNKX-UHFFFAOYSA-N 338.476 5.081 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1cccc(C#N)c1 181887027 CTQHMWDWOZPPGB-AOMKIAJQSA-N 330.406 5.138 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1cccc(Cl)c1Oc1cccnc1 185466251 KTKXLMTXAYCUEK-ZDUSSCGKSA-N 330.815 5.068 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(OC)c1 189913253 FWXAGICQNQZFCG-UHFFFAOYSA-N 343.854 5.453 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 325108903 CHGGDWNOMAXTSI-AWEZNQCLSA-N 335.369 5.121 30 20 EKED C[C@@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccsc2S1 340450300 MDNRCZHJYVSMCT-FHLIZLRMSA-N 342.533 5.698 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(CC)nc1C 356209899 FYTGTGCZWCZLCD-UHFFFAOYSA-N 328.481 5.118 30 20 EKED Cc1nc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 367805151 VYVXBIXQGVAYLI-GJZGRUSLSA-N 347.487 5.402 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1cccc(F)c1C#N 427437600 ZEXUHMVDCBOLKM-UHFFFAOYSA-N 326.415 5.015 30 20 EKED CCCC1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CCC1 467576737 GANOFIWVXYEXSS-OAHLLOKOSA-N 345.512 5.030 30 20 EKED Cc1csc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c1Cl 480084331 QFZFXZZUXURSFI-CQSZACIVSA-N 346.883 5.002 30 20 EKED C=CCC(CC=C)C(=O)Nc1cnn(-c2ccc(C)cc2)c1C(C)C 481891776 LJDNDHKVZTUIJJ-UHFFFAOYSA-N 337.467 5.011 30 20 EKED Cc1cc2occ(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2cc1C 483205305 SKFMGGGLSABCKA-SFHVURJKSA-N 340.382 5.088 30 20 EKED Cc1ccc2sc(C(=O)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 486280614 FIFXGEQKAFEGGN-SFHVURJKSA-N 348.471 5.293 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)c2ccc(C#N)o2)c1 511349286 DPTPCBWCPCRLCE-UHFFFAOYSA-N 336.778 5.032 30 20 EKED CCCC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(OC)cc1 539610283 TYFPSBJAIBKHLC-BTYIYWSLSA-N 340.442 5.288 30 20 EKED N#CCC1CCN(Cc2ccc(-c3cccc(Cl)c3Cl)o2)CC1 540993807 OLPKWLFSYUUVMO-UHFFFAOYSA-N 349.261 5.379 30 20 EKED CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CCCCC#N 594013167 TWDBUPQZUASIOX-IBGZPJMESA-N 334.891 5.360 30 20 EKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2ccc(O)cc2)CC3)cc1 727654054 GPPVHVLMECBZGB-VBKFSLOCSA-N 347.439 5.037 30 20 EKED Cc1ccc(-c2nc(/C=C3/Cc4cc(F)ccc4C3=O)cs2)cc1 734305005 DOLPCLXSDAGBCK-GDNBJRDFSA-N 335.403 5.080 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1c[nH]c2cc(Cl)ccc12 754711881 CXDVQIXGBYVSLL-UHFFFAOYSA-N 338.716 5.253 30 20 EKED C#CC[C@H](N[C@@H](C)c1sc(C(C)(C)C)nc1C)c1ccccc1 773116225 QWDUDKNNOQXCGD-YOEHRIQHSA-N 326.509 5.164 30 20 EKED CSc1ccc(C(=O)/C=C\c2cccc3cnccc23)c(Cl)c1 782890420 YOKQNWJMCQHSQG-YVMONPNESA-N 339.847 5.506 30 20 EKED O=C(/C=C/c1ccsc1Cl)c1ccc(-c2ccncc2)cc1 790219238 HSDIKTHUJNHMQB-AATRIKPKSA-N 325.820 5.360 30 20 EKED O=C1/C(=C/c2ccsc2Cl)CCc2ncc(C(F)(F)F)cc21 790224485 YKXNAOZVSBBGCL-VMPITWQZSA-N 343.757 5.028 30 20 EKED Cc1cc(Cl)cc([C@H](C)Nc2cccc(OCCCC#N)c2)c1O 808709334 RUYNEDFAOKAJNQ-AWEZNQCLSA-N 344.842 5.210 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2csc(Cl)c2)c(C(F)(F)F)c1 811690593 FPPFISWGGXXYEB-ARJAWSKDSA-N 341.741 5.188 30 20 EKED Clc1cccc(C=NOCc2ncc(-c3ccccc3)o2)c1Cl 821497576 ZZCOWSCDMGIGKL-UHFFFAOYSA-N 347.201 5.199 30 20 EKED O=C(/C=C\c1ccc(-n2cccn2)cc1)c1cc(Cl)sc1Cl 884377898 ZDJXWPPHEJLSCM-DAXSKMNVSA-N 349.242 5.137 30 20 EKED CCOc1cc(/C=C\C(=O)c2ccc(SC)cc2)cc(Cl)c1O 916133332 HIOZKDPYIGKRKX-WTKPLQERSA-N 348.851 5.062 30 20 EKED Cc1cc(C(=O)/C=C/c2ccc(Br)s2)c(C)s1 916155830 FHGFDXBUCREVRH-HWKANZROSA-N 327.268 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1c(C)noc1C(C)C 931062784 UFTAAJHQZINZLF-UHFFFAOYSA-N 341.455 5.602 30 20 EKED CCCCCCCCCCCN(C)CCOc1ccccc1C(=O)O 1776784580 KIUSPQPFHBSVEQ-UHFFFAOYSA-N 349.515 5.226 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 121023118 SPLXOATVNWSFNF-UHFFFAOYSA-N 341.455 5.169 30 20 EKED CC[C@@H](C#N)Sc1nnc(-c2ccccc2Cl)n1C1CCCC1 126952869 JCVJPXOSVUUSQI-ZDUSSCGKSA-N 346.887 5.108 30 20 EKED Cc1scc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 180741915 JDIGSYUCYGJLQA-NSHDSACASA-N 346.864 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1c(C)noc1C 189884629 ABFRSPXRPXDUQE-AWEZNQCLSA-N 340.467 5.276 30 20 EKED CCc1c(C(=O)/C=C\c2c(C)nn(CC)c2C)oc2ccc(C)cc12 209344203 SRGAHMGMLUTRQY-KTKRTIGZSA-N 336.435 5.033 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1 237478058 ZQXARMAAQFMPRM-SFHVURJKSA-N 344.458 5.164 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC(C)(C#N)CC2)c(C)c1 272523337 LOYPBAFPZNRVPS-HNNXBMFYSA-N 345.512 5.043 30 20 EKED C[C@H](CC(O)=Nc1cccc2c1CCCC2)/N=C(/O)C1CCCC1 328783550 GLERUKICXHYJPL-CQSZACIVSA-N 328.456 5.079 30 20 EKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)[C@@H]3CCCCC(O)=N3)c3cccc1c32 329897146 LESAQPNVBWMUDU-COXVUDFISA-N 340.467 5.142 30 20 EKED CC1(C)CC[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340444154 GQASTBBTQVQZJD-FCHUYYIVSA-N 332.491 5.824 30 20 EKED N#CCC[C@@H](NC(=O)Nc1csc2ccccc12)c1ccccc1 352810833 QCHCSRULAAFKER-MRXNPFEDSA-N 335.432 5.068 30 20 EKED Cc1ccc(Cl)cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 431697592 PDPFMBFHDSZNFD-KRWDZBQOSA-N 341.842 5.205 30 20 EKED CC[C@H](NC[C@H]1CCCO[C@H]1c1ccc(C)cc1)c1ccc(C#N)cc1 447526231 BZEROMZQVUGHBR-VJBWXMMDSA-N 348.490 5.075 30 20 EKED CC(C)N(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 483434016 NWZHISDSZVKTBU-QGZVFWFLSA-N 340.854 5.169 30 20 EKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 488503848 KMSNFNZZXVHTOE-KRWDZBQOSA-N 339.439 5.037 30 20 EKED CC[C@@H]1C[C@]1(NCc1cccc(OCCCC#N)c1)c1cccc(C)c1 500512198 IVEUHYNKWOKOFR-NFBKMPQASA-N 348.490 5.093 30 20 EKED C=C[C@H](CC(=O)Nc1cc(-c2ccncc2)ccc1C)c1ccccc1 534697825 WXSRKSGUXZLXTB-GOSISDBHSA-N 342.442 5.355 30 20 EKED C=CCC[C@H](NCc1csc(-c2ccc(C)o2)n1)c1ccccc1 538259013 TZBVBKFMJFYDTN-SFHVURJKSA-N 338.476 5.509 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@@H]1C 558640229 PUMBPKIJTQCBLP-HNNXBMFYSA-N 338.426 5.096 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 559862958 FWOHLLWTQDPULN-GHTZIAJQSA-N 344.458 6.032 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@H](C#N)C3CCCCC3)cc2)cs1 609676983 JMUOKLKVERDYAP-AUUYWEPGSA-N 339.508 5.242 30 20 EKED CC(C)c1cccc(NC(=O)CS[C@@H](C)c2ccc(C#N)cc2)c1 609825891 ZFIXPDVKGCZMPK-HNNXBMFYSA-N 338.476 5.115 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610361402 COXGFFSELGWBRU-IRXDYDNUSA-N 334.463 5.053 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(Cl)c(Cl)c1Cl 726365897 PWPWMPFRUWMSRW-UTCJRWHESA-N 347.028 5.591 30 20 EKED CC(Cc1ccsc1)=NNc1nc(Cl)c(Cl)cc1Cl 729635583 BXAFETZQACPVNC-UHFFFAOYSA-N 334.659 5.134 30 20 EKED O=C(/C=C/c1cnn2ccccc12)c1ccc(-c2ccccc2F)s1 729644495 WGHRPVMWDXTZLI-CMDGGOBGSA-N 348.402 5.098 30 20 EKED CCSc1cccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1 733753790 NXOBAEZUHNQIHI-UHFFFAOYSA-N 347.896 5.133 30 20 EKED Cc1ccc(-c2ncc(/C=C3\CCOc4ccccc4C3=O)s2)cc1 734304382 IFGUSJRYBWUDAQ-FOWTUZBSSA-N 347.439 5.167 30 20 EKED CC(C)[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 734708315 CTASMCVELLJOAV-SJORKVTESA-N 338.451 5.247 30 20 EKED Cc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc(C)c1O 734982010 VICFOPONPVXXPX-BAQGIRSFSA-N 334.387 5.220 30 20 EKED C#CC[C@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccccc1 773116364 RIORVXIUZWSBBQ-UZLBHIALSA-N 333.431 5.165 30 20 EKED C=CCC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 775462891 GAFBLSFELIUEGX-KRWDZBQOSA-N 330.815 5.045 30 20 EKED O=C(/C=C\c1cc(-n2ccnc2)cs1)c1cc2ccccc2s1 780187362 DLBMQTMWUFLIHY-WAYWQWQTSA-N 336.441 5.045 30 20 EKED C[C@@H](NCc1ccc(Cl)nc1)c1ccc(-c2cccc(C#N)c2)cc1 782382154 QGHRSATUCKEGTL-OAHLLOKOSA-N 347.849 5.124 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1ccc2ccccc2n1 796744952 CPPREINIBKFZKN-OWYHZJEWSA-N 332.447 5.018 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1cc(F)ccc1F 797156132 ANACOANLHZOMNO-SOFGYWHQSA-N 345.345 5.124 30 20 EKED CCCc1occc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 798394103 CDMVDVNYOROOKB-HXUWFJFHSA-N 344.414 5.140 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@]3(C)CC=CCC3)n2)cc1 835067249 CVSHENKDPSJABD-JXFKEZNVSA-N 336.460 5.041 30 20 EKED C[C@@H](CN(C)C(=S)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1 863230181 FWSZPYIDCOWMLH-ZDUSSCGKSA-N 349.931 5.057 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)cc1 915087524 UPJDNSBIJBYWOH-VRBBWPEWSA-N 344.458 5.107 30 20 EKED N#CC1(C(=O)OCc2sc3ccccc3c2Cl)CCCCC1 920023559 VXKPWWCAQLBEJW-UHFFFAOYSA-N 333.840 5.072 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)N[C@H]1CCCC(F)(F)C1 925562002 FKEJWGIAWHYWHZ-JTQLQIEISA-N 341.286 5.208 30 20 EKED CCCCCCCC[C@H](C)C(=O)Nc1ccc2c(C(=O)O)c[nH]c2c1 1776786156 SJRWEEBIMJLOSZ-AWEZNQCLSA-N 344.455 5.191 30 20 EKED Cc1ccc(-c2cccc(/C=C\C(=O)c3csc(C(=O)O)c3)c2)cc1 1777429646 BBKCMLIPZSFXMH-YFHOEESVSA-N 348.423 5.318 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 90665778 YWCDHEWNWSRGMW-YOEHRIQHSA-N 341.524 5.445 30 20 EKED Cc1cc(C)cc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)c1 118173691 UJIMZOVOXQFJME-AWEZNQCLSA-N 335.432 5.078 30 20 EKED CCCCc1nc(CNc2ccccc2SCCC#N)cs1 172905609 VLCRJDDIYSFNSM-UHFFFAOYSA-N 331.510 5.104 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1 177764669 JECWQHKVXNATNN-GOEBONIOSA-N 326.465 5.027 30 20 EKED CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 185223405 XLUHYFYPDSIJBU-JKSUJKDBSA-N 345.512 5.267 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2ccc3oc(CC(C)(C)C)nc3c2)CCC1=O 328960635 PNYABZBSRJMQOB-CHWSQXEVSA-N 342.439 5.010 30 20 EKED C=CCc1cccc(C(C)C)c1NCc1csc([C@@H](C)OC)n1 352563680 WXAGHLQLLUADFG-CQSZACIVSA-N 330.497 5.315 30 20 EKED CC[C@@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1 447533645 YBRCSWNDKKAGGQ-QZTJIDSGSA-N 332.369 5.293 30 20 EKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1sccc1C#N 485002287 AZPGGLDQPHAVLY-MRXNPFEDSA-N 346.455 5.023 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1ccc(C#N)cc1 509656256 UWKLYURBPLKKEB-LSDHHAIUSA-N 338.476 5.191 30 20 EKED COc1ccc([C@H](Nc2cccc(OCCCC#N)c2)C(C)C)cc1 514623527 OHDNCTALLOSDBQ-OAQYLSRUSA-N 338.451 5.187 30 20 EKED CCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518752357 OECVJVJLDHJXMA-HNNXBMFYSA-N 337.423 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)c(Cl)cn1 529135546 JVPWIIMHGOXGOW-UHFFFAOYSA-N 342.870 5.077 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)N(C)CCC(C)(C)C#N)cc1 538468614 FSVKFSLGSVMXPM-QGZVFWFLSA-N 336.479 5.295 30 20 EKED CC(C)[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 539609102 DXYBOXQCTRQLJL-BLVKFPJESA-N 332.369 5.023 30 20 EKED N#CCCCOc1cccc(NC2CC(c3cc(F)cc(F)c3)C2)c1 569391240 GMHPPWWWZGYILJ-UHFFFAOYSA-N 342.389 5.005 30 20 EKED N#CCCC[C@@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1 570150347 YUCCIAHBNNQSRL-XMMPIXPASA-N 340.470 5.878 30 20 EKED CCCOc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 582560559 MHEDHSWRLICLNC-XMSQKQJNSA-N 336.479 5.561 30 20 EKED C=CCN(CC(F)(F)F)C(=O)c1sc2cc(C)ccc2c1Cl 591011961 IBPTYCMLNIEYLK-UHFFFAOYSA-N 347.789 5.054 30 20 EKED C=CC1CCN(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)CC1 601132976 PDHDBUJMWUUJIN-UHFFFAOYSA-N 340.398 5.048 30 20 EKED C[C@@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 609970487 JXRRTBAZQXQLFB-CQSZACIVSA-N 348.427 5.154 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)CC(F)(F)F 682777532 LYSNVMSYMZKMEI-UHFFFAOYSA-N 342.405 5.391 30 20 EKED Cc1ncccc1/C=C/C(=O)c1ccc(Oc2ccccc2)c(F)c1 728787840 UCUCWWOFRBTNNH-PKNBQFBNSA-N 333.362 5.218 30 20 EKED Oc1ccc2ccccc2c1C=Nc1cccc(Oc2ccncc2)c1 732621033 AZVNUJZLPHPQLQ-UHFFFAOYSA-N 340.382 5.483 30 20 EKED C=CCCCCCN(C)C(=S)Nc1ccccc1-c1ccccc1 739455403 BAXXXQQNQKZTLJ-UHFFFAOYSA-N 338.520 5.729 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1nccc3ccccc13)CO2 740765296 VMADBNZVNIQKQA-SFQUDFHCSA-N 329.399 5.017 30 20 EKED COc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3)cc2)cc1C#N 742366253 QGLCHUJEEACFCY-KRWDZBQOSA-N 342.442 5.085 30 20 EKED COc1ccccc1/C=C/C=C/C(=O)c1cc(Cl)sc1Cl 744868985 OBUSCVYAEFYJSA-JHMJBTLWSA-N 339.243 5.516 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)cc(Cl)c2)cc1 755705999 QEGCPENISZSSQE-KMSCOEIWSA-N 346.213 5.180 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc2cc(OC)ccc2c1)c1ccccc1 773115133 LRPDVTWZTGASCO-HXOBKFHXSA-N 329.443 5.264 30 20 EKED O=c1[nH]ccc2cc(NN=C3CCCC[C@@H](c4ccccc4)C3)ccc12 789076443 JUFYOZIAADKUEL-QGZVFWFLSA-N 345.446 5.044 30 20 EKED C=CCC(CC=C)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904454791 RPWOCXYWBNXBPF-UHFFFAOYSA-N 333.391 5.160 30 20 EKED CC(=O)Nc1cccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)c1 917516976 FZKJVUPGWSMWME-ZHACJKMWSA-N 347.439 5.270 30 20 EKED CCc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc1C 66800220 MUSDWFZEYPWABV-LBPRGKRZSA-N 344.505 5.266 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 75416190 NELASFPBDHDJQJ-LBPRGKRZSA-N 331.466 5.095 30 20 EKED Cc1cc(C)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 90560338 OKRIFNWLWVEDEY-CQSZACIVSA-N 338.476 5.116 30 20 EKED CC(C)CN(CC(C)C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108531433 YCKVKQRERHCXBH-INIZCTEOSA-N 347.528 5.084 30 20 EKED Cc1c([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)oc2ccccc12 180539939 VFUXCPMOTHCMCB-HZPDHXFCSA-N 334.419 5.055 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NCc1ccc(O[C@H](C)C#N)cc1 236622596 XDTYWBCJCCGFON-XMSQKQJNSA-N 336.479 5.163 30 20 EKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 255146110 OQMJHNHYDGUBDS-WTQUMQLASA-N 344.439 5.090 30 20 EKED Cc1ccc(N=C(O)C2CC2)cc1N=C(O)C[C@@H]1C[C@H]2CC[C@H]1C2 328753411 DHCBNQRRQVLVSF-BPUTZDHNSA-N 326.440 5.407 30 20 EKED OC1=Nc2ccc(/C(O)=N/[C@H]3CCCCC34CCCC4)cc2SC1 329623291 NUKGLGOBZQPHGN-INIZCTEOSA-N 344.480 5.188 30 20 EKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCC1CCCC1 443833939 IAOFGRVERPBEIK-UHFFFAOYSA-N 336.435 5.045 30 20 EKED C=CCn1c(S[C@@H](C)c2cccc(C)c2)nnc1-c1ccccc1 462982354 VDIPTBSWTQORKA-INIZCTEOSA-N 335.476 5.293 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(F)ccc1F 475570566 TUFXWRKOWVNSNX-UHFFFAOYSA-N 344.405 5.138 30 20 EKED C=C(C)[C@H](NCc1cnc(C2CCCC2)s1)c1ccc(F)c(F)c1 479408533 HQNUPUXRJXSGLL-SFHVURJKSA-N 348.462 5.486 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C)cc1F 479719405 NQPSRJKJVVZIJA-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C=C[C@H](CC(=O)N(CC)c1nc2ccccc2s1)c1ccccc1 534009885 KGOARSPUUBXKPR-OAHLLOKOSA-N 336.460 5.009 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)cc(Cl)c1 556611245 UVVYWUGUXDXUAM-LBPRGKRZSA-N 331.246 5.205 30 20 EKED CC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(C)cc1 568455722 WMIZXVIQHFKKJC-SFHVURJKSA-N 332.369 5.126 30 20 EKED C=C(C)COc1cccc(NC(=O)c2c[nH]c3cc(Cl)ccc23)c1 589553015 UNMLBZLITHWNRX-UHFFFAOYSA-N 340.810 5.029 30 20 EKED N#Cc1ccc(NC(=O)c2cc3c(Cl)cccc3s2)c(Cl)c1 610896483 BPGYRPCYQAZXII-UHFFFAOYSA-N 347.226 5.332 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc(-c3ccccc3)cc2C)c1 726457376 NXBQAPZMTFQYSA-UHFFFAOYSA-N 342.467 5.452 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccccc2-c2ccccc2)c1 750985044 QDQLCBGCNWCFIE-UHFFFAOYSA-N 328.440 5.144 30 20 EKED CC(C)(C)OCc1ccc(N=Cc2cc3ccccc3nc2O)cc1 752152837 SOYTXDHGGCQONG-UHFFFAOYSA-N 334.419 5.006 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc(Br)cc1 760264729 NVAUTRBFBYFGPT-CMDGGOBGSA-N 348.265 5.069 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1ccc(C(F)(F)F)cc1 772805502 IGIQCYBGPMAQOU-JXMROGBWSA-N 327.305 5.150 30 20 EKED CCCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1cnc2ccccc2n1 792109045 FKUXIHUQRZULTO-IIBYNOLFSA-N 337.467 5.193 30 20 EKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NCC1CCC(C#N)CC1 799726359 OASQNDJSWFUWOK-WXLSXGNJSA-N 338.417 5.117 30 20 EKED C=CC[C@H](NCc1sc2c(Cl)cccc2c1C)c1ccncc1 815124951 PJPILAXWFUVWEK-KRWDZBQOSA-N 342.895 5.665 30 20 EKED CCCCCCCCC(=O)Nc1cccc(C(=O)N2CCCCC2)c1 917778220 GXLDLBSUMTUWKJ-UHFFFAOYSA-N 344.499 5.002 30 20 EKED CCCC#Cc1nc(C#CCCC)c(Cl)c(-c2ccc(C)cc2)n1 98178007 GGMKEFMQHSNJOF-UHFFFAOYSA-N 336.866 5.409 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCOC1CCCC1 191426703 IAIMKLOJCIYIHI-UHFFFAOYSA-N 344.499 5.009 30 20 EKED N#CCCCOc1cccc(NCc2c(Cl)cccc2Cl)c1 237844213 JHZKYPLBTAQUKC-UHFFFAOYSA-N 335.234 5.288 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2nc3c(ccc4ccccc43)s2)CCC1=O 329386136 POCZWEMTWARQAO-YPMHNXCESA-N 338.432 5.043 30 20 EKED CCc1nc2c(s1)[C@@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340448367 RSTARFZBMXNRDX-SJORKVTESA-N 339.508 5.108 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340448766 KLMUODIKDVBPEV-PMACEKPBSA-N 328.406 5.441 30 20 EKED C[C@H](SCc1csc(-c2ccco2)n1)c1cccc(C#N)c1 443149212 WPLJVDVFWUEOAM-LBPRGKRZSA-N 326.446 5.269 30 20 EKED CCC1(C(=O)Nc2ccccc2SC[C@H](C)C#N)CCCCC1 461015438 NBECMPIMZJQWCE-OAHLLOKOSA-N 330.497 5.237 30 20 EKED N#C[C@H](C(=O)c1cccc2ccsc12)c1nc2ccccc2s1 467832757 CZGUMHUHFLPGAY-CYBMUJFWSA-N 334.425 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccc(F)cc1 476162634 ULUBWEMXTCOERZ-INIZCTEOSA-N 339.454 5.810 30 20 EKED Cc1ccc([C@H](Nc2ccc(Cl)cc2C#N)c2ccccn2)cc1 480581757 RWNWYYVJYONDQV-FQEVSTJZSA-N 333.822 5.117 30 20 EKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1C1CC1 481898589 AMKNQRJUYDBQAA-UHFFFAOYSA-N 347.462 5.187 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 489065474 ALJUQEHMOXMNAN-HXUWFJFHSA-N 344.414 5.172 30 20 EKED CC(C)[C@H](NCc1ccccc1C#N)c1cccc(C(F)(F)F)c1 538158121 NYRGRWMTXQIULR-SFHVURJKSA-N 332.369 5.064 30 20 EKED CCSc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 538508951 OYGKZRKDAPCAFR-ZIAGYGMSSA-N 328.456 5.221 30 20 EKED C=CCC[C@H](Nc1cc(OC)c(C(C)C)c(OC)c1)c1ccco1 560548839 JJPXETYGJURQBC-INIZCTEOSA-N 329.440 5.540 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(SC2CCCCC2)cc1C 578734652 LLMSQLIXWZNVAT-IBGZPJMESA-N 330.497 5.298 30 20 EKED N#CC1(c2ccc(CN[C@H](c3ccc(F)cc3)C3CCC3)cc2)CC1 594921727 RYXXAOZXFSAWTC-NRFANRHFSA-N 334.438 5.012 30 20 EKED C[C@H](Nc1cccc(COC2CCCCC2)c1)c1cccc(C#N)c1 600851367 ZXFNGRRXTBTDQW-KRWDZBQOSA-N 334.463 5.581 30 20 EKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2cccc(C#N)c2)c1 609805894 MKOGDEOQXDQBOV-HXUWFJFHSA-N 333.435 5.016 30 20 EKED CCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@@H](CC)c1ccccc1 610356853 BAEVREWCIFTCFB-UWJYYQICSA-N 349.478 5.192 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)C1CCCCC1 726317817 DUCOKKVRSIVPJE-HIFRSBDPSA-N 326.465 5.079 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@H]1c1ccccn1 726884916 RVOWKTRANDNYMR-QGRTWZNFSA-N 328.500 5.442 30 20 EKED COc1ccc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)cc1C#N 742374301 MQFISAWWECGHSE-IBGZPJMESA-N 342.870 5.097 30 20 EKED N#C[C@@H](C(=O)CCCC1CCCC1)c1nc(-c2ccccc2)cs1 744036708 HJBARSZOQNJLOX-KRWDZBQOSA-N 338.476 5.347 30 20 EKED CC(C)Sc1cccc(Cl)c1C=NNc1ccc2[nH]ncc2c1 786035516 BPEPEWWRTKLEQE-UHFFFAOYSA-N 344.871 5.163 30 20 EKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(C3CCCC3)cc2)c1 812755850 DUFLVRYXWPBKQD-JOCHJYFZSA-N 348.490 5.315 30 20 EKED CC(C)(C#N)[C@@H]1CCCC1=NNc1ccnc2cc(Cl)ccc12 814693657 BPEDXLWYEZPPRS-CQSZACIVSA-N 326.831 5.006 30 20 EKED CCCCCCCCOCc1cccc(NC(=O)N2CCCC2)c1 920836234 DHQQTJRXEZAKOT-UHFFFAOYSA-N 332.488 5.191 30 20 EKED C=CCCCCCCCCCNc1c(C(=O)O)nnc2ccccc12 1776172477 LQBMPZSGKMWPNU-UHFFFAOYSA-N 341.455 5.047 30 20 EKED C=CCN(Cc1cccs1)C(=O)C(c1ccccc1)c1ccccc1 60677823 NYGNJTRKHWCCMC-UHFFFAOYSA-N 347.483 5.095 30 20 EKED C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 189784744 RAZKDVVXRXSVJU-LLVKDONJSA-N 341.823 5.115 30 20 EKED C/N=C(/O)c1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1C 328974689 BBBMLNGKANCNLA-USXIJHARSA-N 328.456 5.124 30 20 EKED COc1cc(N=C(C)O)ccc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329209886 ZGHXRSUVQYAEBO-BHYGNILZSA-N 344.455 5.498 30 20 EKED Cc1cc2occ(/C(O)=N/[C@@H]3CCOC4(CCCCC4)C3)c2cc1C 329974407 DANFIJFVPNCZNV-MRXNPFEDSA-N 341.451 5.236 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCC#Cc1ccc(Cl)cc1 443541997 MERNFCPVUYTUIE-HNNXBMFYSA-N 340.879 5.055 30 20 EKED C=C(C)[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc(F)c(F)c1 481620542 INTJBFZKJUKCTC-KRWDZBQOSA-N 336.451 5.126 30 20 EKED Cc1nc(C(C)C)sc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 540275297 YLNCLGQDLWWHEZ-UHFFFAOYSA-N 347.509 5.058 30 20 EKED COc1ccc([C@@H](CCC#N)NCc2c(Cl)cccc2Cl)cc1 576579623 OVBVOGLWVZISJD-GOSISDBHSA-N 349.261 5.137 30 20 EKED C[C@H](SCc1nc(C#N)cs1)c1cccc(C(F)(F)F)c1 594912017 SPKJKOQTLRSBDV-VIFPVBQESA-N 328.384 5.028 30 20 EKED C[C@H](Nc1ccccc1O[C@@H](C)C(F)(F)F)c1cccc(C#N)c1 600850558 CQRRGBSMRUYVSG-STQMWFEESA-N 334.341 5.061 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(C)c3cccc(C#N)c3)sc2c1 609149709 FLIVIKADHXSBCY-UHFFFAOYSA-N 340.835 5.011 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 610089377 SYDWUMNCIJLZRX-MRXNPFEDSA-N 346.861 5.729 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]2CC[C@@H](C1)S2 626534669 YBUPXDROENVOOV-SJORKVTESA-N 344.524 5.040 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NCc1ccc(C#N)cc1F 725794303 AJWFYGWJAUZHJA-UHFFFAOYSA-N 328.456 5.509 30 20 EKED CC(=NNc1ccc(C#N)cc1)c1sc(-c2ccc(C)cc2)nc1C 727651093 HUXLTQCMNUMRCL-UHFFFAOYSA-N 346.459 5.135 30 20 EKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1ccc(F)cc1 735233372 UICFIYVZNUKZMZ-GFCCVEGCSA-N 335.831 5.376 30 20 EKED CC(C)(C#N)CCCOC(=O)c1ccc(C2SCCCS2)cc1 782114165 YOLPNZDCENAKOR-UHFFFAOYSA-N 349.521 5.042 30 20 EKED C[C@H](C#N)Oc1ccc(CN[C@H]2CC(C)(C)CCc3ccccc32)cc1 799345219 VTAMXOUVRGMYTN-VGSWGCGISA-N 348.490 5.171 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1O 815597745 FEFVAGARSPHOHT-GUYCJALGSA-N 348.368 5.107 30 20 EKED Oc1ccc2ccccc2c1/C=N/C[C@@H]1CCCO[C@H]1c1ccccc1 920387157 MGFPYEFLCHBVMB-XETGBZQASA-N 345.442 5.132 30 20 EKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 920790720 KJLLVLXMBTXGTN-YRGRVCCFSA-N 346.883 5.342 30 20 EKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc2oc(C(=O)O)cc2c1 1777559854 MOWFEOIHGSHFFI-VURMDHGXSA-N 346.338 5.082 30 20 EKED Cc1nc(SCCCC#N)c2cc(-c3ccccc3)sc2n1 6114389 YZWRZCKCDOXZQU-UHFFFAOYSA-N 325.462 5.063 30 20 EKED Cc1nc(SCc2ccc(C#N)cc2F)n(C2CCCCC2)c1C 10871139 KRUNYGHQHDBGFY-UHFFFAOYSA-N 343.471 5.308 30 20 EKED CCCN(C(=O)Nc1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 65029353 LBKWCXLLEDOAOF-HNNXBMFYSA-N 347.418 5.310 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N(CCC#N)CC2CC2)c(C)c1 78534669 PJTBKRLNYSQPBF-OAHLLOKOSA-N 345.512 5.043 30 20 EKED CC(C)(C)C1C/C(=C/c2cncs2)C(=O)/C(=C/c2cncs2)C1 129885240 YDHKSQLTUBAREV-VOFKWTQNSA-N 344.505 5.092 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)s1)c1cccc(C(F)(F)F)c1 176960790 QZVOSIIUCZZLLH-INIZCTEOSA-N 338.398 5.125 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CNc1c(C)cccc1C 188060436 KNUNSUSJLSUZQM-UHFFFAOYSA-N 336.479 5.206 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1sccc1C 189884406 HTSNQEVUSUZQLE-ZWKOTPCHSA-N 339.504 5.651 30 20 EKED CC(C)CCOc1ccc(NCc2ccc(O[C@H](C)C#N)cc2)cc1 236580990 XHQRTLJXHMLROV-QGZVFWFLSA-N 338.451 5.014 30 20 EKED CC(C)c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 432475963 LFXJNCVLILLSCY-HXUWFJFHSA-N 335.451 5.367 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)C1CCCCC1 438047781 DVUIBUFXUVADMS-GJZGRUSLSA-N 345.512 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1CC(C)C 475564482 SYNPQQFWYNQJBK-GOSISDBHSA-N 328.500 5.581 30 20 EKED C=C(CNC(=O)Nc1cccc(CCC(F)(F)F)c1)c1ccccc1 477186074 HWKKQOPKXMSBKG-UHFFFAOYSA-N 348.368 5.016 30 20 EKED CCCc1cc(C(=O)Nc2ccccc2SCCC#N)sc1C 519403316 GSIKSSRUFKMWOF-UHFFFAOYSA-N 344.505 5.267 30 20 EKED C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)c1ccccc1Cl 525380446 QBCSLPPSAGXHSD-GOSISDBHSA-N 334.246 5.165 30 20 EKED C=C(CC)CSc1nnc(COc2ccc(Cl)cc2Cl)o1 538010373 BBLMXUVUVUJWHS-UHFFFAOYSA-N 345.251 5.014 30 20 EKED C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)c(F)c1 540708565 ZLCKNHWKGHVFAX-ORAYPTAESA-N 328.406 5.274 30 20 EKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)c1cccc([N+](=O)[O-])c1 552503612 GOIDNRDIXMDDCL-LBPRGKRZSA-N 336.844 5.059 30 20 EKED Cc1cc2cc([C@H](C)N[C@H](CCCC#N)c3ccccc3)oc2cc1C 556204379 GDSFBKZARPMNAP-GHTZIAJQSA-N 346.474 6.135 30 20 EKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(Oc2cccnc2)cc1 570719237 LYFNKQJPSFNPSA-QGZVFWFLSA-N 337.467 5.245 30 20 EKED COc1ccc([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)c2ccccc12 618807881 XVVRJGNZEZQNLP-QRQCRPRQSA-N 342.442 5.058 30 20 EKED N#Cc1cc(NC(=S)Nc2ccccc2-c2ccccc2)ccc1F 728176709 PZYZWZJGQYMCMX-UHFFFAOYSA-N 347.418 5.173 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2F)o1)c1ccc2c(c1)COC2 742435703 XFOBFFRIZFTKOG-CLFYSBASSA-N 334.346 5.012 30 20 EKED CCc1ccc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)o1 752237628 HQJKVSOQEHUAHR-VQHVLOKHSA-N 327.380 5.001 30 20 EKED C[C@H](C(=O)OCc1ccccc1C(C)(C)C#N)c1ccc(Cl)s1 768038735 DTXNFYPZLBMAON-LBPRGKRZSA-N 347.867 5.050 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@H]1C[C@H](O)c1cccs1 769729661 KICOIRVCJMDNQP-ROUUACIJSA-N 348.556 5.136 30 20 EKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1cncc(F)c1 799893923 WSMPHXHGNGEVTO-KWUPLBGHSA-N 335.300 5.082 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cn1 806567791 LSZZJYFLQIAGIM-XQRVVYSFSA-N 340.810 5.070 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cc(Cl)ccc1Cl 916137575 OJYBXLPFRPFKRH-YWEYNIOJSA-N 328.198 5.438 30 20 EKED CCCCCCCCCN(C)C(=O)c1cnc2onc(C(C)C)c2c1 918398152 XGGQIXVMIQXLKZ-UHFFFAOYSA-N 345.487 5.169 30 20 EKED Cc1nc(-c2cccc(N=Cc3cc(Cl)ccc3O)c2)cs1 920945355 WCLAAQFEINLZHE-UHFFFAOYSA-N 328.824 5.228 30 20 EKED CCc1nc(C)c([C@H](C)N(C)Cc2ccccc2C(C)(C)C#N)s1 135248470 YYCZOWPRMVDLFM-HNNXBMFYSA-N 341.524 5.008 30 20 EKED Cc1c([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)oc2ccccc12 180539955 VFUXCPMOTHCMCB-CVEARBPZSA-N 334.419 5.055 30 20 EKED C[C@@H](N[C@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 363696948 BKSVDMVJLOOLJE-IAGOWNOFSA-N 327.431 5.032 30 20 EKED C[C@@H](Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccc(C#N)cc1 439652258 VUNTUGYUCIWEEH-CQSZACIVSA-N 349.821 5.572 30 20 EKED C=CCC[C@@H](NC(=O)NCc1ccc(C(F)F)cc1)c1ccccc1 462204098 PHEONFZIMBNAQE-GOSISDBHSA-N 344.405 5.131 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@@H](c1ccccc1C)C(C)C 490685955 XMKYJMUZEORBMQ-HXUWFJFHSA-N 335.451 5.036 30 20 EKED C[C@H](NC(=O)CC(C)(C)C#N)c1ccccc1-c1ccc(Cl)cc1 498579995 JEJBMGXGOHDGIS-AWEZNQCLSA-N 340.854 5.124 30 20 EKED CC(C)c1ccc([C@@H]2CCCN2CCCC2(C#N)CCOCC2)cc1 499581951 JOWRIZKGENCOCF-NRFANRHFSA-N 340.511 5.047 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1F 512620987 UMJVSDMFAZXYBW-ORAYPTAESA-N 328.406 5.274 30 20 EKED C=C[C@@H](CC(=O)N(Cc1ccccc1)Cc1ccco1)c1ccccc1 534605444 NUXMZVWTRHILGJ-FQEVSTJZSA-N 345.442 5.168 30 20 EKED C=C[C@@H](CC(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 535452641 XYNFBKCECHPDEM-KXBFYZLASA-N 347.380 5.108 30 20 EKED CC(C)(C)c1ccc(C2CCC(NC[C@@H](C#N)CCC#N)CC2)cc1 560446527 QFARHVLUMSKBAL-FQVISZRSSA-N 337.511 5.043 30 20 EKED C=CCC[C@H](N[C@H](C)c1cc(C)on1)c1ccc(C(F)(F)F)cc1 569654117 YZELVQHMODXYJE-CJNGLKHVSA-N 338.373 5.360 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1Cl 585764827 OVXPYEJCEDYOTK-CABCVRRESA-N 342.870 5.411 30 20 EKED Cc1cc(C)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 601135873 ZZSPPAMTJFUBJG-LBPRGKRZSA-N 330.478 5.012 30 20 EKED C=CCCCN(C)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 605877050 DSEXPFVQMPQOEL-UHFFFAOYSA-N 342.870 5.115 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccsc1 609969147 STZZZXISVWDBBK-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C[C@@H](NCc1ccnc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 611396390 OIYIPECIGYYPKI-OAHLLOKOSA-N 347.849 5.124 30 20 EKED Cc1ccc(NC(=S)Nc2ccccc2SCCC#N)cc1C 730953068 MBIWJTLJCILFPJ-UHFFFAOYSA-N 341.505 5.118 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1ccc(-c2ccncc2)cc1 745990776 XUSZTONJEXULFC-XFSBKJJWSA-N 335.790 5.004 30 20 EKED CCC[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780156054 COFHZUOTWOVGFK-WMZOPIPTSA-N 342.483 5.303 30 20 EKED CC(C)(C#N)CCCOC(=O)Cc1cc2c(ccc3ccccc32)o1 784352582 RIIBMXCYLFCNCF-UHFFFAOYSA-N 335.403 5.002 30 20 EKED N#C[C@H]1CC[C@@H](COC(=O)c2sc3ccccc3c2Cl)CC1 809090799 KVINRACOTPPUAW-TXEJJXNPSA-N 333.840 5.041 30 20 EKED N#Cc1ccc(NC(=S)Nc2cccc(C3CCC3)c2)cc1Cl 812258724 GDLTUPUKRSDFSP-UHFFFAOYSA-N 341.867 5.288 30 20 EKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1 842940843 FKKJIJHGHQNBLE-IRXDYDNUSA-N 338.476 5.027 30 20 EKED CC(CCCCCCC(=O)O)=Nn1c2ccccc2c2ccccc21 1776112746 JINZXGZPJLLHFX-UHFFFAOYSA-N 336.435 5.444 30 20 EKED C=CCCC(=O)N(Cc1ccc(Cl)cc1)[C@H](C)Cc1cccs1 60364785 MQBJNRPABBIPTK-OAHLLOKOSA-N 347.911 5.328 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(OC(F)F)cc1 79724411 ZLNXBYDBSXAECH-CQSZACIVSA-N 346.377 5.144 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cccc1C 153581006 ZPLCNXJHGOSYBN-UHFFFAOYSA-N 334.872 5.238 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@H](CCC#N)c3ccccc3)oc12 182052439 VNXNFFBDINLCHS-VQIMIIECSA-N 348.446 5.527 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1cccc(Cl)c1 206844249 QGJOOKBGNAXEIJ-KTKRTIGZSA-N 325.820 5.360 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2ccc(OC)cc21 277650372 DQJHDUZMYQNVIX-HXUWFJFHSA-N 349.474 5.216 30 20 EKED Cc1ccc2ccccc2c1C[S@@](=O)CCCCC(C)(C)C#N 278061496 YZPAQYIQFNIVEO-QHCPKHFHSA-N 327.493 5.117 30 20 EKED CC(C)(C)OCc1cccc(CNc2ccc(Cl)cc2C#N)c1 303236525 XOYZOOLRAFDLNV-UHFFFAOYSA-N 328.843 5.139 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(Cl)c1SCC(F)F 303864001 PKLNJVBDXQEFCF-UHFFFAOYSA-N 348.846 5.127 30 20 EKED C[C@@H]1Oc2ccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)cc2N=C1O 328988152 HMUOFOKGTCZNRI-LQKXBSAESA-N 342.439 5.250 30 20 EKED CC(O)=Nc1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329000155 KXUGLSSISGDMQF-CWRNSKLLSA-N 348.874 6.142 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1nc2c(s1)CCCC2 340449430 VDUBXDXNBFCAND-WBVHZDCISA-N 339.508 5.108 30 20 EKED Cc1c(C(=O)Nc2cc(Cl)ccc2F)sc2ccc(C#N)cc12 428011209 OSLQQKQNLMUQIZ-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cccc3ccsc23)s1 430604518 QMEYETUYEQEFGU-ZDUSSCGKSA-N 340.473 5.145 30 20 EKED CC(C)(C#N)CCCCNC(C)(C)Cc1ccc(C(F)(F)F)cc1 444679462 MSJGVNIYVYGPLG-UHFFFAOYSA-N 340.433 5.336 30 20 EKED CC[C@@H](N[C@@H](CC(F)(F)F)c1ccccc1C)c1ccc(C#N)cc1 447576857 CYTUTTNBXIYPBW-MOPGFXCFSA-N 346.396 5.601 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1sccc1C 475571957 HWDACCWMAYAZLD-UHFFFAOYSA-N 342.508 5.572 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1ccc2ccccc2n1)c1ccc(F)c(F)c1 480680163 KLGRHTZQTGGUNA-LHSJRXKWSA-N 338.401 5.481 30 20 EKED CC(C)Oc1ccc(F)cc1NCc1ccccc1C(C)(C)C#N 486429631 CSUYMCDOMLHZEM-UHFFFAOYSA-N 326.415 5.026 30 20 EKED C=CC[C@@H](C(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 489041117 NTYISIKVMFMWLP-QGZVFWFLSA-N 333.353 5.090 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1(C)CCCCC1 510529301 KMDZPIUAZQQUCS-HNNXBMFYSA-N 330.497 5.380 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 536835229 WJYVEMKDDABNFW-XLIONFOSSA-N 330.431 5.642 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 539048645 RCXPHSFBJOQSTF-RDTXWAMCSA-N 334.385 5.459 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 556203276 JBQLJQSEEAQBLB-IFXJQAMLSA-N 347.289 6.079 30 20 EKED N#Cc1csc(CNc2ccc(Oc3ccc(Cl)cc3)cc2)n1 578404037 BMLUBMLEGSIOFE-UHFFFAOYSA-N 341.823 5.073 30 20 EKED CC1=C(C)C[C@@H](C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 592590835 BWRRRNQJEVULRA-BBRMVZONSA-N 328.481 5.013 30 20 EKED N#CCCCCN1CCc2sccc2[C@@H]1c1ccc(Cl)cc1 595767054 MDSNOORMPQYRAL-SFHVURJKSA-N 330.884 5.043 30 20 EKED CC[C@H](C)[C@@H](C(=O)Nc1sc(C)c(C)c1C#N)c1ccccc1 603444846 CQXJRFWMOYRLJG-YVEFUNNKSA-N 326.465 5.005 30 20 EKED C[C@H](c1cccc(C(F)(F)F)c1)N(Cc1ccc(C#N)cc1)C1CC1 603940617 WOEFOUFHXZHDGN-CQSZACIVSA-N 344.380 5.303 30 20 EKED Cc1ccc(F)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609176174 ASWJCGLSPNUKQJ-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 626633606 DMQVBIGSLYEJIK-PWRODBHTSA-N 331.459 5.063 30 20 EKED CC(C)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Cl)cc1 728713294 YLCPBEPPTZWRSX-QRWLVFNGSA-N 342.870 5.118 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C/C(=O)c2ccccc2)c1 731317758 BPIOLDQEFVWEDC-BUHFOSPRSA-N 339.394 5.033 30 20 EKED Cc1cccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)c1 747705684 FMYGULSSAHXIEM-UHFFFAOYSA-N 349.503 5.008 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C[C@@H](C)C#N)C1CC1 754431349 ICJQWWSNSJCBAN-ZDUSSCGKSA-N 345.512 5.042 30 20 EKED CC(C)COc1ccc(C=NOc2ccccc2C(F)(F)F)cc1 754712827 UKZGRRVSPMVHAM-UHFFFAOYSA-N 337.341 5.153 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1)c1cc2c(ccc3ccccc32)o1 776154182 PYJPOGIZDGODAY-OAHLLOKOSA-N 326.399 5.308 30 20 EKED CC(C)[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797569678 UVPKFFDSARSEPN-RDJZCZTQSA-N 340.492 5.057 30 20 EKED C[C@@H]1/C(=C/c2ccc(OCc3ccncc3)cc2)C(=O)c2ccccc21 809159849 XWSABSOKNLARIB-VOMLJKFNSA-N 341.410 5.044 30 20 EKED CCCCCCCCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1 887190992 SMCDFBMJLLJFCW-UHFFFAOYSA-N 342.439 5.221 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc(SC(F)F)cc1 912781010 QHBFKLJYDLBYIT-UHFFFAOYSA-N 330.359 5.006 30 20 EKED CCCN(CCC)c1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1 915224780 MEHNVDXNJQSFMV-SFHVURJKSA-N 335.495 5.035 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352019 IFTAVJXXLZXAFO-DYESRHJHSA-N 349.478 5.432 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1ccc(C(F)(F)F)cc1 915939803 QZXYDRVFXPCRQW-UHFFFAOYSA-N 329.325 5.090 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(-c2ccccc2)no1 926481296 SXOINSJLQONWEH-YLJYHZDGSA-N 345.446 5.427 30 20 EKED C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1 154327625 QIQSXNSPXUNHJX-IAGOWNOFSA-N 327.431 5.032 30 20 EKED C=C[C@H](CC(=O)N(c1ccccc1)c1nc(C)cs1)c1ccccc1 179882842 SULNYQMLJIYFPA-QGZVFWFLSA-N 348.471 5.476 30 20 EKED N#CCCC[C@@H](NC(=O)c1ccc(C2CCC2)cc1)c1ccccc1 352165222 CIKWSHPBGIGNMK-OAQYLSRUSA-N 332.447 5.119 30 20 EKED N#Cc1ccccc1S[C@@H](C(=O)Nc1ccccc1)c1ccccc1 439705041 HGWJLYKBYVKKHI-HXUWFJFHSA-N 344.439 5.030 30 20 EKED C[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 443608786 XOLQXDYOFSWAQS-ARFHVFGLSA-N 345.512 5.029 30 20 EKED CC[C@@H]1CCCC[C@@H]1N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458802301 PMXJHKUGSSHPKN-HOJAQTOUSA-N 341.499 5.032 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(OC)c(F)c1)c1ccc(F)c(F)c1 480682334 NZWIONQIPKKHCI-CWTRNNRKSA-N 335.369 5.081 30 20 EKED N#Cc1csc(CN2CCC(Sc3ccc(Cl)cc3)CC2)c1 539822215 KDOYGERVZQKLEG-UHFFFAOYSA-N 348.924 5.030 30 20 EKED C=C(C)CCc1noc(-c2c(-c3ccccc3Cl)noc2CC)n1 571447269 SULNPFFMEOEGAK-UHFFFAOYSA-N 343.814 5.116 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3N[C@H]1CCc2cc(C#N)ccc21 588958823 VLUDHFXCZSXBDH-UNMCSNQZSA-N 341.458 5.003 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1OC(C)(C)C 604629732 VOCFZBZRLMUDDT-UHFFFAOYSA-N 338.451 5.084 30 20 EKED C=CCN(C(=O)CCC(C)(C)C)c1nc(-c2ccccc2)cs1 606159114 FBTAUBUWAXZNEL-UHFFFAOYSA-N 328.481 5.155 30 20 EKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1F 656689060 NPFODOBCADRXBA-JTQLQIEISA-N 345.302 5.530 30 20 EKED O=[N+]([O-])c1ccc(NN=Cc2c(Cl)cccc2Cl)c(Cl)c1 727649196 AZTAJLRVJAGAOH-UHFFFAOYSA-N 344.585 5.001 30 20 EKED Cc1ccc2cc(C(=O)/C=C/c3cnc(-c4ccccn4)s3)oc2c1 754823911 GMODEVCLTFPVIE-BQYQJAHWSA-N 346.411 5.156 30 20 EKED CCCCCCC[S@](=O)Cc1csc(-c2ccccc2F)n1 764453598 INIQPKQDFOSTCT-QFIPXVFZSA-N 339.501 5.168 30 20 EKED CC(C)(CC#N)COC(=O)[C@H](Sc1ccccc1)c1ccccc1 764835524 YUWGSVXPPSEDMS-GOSISDBHSA-N 339.460 5.003 30 20 EKED CCCNc1ccc(C#N)cc1NCc1cccc(C(F)(F)F)c1 864036556 SCNHSUROVIBHHH-UHFFFAOYSA-N 333.357 5.011 30 20 EKED CCc1c(C)sc(NC(=O)c2cc(Cl)ccc2Cl)c1C#N 6122881 FERWTFCMRVPRMY-UHFFFAOYSA-N 339.247 5.050 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2ccc(F)cc2)n1 24284680 AGVDZYMXQSWHOL-JTQLQIEISA-N 340.345 5.273 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 54464626 OQMJHNHYDGUBDS-XOVFHRFOSA-N 344.439 5.090 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@@H](C#N)C3CCCCC3)o2)c(C)c1 115187866 VHAGUGLPHGCNQH-INIZCTEOSA-N 341.480 5.226 30 20 EKED COc1cccc2cc([C@H](C)N[C@H](CCC#N)c3ccccc3)oc12 182052963 HJRNUBPXUOIRBF-MAUKXSAKSA-N 334.419 5.137 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccccc1C 189897063 LYCHTJBKWNFIMT-UHFFFAOYSA-N 339.504 5.578 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1C 209743888 MXOCHWBEIAZKKQ-FPLPWBNLSA-N 325.458 5.385 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(C)C)nc1 427445554 CKNPRNGLTSKMCR-UHFFFAOYSA-N 337.467 5.006 30 20 EKED Cc1c(C(=O)Nc2ccc(F)cc2Cl)sc2ccc(C#N)cc12 431248109 QFUHTMGUJOADJC-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CC(C)(C#N)CCCCN1CCC(c2c[nH]c3cc(F)ccc23)CC1 444650145 NQHCURWCLACMEQ-UHFFFAOYSA-N 341.474 5.206 30 20 EKED CC(C)(C#N)CC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 447204967 WZQIFOLEWBMVRX-UHFFFAOYSA-N 328.799 5.011 30 20 EKED C[C@H](CC(C)(C)C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 454769468 UACUYBDVVONWPB-ZIAGYGMSSA-N 333.501 5.027 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC)c1cccc(Cl)c1 500384523 OSMCXRFKGKYDKC-QGZVFWFLSA-N 348.899 5.250 30 20 EKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(C#N)cc1)C1CC1 509914531 RMXVJKWKUYQDFQ-MRXNPFEDSA-N 340.426 5.077 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccc(F)cc2)cc1 517714508 BQIJBLNVMVKGKB-UHFFFAOYSA-N 347.349 5.134 30 20 EKED Cc1ccc(-c2ccc(C(=O)Nc3ccc(CC#N)cc3)c(F)c2)cc1 518555698 NKOKUVNHCGAFQR-UHFFFAOYSA-N 344.389 5.120 30 20 EKED CC(C)c1ccc(Sc2ccc(NC(=O)C(C)(C)C#N)cc2)cc1 522908474 FYQCPHXLEAHGAJ-UHFFFAOYSA-N 338.476 5.449 30 20 EKED C=CCC[C@@H](NCc1cccnc1C)c1ccc(C(F)(F)F)cc1 532727062 RCBJCCJPQSMBKJ-GOSISDBHSA-N 334.385 5.206 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccccc1Cl)c1ccccc1 534624816 VBNIYAHRBWPJKO-UZLBHIALSA-N 339.866 5.363 30 20 EKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)cc1 540333843 ZCWQMXLYEKOPKN-IBGZPJMESA-N 326.871 5.382 30 20 EKED C[C@H](NC[C@@H](C)C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 542012181 PJXWGLQRPFEMJU-KGLIPLIRSA-N 332.369 5.074 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C#N)c(Cl)c1 548607251 UVLZTSXHBOJIOD-UHFFFAOYSA-N 340.854 5.711 30 20 EKED CCc1cc(C#N)c(NC(=O)Cc2ccc(-c3ccccc3)cc2)s1 604029854 ICNWEVCBTDHSAM-UHFFFAOYSA-N 346.455 5.030 30 20 EKED C[C@H](NCc1cccc(Oc2ccccc2)c1)c1cccc(C#N)c1 610344679 FBXAAOPJMVTYHP-KRWDZBQOSA-N 328.415 5.201 30 20 EKED CC[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 735306218 KRIWELTVZVRLTO-KRWDZBQOSA-N 349.261 5.137 30 20 EKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1cc(F)ccc1F 751525580 XKEWRCVQQTVPOP-UTCJRWHESA-N 339.316 5.062 30 20 EKED CC[C@@H](NCc1ccc(N2CCC(C)CC2)cc1)c1ccc(C#N)cc1 774172892 FPGRTZYCXSOQQY-HSZRJFAPSA-N 347.506 5.035 30 20 EKED O=C1/C(=C/c2scnc2C2CC2)CSc2c(Cl)cccc21 782326250 NVYLHBNZYMDFBL-UXBLZVDNSA-N 333.865 5.046 30 20 EKED CSc1ccc(C(=O)/C=C/c2cnc(-c3ccco3)s2)cc1F 789143069 OCEOPWVLYGPZRY-AATRIKPKSA-N 345.420 5.160 30 20 EKED Cc1cccc2cc(C=NNc3cccc4ncccc34)c(Cl)nc12 915964725 KVPOKFJNQPCDPC-UHFFFAOYSA-N 346.821 5.191 30 20 EKED Cc1ccc(C(=O)/C=C\c2cccc(/C=C/C(=O)c3ccc(C)o3)c2)o1 96920963 RKOWHYKJCVTAPZ-PNQPDEHRSA-N 346.382 5.282 30 20 EKED N#Cc1ccc(CNc2ccc(Oc3ccc(Cl)cn3)cc2)cc1 172935149 YDNMPQKPSZCORI-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(CC(C)C)nc1C 189908324 HLXOVCFOTZQLIW-UHFFFAOYSA-N 340.467 5.286 30 20 EKED Cc1cccc([C@H](Nc2ccc(C#N)c(Cl)c2)c2ccccn2)c1 301863913 FNKNTWAPNHMTBD-FQEVSTJZSA-N 333.822 5.117 30 20 EKED CCCCN(C(=O)CCc1ccc(C#N)cc1)[C@H](CC)c1ccccc1 303535146 GPUWPMCFAJIHHQ-JOCHJYFZSA-N 348.490 5.271 30 20 EKED CC(C)=CCSc1ccccc1C(=O)Nc1ccc(F)c(C#N)c1 303908823 RIOJTPFZLPIVDT-UHFFFAOYSA-N 340.423 5.008 30 20 EKED C[C@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 352175568 VXZOJBAJEPOOHS-DZGCQCFKSA-N 346.883 5.056 30 20 EKED C=CCC[C@@H](NC(=O)N1CCc2sccc2[C@H]1C)c1ccccc1 435106025 ZFUKEPZHUHURMT-CRAIPNDOSA-N 340.492 5.084 30 20 EKED CC(C)(C#N)CC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 447389867 BJGSFQDAKJDCLG-UHFFFAOYSA-N 328.799 5.011 30 20 EKED COc1cccc2c(CN[C@@H](CCCC#N)c3ccccc3)cccc12 449338084 DVFFRWWNDDOGOE-QFIPXVFZSA-N 344.458 5.373 30 20 EKED Cc1cc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2cc1C 473495106 YVYHKHKEZKIDKH-CQSZACIVSA-N 346.411 5.149 30 20 EKED CC(C)C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1cccs1 475112107 DHOHYABNGSGSOB-KRWDZBQOSA-N 340.492 5.066 30 20 EKED C=CCCCC(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 481455489 KTYZBCLPCCUBFM-UHFFFAOYSA-N 339.826 5.178 30 20 EKED CC(C)Sc1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483195157 IJNAJSULZQARAX-SFHVURJKSA-N 346.455 5.225 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cc(OC)ccc1OC)c1ccccc1 539045950 DAPJEVFPLULSDR-OXQOHEQNSA-N 325.452 5.062 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 539048521 NMHVZMVNSMAJSH-KBXCAEBGSA-N 334.385 5.459 30 20 EKED C=CCCC(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 541269583 DMBSOYBABUPPCN-UHFFFAOYSA-N 340.423 5.316 30 20 EKED C=CCC[C@@H](NCC(=O)Nc1ccccc1C(C)C)c1ccccc1 553340619 OZANEYBYPQGGOG-HXUWFJFHSA-N 336.479 5.046 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1N1CCCCCC1 606938609 LPCIEPCJIDCJQJ-UHFFFAOYSA-N 343.515 5.277 30 20 EKED C[C@H](N[C@H]1CCCc2c1sc1ccccc21)c1cccc(C#N)c1 610829627 BPHSGIQGRZYMTA-LIRRHRJNSA-N 332.472 5.501 30 20 EKED Cc1ccc([C@H](NCc2ccc(C#N)c(Cl)c2)C2CCCC2)o1 619755383 GXQGKMFKOCJTMZ-LJQANCHMSA-N 328.843 5.134 30 20 EKED FC(F)Oc1ccc(NN=Cc2ccccc2-c2ccccc2)cc1 726426811 ILGPTJRKFOZJRP-UHFFFAOYSA-N 338.357 5.401 30 20 EKED CCCCCCCCC(=O)Nc1ccc(SC(=O)N(C)C)cc1 731419076 AWUFKBARXIJFJL-UHFFFAOYSA-N 336.501 5.149 30 20 EKED CCOc1ccc(O)c(C=Nc2ccc(Oc3ccc(C)cn3)cc2)c1 733205445 VNRPGIMBHAZZFS-UHFFFAOYSA-N 348.402 5.037 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cc(Cl)sc1Cl 747191344 CTESLQUUMRYHKV-XQRVVYSFSA-N 334.227 5.499 30 20 EKED C=C[C@H](CC(=O)OCc1nc(-c2ccccc2)oc1C)c1ccccc1 758911594 JRMMJKQTHVRIKU-QGZVFWFLSA-N 347.414 5.053 30 20 EKED Cc1cc(/C=C\C(=O)c2ccc(C#N)s2)ccc1Oc1cccnc1 762443880 SUBGSZJBDJAVLF-DAXSKMNVSA-N 346.411 5.012 30 20 EKED C#CC[C@@H](N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 773108368 WYZPSYIXRIYDNU-OXQOHEQNSA-N 346.499 5.534 30 20 EKED CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780147413 GYVUPBGFOAWLPO-FUHWJXTLSA-N 342.483 5.159 30 20 EKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCCC(C)(C)C 782902620 FPNHJHLGAAVTRT-UHFFFAOYSA-N 346.906 5.009 30 20 EKED Cc1ccc(-c2cccnc2)cc1N=Cc1cc2ccccc2nc1O 794832325 HIGSUOSTTLEOGQ-UHFFFAOYSA-N 339.398 5.061 30 20 EKED CC[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1cccc(Cl)c1O 848566551 AFWOVLLXOKZFPW-SFHVURJKSA-N 340.854 5.037 30 20 EKED CCc1oc2ccccc2c1C=NOCc1cc(-c2ccccc2)no1 913031431 KJSUTQMYFMEDRC-UHFFFAOYSA-N 346.386 5.201 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2)cc1 915087495 UFJMITLOISBZCL-HXUWFJFHSA-N 346.817 5.248 30 20 EKED N#C[C@@H](C(=O)CCC1CCCCC1)c1nc2cc(Cl)ccc2s1 917045351 YDRQBAYONACEFT-AWEZNQCLSA-N 346.883 5.486 30 20 EKED CC(=NNc1cccc(C(=O)O)c1)c1ccc(Oc2ccccc2)cc1 1776036755 HBGVCMYRUHXQBA-UHFFFAOYSA-N 346.386 5.013 30 20 EKED Cc1cc(C)c(N[C@@H](C)c2cccc(C#N)c2)c(Br)c1 159648155 CLJOKUWRDBEVIC-ZDUSSCGKSA-N 329.241 5.111 30 20 EKED Cc1ccc(NC(=O)C(C)(C)C)cc1N[C@H](C)c1cccc(C#N)c1 179845886 VYQRGVOWCVCSMW-OAHLLOKOSA-N 335.451 5.024 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303655445 GCRVQLFURUXBMJ-QGZVFWFLSA-N 349.478 5.320 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CC[C@H]4CCCC[C@@H]4C3)c(F)cc2CC1 328765258 GTILGACWCNXNSO-UMVBOHGHSA-N 344.430 5.554 30 20 EKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 430601554 DHLNNUKXBKRNRY-LLVKDONJSA-N 332.494 5.116 30 20 EKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@H]1c1nc2ccccc2s1 442683566 VRKFPFGITVAGOD-KSSFIOAISA-N 333.460 5.066 30 20 EKED N#Cc1c(Cl)cccc1SCc1nnc(-c2ccccc2)s1 463790815 VMTDYSYPCWPTHP-UHFFFAOYSA-N 343.864 5.022 30 20 EKED C=CCC(CC=C)C(=O)N1Cc2ccccc2C[C@H]1c1ccccc1 467518630 AYRPNBKFNVLTOQ-QFIPXVFZSA-N 331.459 5.081 30 20 EKED CCCC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 471337029 PABHPZUAJUBDRH-UHFFFAOYSA-N 334.419 5.178 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(C)Cc2ccccc2C1 475574355 WMNSZXJJVNUOCK-UHFFFAOYSA-N 348.490 5.218 30 20 EKED CCc1ccc([C@H](C)CC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487176306 LHPXIDTXNDRNPM-GCJKJVERSA-N 348.490 5.294 30 20 EKED Cc1c(C(=O)N(C)c2ccccc2C#N)oc2c1ccc1ccccc12 508106070 WSLMMQQRYJDBKS-UHFFFAOYSA-N 340.382 5.043 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512624975 LCAJRYXHTUMTRB-HUUCEWRRSA-N 342.483 5.610 30 20 EKED C=CCCCN(C)C(=O)Nc1cc(F)ccc1Oc1ccccc1 516116589 WETQTHATLOTZDP-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C=C[C@H](CC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1)c1ccccc1 536204804 PPDYXXWTABAVBS-YVWKXTFCSA-N 337.463 5.248 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1 538394589 GNNLERXLMKQBFQ-YJYMSZOUSA-N 328.406 5.274 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(Cl)c1Cl 551807284 DJUKNZZFFOIUCT-LBPRGKRZSA-N 331.246 5.205 30 20 EKED CSc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1Br 600853135 XBXKSKHYDRDDGB-LLVKDONJSA-N 347.281 5.216 30 20 EKED CCCCCCCCC(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1 747786301 ZWDGKINYEJDQLA-IFMALSPDSA-N 345.527 5.363 30 20 EKED CCCCCCCC[S@](=O)Cc1nc(-c2ccccc2)oc1C 790135246 OQPFUYHVXVJINT-QHCPKHFHSA-N 333.497 5.259 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2cccc3ccccc23)s1 797572678 FWFUTSBDARTONH-KRWDZBQOSA-N 348.471 5.013 30 20 EKED N#C[C@H](Cc1ccccc1)Sc1nc(-c2ccc(F)cc2)cs1 852999785 OSPKEEQJEGNJAS-INIZCTEOSA-N 340.448 5.176 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1cc(C(F)(F)F)co1 871827166 SYCKWTSLXGWXNY-NSHDSACASA-N 340.370 5.162 30 20 EKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c(C)c1 920065472 YGOPNBPHKWFMBW-XQRVVYSFSA-N 325.458 5.385 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1c[nH]c2cc(Cl)ccc12 920068346 MRRTUGWVVFODAQ-XBXARRHUSA-N 332.790 5.266 30 20 EKED Cc1c(NN=C2CCCCC[C@@H]2c2ccccc2)cccc1C(=O)O 1776089103 BQAKAEKGVPZCNO-GOSISDBHSA-N 336.435 5.209 30 20 EKED CCc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 25721472 JFPVEQLIOLMMRO-UHFFFAOYSA-N 326.399 5.040 30 20 EKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)CCCCC#N)s2)cc1 134212101 MPUSIVXIBKZJFH-MRXNPFEDSA-N 327.497 5.114 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)cc1 208009263 JKGQCEMUBDSEBV-OLXGIWCBSA-N 333.431 5.072 30 20 EKED C[C@@H](Nc1snc(Cl)c1C#N)c1cccc(Cl)c1Cl 301301802 VNSLXSIFCCOPTF-ZCFIWIBFSA-N 332.643 5.148 30 20 EKED CC(C)[C@@H]1CCC[C@H](/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)C1 330010907 HJBXJARAKORDGD-FPQWYMTMSA-N 334.504 5.083 30 20 EKED N#CCC[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccc1 358323733 BLLPRZQSDRGTNX-OOMBGRCJSA-N 343.474 5.025 30 20 EKED CC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(OC)cc1 360822286 PPRAOJZHXQZAKG-VXKWHMMOSA-N 334.463 5.075 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(C#N)cc2Cl)c(C)c1 426145364 ZRFJSZTZROLPJV-CQSZACIVSA-N 341.842 5.053 30 20 EKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc2ccccc2c1OC(F)F 453284265 GOFLIYRNWVAEIQ-DZKIICNBSA-N 344.405 5.174 30 20 EKED C=C(C)CNC(=O)c1oc2ccccc2c1CSc1cccs1 490038542 KKQLBMZTNZOLOK-UHFFFAOYSA-N 343.473 5.093 30 20 EKED C=C[C@H](CC(=O)N1CCC(c2ccccc2C)CC1)c1ccccc1 542564543 QCSVLIQOTZVGIG-LJQANCHMSA-N 333.475 5.061 30 20 EKED N#CCc1ccnc(NCc2ccc(-c3ccccc3Cl)s2)c1 545926856 BONDHTSLMNGBBN-UHFFFAOYSA-N 339.851 5.142 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccsc1 609969118 HUEPHMCYICAUMK-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(NC(=O)[C@H](C)CC(=C)C)cc1C 619323255 ABRHUBFUAKHFDZ-SJORKVTESA-N 342.483 5.077 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619755769 RYBJCNAONNNLDL-GFCCVEGCSA-N 349.261 5.115 30 20 EKED C(=NN=C1c2ccccc2-c2ccccc21)c1ccnc2ccccc12 731314373 KQXAFNNFZCYXLV-UHFFFAOYSA-N 333.394 5.087 30 20 EKED CCCCCC[C@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 741925405 PRXVJSUGTUIJDW-HOTGVXAUSA-N 332.513 5.483 30 20 EKED CCCCCCCC(=O)c1ccc(OCc2nc(C)c(C)o2)cc1 749675449 RFAAWTMKCKPCKQ-UHFFFAOYSA-N 329.440 5.414 30 20 EKED O=C1/C(=C\c2cocn2)CCCCCCCCC/C1=C\c1cocn1 790212285 SSJBFPMOPJXQQE-VRNBXGKJSA-N 340.423 5.223 30 20 EKED CC(=NNc1cccc(Cl)n1)c1csc(-c2csc(C)n2)c1 793175790 WANBJKZZQPOAFJ-UHFFFAOYSA-N 348.884 5.065 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)s1 802833575 OOMMFVDNYKFMFS-KLHDSHLOSA-N 344.524 5.223 30 20 EKED N#Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)c(C2CC2)c1 933844309 SAXIKGRAKHRNMF-IBGZPJMESA-N 349.434 5.178 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 192985557 DWLBDGXVAVEDBK-IFXJQAMLSA-N 328.843 5.044 30 20 EKED C[C@H]1C[C@H](C(O)=Nc2ccc3nc(C(C)(C)C)sc3c2)CCC1=O 328897374 CQMQIBAHFUZNSU-NWDGAFQWSA-N 344.480 5.187 30 20 EKED N#CCCCNC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 433826699 RDXDDYLONUISNM-UHFFFAOYSA-N 348.233 5.086 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCC#Cc1ccc(Cl)cc1 443540878 LXCPNVQLNZNQGN-OAHLLOKOSA-N 340.879 5.198 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1=CCC(C)(C)CC1 455572582 CBSWKARYVPWUHP-AWEZNQCLSA-N 328.481 5.156 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(SC)cc1OC)c1ccccc1 487497730 DHBNTROHINYHID-QGZVFWFLSA-N 341.476 5.106 30 20 EKED CC(C)(CCC#N)CNc1cccc(COCCc2ccccc2)c1 533219383 DMQUQTIBWRFJQE-UHFFFAOYSA-N 336.479 5.188 30 20 EKED CC(C)Oc1ccc([C@@H]2CCC[C@H]2NCC(C)(C)CCC#N)cc1 558247529 PVILYVJXARELEF-VQTJNVASSA-N 328.500 5.029 30 20 EKED COc1ccc([C@H]2C[C@@H]2[C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559860436 UNYQNVWYZZCWCZ-XCYUPCBOSA-N 348.490 5.212 30 20 EKED CC(C)(CCC#N)CN[C@H](Cc1cccc(F)c1)c1cccc(F)c1 566815071 RWLJFWMASSRHED-HXUWFJFHSA-N 342.433 5.168 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(Cl)c1 570067736 YRUITUZDESYGFV-HXPMCKFVSA-N 328.818 5.079 30 20 EKED N#CCCCCCC(=O)N[C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 588166429 WATPWBOZPUCAEP-RTBURBONSA-N 346.902 5.347 30 20 EKED C=CC[C@H]1CCN(C(=O)Nc2cccc(CSC(C)C)c2C)C1 599753873 XSCRRMROFGNCOO-INIZCTEOSA-N 332.513 5.067 30 20 EKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 604461348 GLAROCJUFHLFOO-MRXNPFEDSA-N 349.434 5.004 30 20 EKED C[C@H](SCc1cc(-c2ccc(F)cc2)no1)c1ccc(C#N)cc1 609825425 XBGPLKDXEVXRHP-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED N#C[C@@H]1CCC[C@@H](NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 618577740 CYFGQSBOMHJEFA-DGCLKSJQSA-N 342.792 5.020 30 20 EKED CCCC(C#N)(CCC)NC(=O)c1sc2ccccc2c1Cl 730093028 VZKOOTXCFYFAJM-UHFFFAOYSA-N 334.872 5.147 30 20 EKED C[C@H](CC#N)OC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 733709850 YTHQEORQQNWGDL-CYBMUJFWSA-N 345.851 5.091 30 20 EKED CC(=NNc1cnnc2ccccc12)c1ccc(-c2cccs2)cc1 733748270 OFFLGNNVQHVACS-UHFFFAOYSA-N 344.443 5.194 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(C)cc1 739144471 ZHFHCMRWMMQAPV-RDJZCZTQSA-N 348.471 5.365 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cccc(-c2ccncc2)c1 741472317 HDSOQAWKFNZUNM-XQRVVYSFSA-N 335.790 5.004 30 20 EKED O=C1/C(=C/c2cnc(-c3ccccc3)s2)Cc2cc(Cl)ccc21 742437152 JADDCSYFKITXER-GXDHUFHOSA-N 337.831 5.286 30 20 EKED C#CC[C@H](N[C@H](CC)c1ccc(OC(F)F)cc1)c1ccccc1 773113886 GQGBHZVZESVSCE-MOPGFXCFSA-N 329.390 5.093 30 20 EKED CCCC(C)(C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 786321759 IOXCYXZDEWXODD-GFCCVEGCSA-N 334.872 5.342 30 20 EKED CC(C)Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 796815786 GFBGBGLOANEXAV-CRAIPNDOSA-N 346.430 5.006 30 20 EKED Clc1cccc(C=NOCc2cccc3cccnc23)c1Cl 809833784 NEHAHIUMGVZLAN-UHFFFAOYSA-N 331.202 5.092 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2cscc2C(F)(F)F)c(Cl)c1 811691581 QNLOHRWVCNMFPI-RQOWECAXSA-N 341.741 5.188 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1nc(C)sc1C 916249237 WLTVVKZNJQUXHW-UHFFFAOYSA-N 348.686 5.556 30 20 EKED C=CCCc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC(CC(F)F)C2 931291046 USGNMOXVPVCBEI-IRXDYDNUSA-N 348.437 5.235 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc2cc(C)c(C)cc2o1 1776783097 XVVUFZUXRMOKIQ-SFHVURJKSA-N 345.483 5.343 30 20 EKED C=CCOc1ccc(/C=C(\Cl)c2nc3ccccc3o2)cc1OC 7914545 CMGIZMAWKITJJF-KAMYIIQDSA-N 341.794 5.138 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cccc2cccnc12 178391538 OMDPMKGHTULVJW-OAHLLOKOSA-N 333.460 5.241 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCC[C@H](OC)C1 282033322 YAUTVGPMZZIXOX-AEFFLSMTSA-N 329.484 5.072 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cc(C)sc2C)cc1Cl 303224227 WAVNEODPYKAHNA-CYBMUJFWSA-N 335.900 5.434 30 20 EKED CC(C)[C@H](C/N=C(/O)[C@@H]1CC12CCCC2)/N=C(/O)[C@@H]1CC12CCCC2 329992858 KTVUGLVSTSADGW-ULQDDVLXSA-N 346.515 5.085 30 20 EKED N#Cc1ccc(NC(=O)c2sccc2-c2ccccc2)c(Cl)c1 430352135 HCTLWFDAOOXSFV-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CCC[C@@H](NC(=O)N(CC=C)Cc1cccs1)c1ccccc1 435106109 ZNTZBMDDPQBWNF-LJQANCHMSA-N 340.492 5.153 30 20 EKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(C#N)c1 442794430 RZVTVNZLAIQEEU-MRXNPFEDSA-N 339.398 5.395 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 466426942 UKFPRICSSIHUQR-FZMZJTMJSA-N 333.781 5.004 30 20 EKED CC(C)(C)c1c(CC#N)nc2sc3c(c2c1-c1cccnc1)CCC3 469000581 NVJUGJMJOVMXKO-UHFFFAOYSA-N 347.487 5.211 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(OC)CCCCC1 475576980 CATQWKWGAIMUBF-UHFFFAOYSA-N 344.499 5.009 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 481575971 VBAPOCFCQKYNPG-UHFFFAOYSA-N 330.815 5.172 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1C 509736210 QUPRMHAOPGJARE-HZPDHXFCSA-N 349.434 5.003 30 20 EKED N#Cc1cccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 521813970 MVICYEQKBXTYNT-QFIPXVFZSA-N 346.861 5.285 30 20 EKED C[C@H](SCC(=O)Nc1cccc2ccccc12)c1ccc(C#N)cc1 522841017 HYFGIHBBNQMBQQ-HNNXBMFYSA-N 346.455 5.144 30 20 EKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2cc(C#N)ccc2C)cc1 531320553 VKPPPGHUUDVXFC-UWJYYQICSA-N 347.462 5.180 30 20 EKED C[C@H](N[C@@H]1CCCc2c1sc1ccccc21)c1ccc(C#N)cc1 532465304 WAKMIGZLPHEXCH-IFXJQAMLSA-N 332.472 5.501 30 20 EKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 552312949 DCKDPAURAHXZJY-OAQYLSRUSA-N 346.499 5.940 30 20 EKED CC(C)[C@@H](C#N)c1ccc(-c2ccccc2OC[C@@H]2CCOC2)cc1 592987212 XHACBYYTDMMDNM-DYESRHJHSA-N 335.447 5.032 30 20 EKED Cc1ccc(N(C(=O)[C@@H](C)CC#N)c2nc3ccccc3s2)c(C)c1 598810928 SKWFSBDFKGOHRI-AWEZNQCLSA-N 349.459 5.128 30 20 EKED Cc1cc(C(=O)N[C@@H](C#N)CC(C)C)sc1-c1cccc(Cl)c1 608822869 AQPXDAJHWLJBFP-OAHLLOKOSA-N 346.883 5.045 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(F)c(-c2cccs2)c1 618741454 GMDSAAOWURSMNW-FQEVSTJZSA-N 348.446 5.203 30 20 EKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccsc1 619747811 AQOPPDJRHFTHHS-MRXNPFEDSA-N 348.471 5.050 30 20 EKED Cc1ccsc1C(=O)/C=C/c1csc(-c2ccc(F)cc2)n1 733749514 YYSDPBMUCITJTC-VOTSOKGWSA-N 329.421 5.215 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 739144424 XMRXUCJMPYWXPZ-UZLBHIALSA-N 342.442 5.167 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(Cl)cc1Cl 746345543 GMMPQKYYUJFVSL-VURMDHGXSA-N 337.250 5.284 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1 766022954 SZYCFFUQUNNPGH-GCJKJVERSA-N 335.495 5.040 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1ccc(O)c(Cl)c1 768753951 ABKFZBXGHZBKSR-CMDGGOBGSA-N 341.819 5.065 30 20 EKED CCC(C)(C)c1ccc(NC(=O)c2ccccc2SCC#N)cc1 791188637 ZNBVOJGSKSWORU-UHFFFAOYSA-N 338.476 5.242 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792103690 LQYXDRBGEIXUDO-KWRJMZDGSA-N 346.817 5.168 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](F)CC1CCCCC1 793460025 GGNVDZMRBCJBAF-ZBFHGGJFSA-N 348.487 5.185 30 20 EKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Cl)c1 797568983 ZEZYNVBQLMCIJN-FZMZJTMJSA-N 346.883 5.074 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815636227 RDQZILVSJRNSOR-RTBURBONSA-N 342.870 5.521 30 20 EKED CC(C)(CC(=O)Nc1ccc([C@@H](F)C(F)(F)F)cc1)C(F)(F)F 882573672 FEZHRBLPTBZQKG-LLVKDONJSA-N 345.258 5.177 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1ccccc1F 917711266 AAUCXTVOKUQXKA-KHPPLWFESA-N 348.402 5.078 30 20 EKED CCCCCCCC(=O)N(Cc1cccnc1)c1ccc(F)cc1 917774763 QYCSLCDSEVKRKX-UHFFFAOYSA-N 328.431 5.114 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(/C=C\C(=O)O)cc1)CC2 1776374769 NOVMWEWBJSYOGR-FGMDVPKRSA-N 346.426 5.120 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(C)C 130331744 VQLGCJSGEMKJJM-UHFFFAOYSA-N 335.451 5.126 30 20 EKED C=C(C)[C@H](NCc1coc(-c2cccs2)n1)c1ccc(F)c(F)c1 187756510 RVKLCVNLLFXMMQ-KRWDZBQOSA-N 346.402 5.088 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1ccccc1 194559369 OFCDQDYCWVCEAY-QGZVFWFLSA-N 335.451 5.148 30 20 EKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cc2cc(Cl)ccc2o1 207714527 ZCJVBTLIPXZNCM-DJWKRKHSSA-N 333.170 5.341 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Cl)cc1F 302776156 ZHOMLWYIRBYEIA-UHFFFAOYSA-N 344.238 5.022 30 20 EKED C=CCCc1ccccc1NC(=O)[C@@H](C)SCc1ccccc1 410369121 AAFCICMDQCCUQC-MRXNPFEDSA-N 325.477 5.066 30 20 EKED C[C@H]1CC[C@@H](N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 429748835 CADUTCQGGIMVDR-MAUKXSAKSA-N 349.434 5.003 30 20 EKED CC#CCCCC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 466875740 ZIVPOGBLRHBRMK-UHFFFAOYSA-N 344.505 5.043 30 20 EKED CC(C)(C#N)CCCSc1nnc(-c2ccc(C(C)(C)C)cc2)o1 475936830 FZRSQSWVHCFHRD-UHFFFAOYSA-N 343.496 5.456 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 484850840 BZYPHOWQBWCJOO-UHFFFAOYSA-N 334.463 5.173 30 20 EKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 494560156 GCTPHNYFJQBUIU-SAPNQHFASA-N 347.462 5.055 30 20 EKED N#CCCN(Cc1ccco1)Cc1sc2ccccc2c1Cl 505746686 ZPSQLATYKFVXHO-UHFFFAOYSA-N 330.840 5.064 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc2c1CCC2 512939504 DZEXHTCBUPMAIG-UHFFFAOYSA-N 344.439 5.028 30 20 EKED C=CCC[C@H](NCc1ccc(Oc2ccccc2)nc1)c1ccco1 515625307 SSODWHRKFOKLTH-IBGZPJMESA-N 334.419 5.264 30 20 EKED C[C@H](SCCC(=O)Nc1ccc(Cl)cc1)c1ccc(C#N)cc1 522841213 MSODTFCGXDPZLN-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED C[C@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccc(C#N)cc1 531695881 QDOXIOUDQVLONO-DLBZAZTESA-N 327.431 5.032 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@H]1c1cc(C)ccc1C)c1ccccc1 534725331 GJZDVRCRJAMPIA-KNQAVFIVSA-N 333.475 5.327 30 20 EKED C=C[C@H](CC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)c1ccccc1 561133363 LRTQNODWJJHDEX-MSYGRNIXSA-N 345.486 5.141 30 20 EKED C=CCCCC(=O)N1CCC(c2c(Cl)cccc2Cl)CC1 570947781 QIZDCUWTMPYPOW-UHFFFAOYSA-N 326.267 5.056 30 20 EKED CC(C)(CCC#N)CNC(=O)c1cc2sc3ccccc3c2s1 584724812 KCEICWCLNYQJEE-UHFFFAOYSA-N 342.489 5.176 30 20 EKED N#Cc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)s1 589321356 BRFAMNCYQYGLIQ-MRXNPFEDSA-N 337.275 5.167 30 20 EKED CC(C)c1ccc(-c2nnc(S[C@@H](C#N)Cc3ccccc3)o2)cc1 608930211 QNHDQMHOBIFUIK-GOSISDBHSA-N 349.459 5.087 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1cc(Cl)ccc1Cl 726741163 DAMQDEKMOYQXTP-YVMONPNESA-N 331.198 5.208 30 20 EKED CC[C@@H]1CCCC(=NNc2nc(C(F)(F)F)nc3ccccc23)C1 734978561 MIIVABFIBJMYQJ-LLVKDONJSA-N 336.361 5.017 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(C[C@H](C)C#N)C1CC1 754431347 ICJQWWSNSJCBAN-CYBMUJFWSA-N 345.512 5.042 30 20 EKED C/C=C(/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC 764841765 YHPZQUGIVQORNH-LQDTWUIKSA-N 330.431 5.193 30 20 EKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 794926763 NXYBIUGKUVVNPL-FPYGCLRLSA-N 337.709 5.082 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1cnn(C2CCCC2)c1 799895219 FIAZEUNUXXQZHH-ZHACJKMWSA-N 349.459 5.018 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1c(F)cccc1Cl 809159183 KASSEQNLNUGZGT-VOTSOKGWSA-N 349.839 5.560 30 20 EKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(-c2ccccc2)cc1F 914733161 NMICYCLJWAESFV-QBFSEMIESA-N 342.373 5.016 30 20 EKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccc(O)cc1 916134840 KLPPDEVJBUSSEP-LUAWRHEFSA-N 347.395 5.158 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1 1776699939 IZVDEYFZUKKXRK-IWMPZKFUSA-N 336.431 5.411 30 20 EKED COc1ccccc1[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1 181942925 OVPKIXJBCYGOMQ-GAJHUEQPSA-N 342.442 5.007 30 20 EKED C[C@H](SCCC(=O)Nc1ccccc1Cl)c1cccc(C#N)c1 190891661 TYILCIOCZCYFAB-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED N#Cc1cccc(Cl)c1N1CCC(c2c[nH]c3ccccc23)CC1 303525290 VPNPYODWWGANFW-UHFFFAOYSA-N 335.838 5.077 30 20 EKED N#CCCCOc1cccc(N[C@H](c2ccccc2)C(F)(F)F)c1 462814414 PSYRCXWICKBPQD-QGZVFWFLSA-N 334.341 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(CC)cc1 476121030 FOYMJGCVBOQOSV-QGZVFWFLSA-N 335.491 5.843 30 20 EKED C=CCn1c(S[C@H](C)c2ccc(C(C)(C)C)cc2)nnc1C1CC1 499348682 HYTOSKJVKBAQOF-CQSZACIVSA-N 341.524 5.492 30 20 EKED Cc1cc(C)cc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 503219155 QOFIJQQWMCLSLM-OAHLLOKOSA-N 339.464 5.342 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4)cc3F)CC2)c1 519592468 UQMMCMZVJQERHZ-UHFFFAOYSA-N 342.417 5.143 30 20 EKED Cc1sc(NC(=O)C2(c3cccs3)CCCCC2)c(C#N)c1C 523102467 LCZZMIKFYJTIMV-UHFFFAOYSA-N 344.505 5.139 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CC/C=C\c1ccccc1 523112882 JZFNBOOWGKLKKF-POHAHGRESA-N 346.474 5.036 30 20 EKED CCSc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 551211856 YJWVUDDGYLERRZ-UTKZUKDTSA-N 338.520 5.884 30 20 EKED N#CCCN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 551935276 YRNZUEMPONZSKD-UHFFFAOYSA-N 344.389 5.053 30 20 EKED CC(C)[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 555095347 VYCHTRBWGYOCAI-SFHVURJKSA-N 332.369 5.064 30 20 EKED CSc1ccc(C)c(NCc2ccc(C#N)cc2C(F)(F)F)c1 564528143 FUIFHJIREDGXEW-UHFFFAOYSA-N 336.382 5.220 30 20 EKED C[C@@H](NCc1cc2ccccc2s1)c1ccc(C#N)cc1Cl 583038348 OCRYARJPWAAWCC-GFCCVEGCSA-N 326.852 5.277 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C 588309449 KTVRTCVJGAUCHR-INIZCTEOSA-N 342.405 5.010 30 20 EKED C[C@H](Nc1ncc(C#N)cc1Cl)c1cc(F)c(Cl)cc1Cl 608884809 AQIMJMGEKBRMIZ-ZETCQYMHSA-N 344.604 5.226 30 20 EKED N#CCOc1cccc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)c1 730150865 YJSQBNHCXHFKTQ-SEYXRHQNSA-N 339.394 5.152 30 20 EKED CC(C)Oc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1 741469205 KNZZVXVGPGKESF-DHZHZOJOSA-N 343.426 5.432 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)o1)c1ccc2c(c1)COC2 742437085 RHMLYSDYMQLJLH-VQHVLOKHSA-N 334.346 5.012 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC(C)C)c2ccccc2)c1 749129385 QRAAZEQZXVWHMA-RBBKRZOGSA-N 336.479 5.245 30 20 EKED Cc1ccccc1[C@H](NCc1ccc(N(C)CCC#N)cc1)C(C)(C)C 751152726 NUHHVNAKRDORQN-QFIPXVFZSA-N 349.522 5.222 30 20 EKED CC(=NN(Cc1ccccc1)c1ccccc1)c1cnn(C(C)C)c1C 787145370 QAZAVNHGDJAXRG-UHFFFAOYSA-N 346.478 5.203 30 20 EKED C[C@@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)cc1F 864023578 RLMIYZCTGPIRNU-MRXNPFEDSA-N 346.405 5.449 30 20 EKED CCCCCCc1ccc(C(C)=NNc2cccc(C(=O)O)c2)cc1 1776036784 PRUTYLDJLRSYFR-UHFFFAOYSA-N 338.451 5.344 30 20 EKED CC[C@H](C)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776698351 LJZZBQXZNWXKTF-SJPXOZHESA-N 348.442 5.501 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2sccc2-c2ccccc2)cc1 25437573 VGIIDEYLNYVSDA-UHFFFAOYSA-N 346.455 5.469 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(C#N)cc1 43170693 AYNWJAUYGZXWTG-MRXNPFEDSA-N 349.478 5.688 30 20 EKED C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccsc1 78080762 KWLGWIAQROGPQN-GFCCVEGCSA-N 338.457 5.090 30 20 EKED COc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)c2ccccc12 90665153 CQRQEMJFXNJLPX-HTAPYJJXSA-N 344.458 5.544 30 20 EKED CC[C@H](c1ccccc1)c1nnc(S[C@@H](C#N)C2CCCCC2)o1 115187843 XRPWJABWZOJRIA-SJORKVTESA-N 341.480 5.176 30 20 EKED C[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 122157212 HDDUKHIZNZHOFK-SJKOYZFVSA-N 328.868 5.099 30 20 EKED C=CCc1ccc(OCc2nc(-c3cccs3)oc2C)c(OC)c1 218156569 ZXVSEWHEFMIVBA-UHFFFAOYSA-N 341.432 5.028 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(C#N)cc1 237786347 BQKCHWGRYPPHKU-HXUWFJFHSA-N 332.472 5.002 30 20 EKED C[C@@H]1Cc2c(sc(NC(=O)c3ccoc3C3CC3)c2C#N)[C@@H](C)C1 410965374 BOSPKFQWHJYKGZ-QWRGUYRKSA-N 340.448 5.028 30 20 EKED Cc1cc(CN[C@H](CCC#N)c2ccccc2)ccc1C(F)(F)F 414358499 GXEXATZWXOWCBZ-GOSISDBHSA-N 332.369 5.149 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416736813 PQJTZENKLIRJAP-HXUWFJFHSA-N 347.462 5.189 30 20 EKED N#CC1(CCSCc2csc(-c3ccccn3)n2)CCCCC1 419407759 ZAIHFACGKABVFU-UHFFFAOYSA-N 343.521 5.302 30 20 EKED Cc1ccc(-c2nnc([C@H](C)S[C@@H](C)c3cccc(C#N)c3)o2)cc1 419466947 RWUGBMJPRWZNNM-GJZGRUSLSA-N 349.459 5.472 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1sccc1C1CC1 432934261 ZLXZPZJACPXXQY-LBPRGKRZSA-N 342.489 5.272 30 20 EKED C=C[C@H](CC(=O)Nc1ccccc1-c1csc(C)n1)c1ccccc1 477692865 IEBOLUIBCDIBKD-MRXNPFEDSA-N 348.471 5.417 30 20 EKED C=CCSc1ccccc1C(=O)NCc1ccc(C(C)(F)F)cc1 490315692 WJUBZZLGUMGFBJ-UHFFFAOYSA-N 347.430 5.006 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)sc2ccc(F)cc12 494585898 ZYXWAODRMJMYRK-UHFFFAOYSA-N 344.798 5.126 30 20 EKED CCCCCC(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 514536658 WIEDQOOIRSHALX-UHFFFAOYSA-N 338.426 5.119 30 20 EKED CCCN(CC1CCCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 516078669 TVXAZZZNENLLEH-UHFFFAOYSA-N 341.499 5.312 30 20 EKED CCCC[C@@H](CC)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 522682597 UDQGDJMJDROVFR-JKSUJKDBSA-N 332.513 5.626 30 20 EKED N#CCCCCCC(=O)N[C@@H](CC1CCCCC1)c1ccccc1 588339639 JNMZLHCWSOCWCA-FQEVSTJZSA-N 326.484 5.288 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(Cl)ccc1Cl 642389043 VLSHJOUBZCWNQJ-UHFFFAOYSA-N 335.234 5.214 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CCC2)CC1 672744547 GYCMLGHOUOZYEQ-UHFFFAOYSA-N 326.484 5.337 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1 728695580 ZLXYXBRWTFCELK-REPPVQDKSA-N 346.213 5.180 30 20 EKED CC(C)c1ccc(C(C)(C)NCc2ccc(N(C)CCC#N)cc2)cc1 729686395 JQNAOUYSKWMOBZ-UHFFFAOYSA-N 349.522 5.185 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2cccc(Cl)c2)c1 746047701 PWYYSUUBOLPMIX-AZUAARDMSA-N 342.870 5.262 30 20 EKED CCC(=NN(Cc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 772990629 NSRFXYTYNZLHFH-UHFFFAOYSA-N 339.442 5.379 30 20 EKED C[C@@H](Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(C#N)c(F)c1 776801864 CEUMSWQCGQUULY-SECBINFHSA-N 340.732 5.125 30 20 EKED C=CC[C@H](N[C@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccncc1 796770062 BJEFVAANTXDHRF-KDOFPFPSSA-N 330.859 5.020 30 20 EKED N#Cc1ccc(Br)c(CNc2ccc3ccccc3c2)c1 863996652 SKHMTGNGHHXEDI-UHFFFAOYSA-N 337.220 5.086 30 20 EKED CCCc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)sc1C 25437888 YLZQYRZRWMQGCQ-UHFFFAOYSA-N 326.465 5.063 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1Cl 37748907 OWZYNMYXQVTAQH-SNVBAGLBSA-N 339.653 5.369 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccccc1C(C)(C)C#N 131702159 KLMDTHZNWRYDLR-MRXNPFEDSA-N 349.503 5.352 30 20 EKED COc1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc1 207732143 ABXNCFBPWLNXPF-SSZFMOIBSA-N 347.439 5.031 30 20 EKED CC(C)(CCC#N)CNC[C@@H]1CC2c3ccccc3C1c1ccccc12 236818411 XJSRCPQHMKQMBH-YTZBPGPESA-N 344.502 5.203 30 20 EKED Cc1ccc(Oc2ccccc2CNCc2cc(C#N)cs2)cc1 237808219 NRQDUGALUPJUDF-UHFFFAOYSA-N 334.444 5.010 30 20 EKED C[C@@H]1C[C@H](N[C@H](CCC#N)c2ccccc2)c2ccsc2S1 358346909 DELGUWZUKWGUOZ-XYPHTWIQSA-N 328.506 5.308 30 20 EKED C=CCC[C@H](NC(=O)Nc1cccc([C@@H](C)OC)c1)c1ccccc1 435605054 CGJMSRHVHBFACZ-UZLBHIALSA-N 338.451 5.223 30 20 EKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cc2ccccc2s1 475758520 XLKMZHCXXHUMNX-RDJZCZTQSA-N 348.471 5.166 30 20 EKED C=CC[C@@H](C(=O)Nc1cnn(CCCC)c1C(C)C)c1ccccc1 482728788 QDJKJIORHUKSTN-GOSISDBHSA-N 339.483 5.105 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 537289412 AAQFEYFLNAFLGA-AOMKIAJQSA-N 346.861 5.652 30 20 EKED C[C@@H](Sc1cccc(C#N)c1)c1nc2ccccc2n1C(F)F 570181857 FIESNKRQNUDZCR-LLVKDONJSA-N 329.375 5.156 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 604461347 GLAROCJUFHLFOO-INIZCTEOSA-N 349.434 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(N2CCCC2)c1 613901104 NOWFYOSTXOORIN-UHFFFAOYSA-N 348.490 5.391 30 20 EKED Cc1ccc2c(c1)C(=O)/C(=C/c1nc(-c3ccccc3)cs1)CCO2 727975903 IVZYVWINRCNKOL-FOWTUZBSSA-N 347.439 5.167 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc3ccccc23)cc1 728694733 HIFHVMVFDWBLSB-WSYSLRRZSA-N 327.383 5.027 30 20 EKED C[C@@H](c1cccc(Cl)c1)N(C)Cc1cc(Cl)ccc1OCC#N 735308606 KUKGZJGPFOKJHU-ZDUSSCGKSA-N 349.261 5.089 30 20 EKED CCCCCCCCC(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 743836713 ACJGSCAQARUVJG-SFHVURJKSA-N 343.471 5.104 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Cl)cc1 915086844 NGRSIPJCMYQIOD-LJQANCHMSA-N 346.817 5.248 30 20 EKED C=CCN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)C(C)C 915147580 DVDPDSLWTXWLRO-UHFFFAOYSA-N 342.489 5.061 30 20 EKED CC(CC[C@@H]1[C@@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)c(F)c1 1776076899 LCXDBKADMOGRSG-SUMWQHHRSA-N 348.462 5.554 30 20 EKED C=CCC[C@@H](CC(C)C)C(=O)Nc1cc(C(=O)O)c2ccccc2c1 1776166340 VVWMDDQNTUTRIJ-INIZCTEOSA-N 339.435 5.105 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(OC(C)(C)C)c1 1776784050 UVHUFKZHWXFZBT-SFHVURJKSA-N 349.515 5.157 30 20 EKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1 56517829 ULZFNDGXNRRFGB-NRFANRHFSA-N 341.414 5.080 30 20 EKED CC(C)C[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 109028020 CFVHEAAXBBXMQO-CVEARBPZSA-N 345.512 5.123 30 20 EKED CO[C@@H](C)c1nc(CSCc2ccccc2C(C)(C)C#N)cs1 134075132 PKXGQQYVVDHZLX-ZDUSSCGKSA-N 346.521 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)c1ccncc1 191431959 INFCBXAVRFMJKA-LJQANCHMSA-N 337.467 5.206 30 20 EKED C[C@H](c1ccc(Cl)c(Cl)c1)[S@@](=O)CCCCC(C)(C)C#N 278365138 XIDVVKAWWRHDFO-GTJPDFRWSA-N 346.323 5.523 30 20 EKED O/C(=N/[C@@H]1CCC[C@H](C(F)(F)F)C1)c1coc(C2CCCCC2)n1 328711585 BFRRYCRCXGQDPH-QWHCGFSZSA-N 344.377 5.148 30 20 EKED N#Cc1c(NC(=O)c2cccc(C(F)F)c2)sc2c1CCCCC2 409735325 ATLZHAKYAYLKSZ-UHFFFAOYSA-N 346.402 5.079 30 20 EKED Cc1c(C(=O)Nc2ccc(F)cc2C#N)oc2c1ccc1ccccc12 433968312 QAYBGICHMLCQBH-UHFFFAOYSA-N 344.345 5.158 30 20 EKED CCCCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](C)c1ccccc1 455912276 WYYGXTDKEKYFFQ-KRWDZBQOSA-N 335.451 5.148 30 20 EKED CC(C)(C)C[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458804757 SWTJCSVYVZYIEO-OALUTQOASA-N 341.499 5.032 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C(C)=O)ccc1Cl 486425617 BSARBNMGSREYDL-UHFFFAOYSA-N 345.851 5.073 30 20 EKED N#Cc1csc(CN[C@@H]2CCc3ccc(-c4ccccc4)cc32)c1 495148697 DJKDIONADXOLPQ-OAQYLSRUSA-N 330.456 5.064 30 20 EKED N#Cc1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CCCC2)cc1 503895520 SRQXFDGCPVXAOC-UHFFFAOYSA-N 344.380 5.136 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CC1CCCC1 510863371 BWODGQWESCDQKZ-LSDHHAIUSA-N 330.497 5.093 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 536814123 FEWSVWBIIRDJOQ-CRAIPNDOSA-N 349.434 5.145 30 20 EKED COc1cccc(-c2ccc(CN[C@H](C)c3cccc(C#N)c3)cc2)c1 537293780 GBIZKNUUKXGWJU-QGZVFWFLSA-N 342.442 5.085 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc3sccc3c2)s1 562379870 ZFLPNJOXHFLAMW-ZDUSSCGKSA-N 340.473 5.145 30 20 EKED C=C(C)COc1cccc(NC(=O)c2ccccc2SCC)c1 589552676 CRKHKIZVRSBGPS-UHFFFAOYSA-N 327.449 5.006 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2CC(=O)Nc1c(C(C)C)cccc1C(C)C 662078809 HANRSLQYEZDQJK-HDICACEKSA-N 340.511 5.055 30 20 EKED C=CCN(C(=O)Nc1cccc(Cl)c1SCC(F)F)C(C)C 737028327 XCHKNDQOSBYHNR-UHFFFAOYSA-N 348.846 5.126 30 20 EKED N#C[C@H](C(=O)C1CCCCCCC1)c1nc(-c2ccccc2)cs1 744037282 SHTSUUCONOEFBY-QGZVFWFLSA-N 338.476 5.347 30 20 EKED CC(C)C[C@@H](C)N(C(=O)c1cccc(C#N)c1)c1ccc2[nH]ccc2c1 750825146 AKERSAMPGXWFCN-MRXNPFEDSA-N 345.446 5.121 30 20 EKED C=C[C@@H](CC(=O)O[C@H](c1ccccc1)c1ccncc1)c1ccccc1 759275447 MEYRBQPYVLSITD-FDDCHVKYSA-N 343.426 5.074 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1cc(-c2ccccc2)cs1 779989448 SERJXHDAWIHYMY-OAHLLOKOSA-N 334.444 5.318 30 20 EKED Cc1cc(-c2ccccc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 795167795 ZVHIBHOKPDAHLF-UHFFFAOYSA-N 346.817 5.439 30 20 EKED C=C(C)CCc1noc([C@@H](C)Sc2nc3ccccc3s2)n1 795767363 MOIVWTDKWJITKR-LLVKDONJSA-N 331.466 5.041 30 20 EKED C#CC[C@H](N[C@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccccc1 796844536 DQQLMDWLTNEMEE-BEFAXECRSA-N 327.855 5.072 30 20 EKED C=CCC[C@H](Nc1ccc(OC2CCOCC2)c(C)c1)c1ccco1 796926097 NYOYTJKRYYJBQQ-IBGZPJMESA-N 341.451 5.265 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]1c1ccccc1)c1nc2ccccc2s1 835039988 MKAOETYEDVQSKB-GVDBMIGSSA-N 346.455 5.056 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccccc1C 916317816 HQWWMHGBZUXRQI-UHFFFAOYSA-N 328.630 5.186 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1C 1776089594 ZHNPSWUKOAFCII-KDOFPFPSSA-N 344.499 5.724 30 20 EKED N#Cc1ccccc1CSc1nnc(-c2ccc3ccccc3c2)o1 42180996 XRXJFEDQOZRORE-UHFFFAOYSA-N 343.411 5.054 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 185911181 QKOXWKRWIYZALY-ZDUSSCGKSA-N 344.505 5.518 30 20 EKED CCCOc1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 207590430 YCKVSDSFIQFRRA-JYRVWZFOSA-N 349.430 5.054 30 20 EKED C=CC[C@H](C)[C@H](C)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 246218839 YPWGKTBETKYBHW-LLJLJFOGSA-N 341.520 5.148 30 20 EKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1Cl 329943699 DSDWJPMUCADYQJ-GRTSSRMGSA-N 348.874 5.283 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1OC 358343400 HJCVXQWATCUAJT-RTBURBONSA-N 342.870 5.434 30 20 EKED Cc1cc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)o1 447580325 NWRUTRYASIRDSZ-INIZCTEOSA-N 330.431 5.286 30 20 EKED C[C@@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)c2ccccc12 462471980 FHWRTBGKAZCWSF-OAHLLOKOSA-N 334.850 5.410 30 20 EKED Cc1c(F)cccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 465279378 VIJHQQZIBANSFA-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CC[C@@]1(C)CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 467554397 OFAPRSYRWJEYMW-NRFANRHFSA-N 349.434 5.004 30 20 EKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C(C)(C)C1 472701281 UZNHMSGIGNXZLV-HNNXBMFYSA-N 349.434 5.003 30 20 EKED Cc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1-c1ncco1 481997078 GJNGMSCBUWDZFB-NRFANRHFSA-N 343.430 5.401 30 20 EKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1nccc2ccccc12 483229321 KMFGKPDFBAAQJH-MRXNPFEDSA-N 346.386 5.079 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccccc1N1CCCCC1 486444179 WIZKCDMIGMAKHC-UHFFFAOYSA-N 333.479 5.090 30 20 EKED C=CCC[C@@H](C(=O)Nc1cccc(-c2ncc(C)o2)c1)c1ccccc1 488315602 OQIWRIUTANUWCS-HXUWFJFHSA-N 346.430 5.339 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccc(F)c(F)c1 502431817 PNVQEYGTPDZHPL-JLTOFOAXSA-N 345.437 5.244 30 20 EKED C=C(C)CCSCc1csc(-c2cccc(OC)c2OC)n1 507131572 BZAMAEAYNDKMSV-UHFFFAOYSA-N 335.494 5.027 30 20 EKED C[C@@H](Nc1ccc(CN2CCCC[C@H]2C)cc1)c1ccc(C#N)cc1 540700884 NUNKQPXSJZFPHL-QZTJIDSGSA-N 333.479 5.106 30 20 EKED C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 540705225 FLHGGMOLWMLYCQ-UZUQRXQVSA-N 344.433 5.332 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1Cl 577684759 UGFSGVXXQZQVJB-BBATYDOGSA-N 331.246 5.203 30 20 EKED Cc1ccc(C[C@H](C#N)Sc2nc3cc(Cl)ccc3o2)cc1 588790579 MDQDBKYIZYCKMC-CQSZACIVSA-N 328.824 5.017 30 20 EKED N#Cc1ccc(CN[C@H]2CCCc3c2sc2ccccc32)c(F)c1 610812862 XWGXQNCBPVQNDG-SFHVURJKSA-N 336.435 5.079 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCSc2c(Cl)cccc21 618807021 SPHUXIYBIGSLDP-ROUUACIJSA-N 340.879 5.026 30 20 EKED Cn1cc(C(=O)/C=C/c2csc(-c3ccccc3)n2)c2ccccc21 726740763 PJVHEFFLARSFFY-VAWYXSNFSA-N 344.439 5.198 30 20 EKED CCOc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1 727263447 CTAISKZJKXFLCW-SEYXRHQNSA-N 335.428 5.105 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1ccc(SC(F)F)cc1 734979343 CDUUISHDAVKBDK-YHYXMXQVSA-N 344.382 5.216 30 20 EKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 735400691 YJMQXEWLQSINMI-DOTOQJQBSA-N 340.492 5.593 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(Cl)nc3)cs2)cc1 759084820 XXDRBRKMMMBWOZ-BQYQJAHWSA-N 340.835 5.063 30 20 EKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772240119 ZZKRGWIVCCJQJH-MAODMQOUSA-N 347.462 5.137 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1Cl 779712562 JESDPCFHBWQJCT-NEPJUHHUSA-N 335.234 5.457 30 20 EKED C#CCCCCCC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 779849214 CCQIVWBTQYBFNC-IBGZPJMESA-N 345.895 5.191 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2sccc2CC#N)c(C)c1 865071099 OECFYWBNOQVRIO-CYBMUJFWSA-N 344.505 5.266 30 20 EKED Cc1cccc(C)c1NC(=O)CCCSCC1CCC(C#N)CC1 902272467 FFIVGCWRXDXASN-UHFFFAOYSA-N 344.524 5.085 30 20 EKED CCCCCCCCC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 920232914 XWRLCERKMGFEEL-FPOVZHCZSA-N 331.500 5.021 30 20 EKED C=CCCC(=O)N(Cc1ccc(Cl)cc1)[C@@H](C)Cc1cccs1 60364784 MQBJNRPABBIPTK-HNNXBMFYSA-N 347.911 5.328 30 20 EKED N#Cc1ccnc(SCc2nc(-c3ccccc3Cl)cs2)c1 186589168 NQLJUFSUNYLOPH-UHFFFAOYSA-N 343.864 5.022 30 20 EKED CC[C@@H](CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1)c1ccc(C)cc1 303865196 PPEPBJWQARSEGQ-QUCCMNQESA-N 348.490 5.360 30 20 EKED N#CCCC[C@@H](NCc1cccc(-c2ccccn2)c1)c1ccccc1 353894899 BHFIOCYHSBEWAQ-JOCHJYFZSA-N 341.458 5.273 30 20 EKED N#CC[C@H](CC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 474583356 FKJGOMBGPUHXBX-QGZVFWFLSA-N 346.455 5.441 30 20 EKED C[C@@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)c1ccccc1 499628484 ACJJXJUHSMHCAH-FQEVSTJZSA-N 348.490 5.355 30 20 EKED C=CCCCSCC(=O)Nc1ccccc1Oc1ccccc1 522757445 IASAPCDARPCTOO-UHFFFAOYSA-N 327.449 5.117 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 540149470 PNVCWXVCIJXNKT-HNAYVOBHSA-N 348.412 5.767 30 20 EKED Cc1cccc(C)c1-c1cccc(OCCCC2(C#N)CCOCC2)c1 564407660 JZQAPGBYHZZNBC-UHFFFAOYSA-N 349.474 5.450 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC(CCC#N)CC2)c(C(C)C)c1 565889963 JMGISTUDXWWREP-UHFFFAOYSA-N 341.499 5.481 30 20 EKED Cc1c(NCc2ccc(C(C)(C)C#N)cc2)cccc1-c1ncco1 589969943 GTBXPGBGLKGBPG-UHFFFAOYSA-N 331.419 5.063 30 20 EKED CC(C)CN(CCC#N)C(=O)c1cc(-c2ccccc2)ccc1Cl 732062372 KTDPCMMIQARUSD-UHFFFAOYSA-N 340.854 5.019 30 20 EKED CC[C@@H](/N=C\c1cc(Cl)ccc1O)c1nc(C(F)(F)F)cs1 745976941 OYPLVDXECNPIIO-FFVKGDJCSA-N 348.777 5.091 30 20 EKED O=C(/C=C/c1cc2ccccc2o1)c1ccc(-c2ccncc2)cc1 745990120 KSODOQGWPUFXFU-MDZDMXLPSA-N 325.367 5.391 30 20 EKED CC(=NN(c1ccccc1)c1ccccc1)c1ccc(C(C)(C)O)cc1 767351622 GGBZVEBCFWAWPV-UHFFFAOYSA-N 344.458 5.476 30 20 EKED CC(C)(C#N)CCSCc1cccc(NC(=O)OC(C)(C)C)c1 790564879 SWVDXZVAZFLVMX-UHFFFAOYSA-N 334.485 5.207 30 20 EKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1csc2ccccc12 793446158 VEYPSDMQZGMHEH-WBVHZDCISA-N 348.471 5.166 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(C(F)(F)F)s1)c1ccncc1 902806833 PESCCRGBNXRGHS-YPMHNXCESA-N 326.387 5.130 30 20 EKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1c[nH]c2ccccc12 921269943 PWISJDOCGZBMQM-JXMROGBWSA-N 345.320 5.005 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776370439 FJDLGMLYJBRQCI-BQYQJAHWSA-N 334.824 5.119 30 20 EKED COc1ccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)cc1 33372052 CDWXQQCOZHDTJF-RAXLEYEMSA-N 335.428 5.023 30 20 EKED CCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 79863608 XKNOUHFZGOEKFE-LLVKDONJSA-N 346.864 5.064 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(F)cc1Cl 130318300 NAUMLHOYMKSITQ-CQSZACIVSA-N 346.833 5.012 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccccc1F 189901032 AVKYQZPKXGMHLU-OAHLLOKOSA-N 325.427 5.420 30 20 EKED N#Cc1cccc(CNCc2ccccc2-c2ccc(Cl)cc2)c1 237804094 RJRBMDPNBLGCBD-UHFFFAOYSA-N 332.834 5.168 30 20 EKED CSc1nc(C(C)(C)C)nc(C)c1C(O)=Nc1cc(C)ccc1C 330985321 LDUNSZJZGVXPBV-UHFFFAOYSA-N 343.496 5.058 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cc(F)cc(Cl)c1)c1ccccc1 433281628 KBQMTKMVVMTHAY-QGZVFWFLSA-N 345.805 5.036 30 20 EKED Cc1nc2ccc(CSc3ccc(C#N)c(C(F)(F)F)c3)cc2[nH]1 460453784 UONWNTJOOYZJJI-UHFFFAOYSA-N 347.365 5.054 30 20 EKED N#CC1(c2ccccc2)CCC(NC[C@H]2CCCCC(F)(F)C2)CC1 495021571 ZAZRFSVHJVSCDR-KKXNLOMOSA-N 346.465 5.196 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(F)cc1 505062489 RXKZNBCUTZQOHN-FQEVSTJZSA-N 338.426 5.313 30 20 EKED Cc1ccccc1[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)C1CC1 515334898 RIHPDNWJZLSYBQ-IBGZPJMESA-N 344.380 5.126 30 20 EKED N#Cc1ccc(CSCc2csc(C3CCCC3)n2)c(F)c1 520916737 GVYXXFKCVJGACP-UHFFFAOYSA-N 332.469 5.245 30 20 EKED N#Cc1ccc(CNCc2cc3ccccc3s2)c(C(F)(F)F)c1 549833238 XKQPWKHVVZMANU-UHFFFAOYSA-N 346.377 5.082 30 20 EKED CC[C@H](C)Oc1cccc(N[C@H](CCC#N)c2ccc(OC)cc2)c1 550855694 CQFKOSJSPSOEFD-HRAATJIYSA-N 338.451 5.329 30 20 EKED C=CCC[C@@H](NCc1ccncc1C)c1ccc(C(F)(F)F)cc1 565285180 MDZPBEGKUDSMDY-GOSISDBHSA-N 334.385 5.206 30 20 EKED Cc1cc(Oc2nc(C(F)F)nc3ccccc23)c(C)c(C)c1C#N 588081885 QJQGQIFVTTYLON-UHFFFAOYSA-N 339.345 5.157 30 20 EKED N#CCCC[C@H](N[C@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 599048375 MOXIWAWABDSZQV-PMACEKPBSA-N 342.845 5.491 30 20 EKED CCC(C)(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 608847633 UTNXMHJULWGSOP-KRWDZBQOSA-N 340.854 5.370 30 20 EKED COCc1cccc(/C=C\C(=O)c2cc(Cl)sc2Cl)c1 742432545 XRJNUOIVLTYBPG-WAYWQWQTSA-N 327.232 5.097 30 20 EKED C[C@@H](CCC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 750313185 NXRZBXIGOPBKAI-GOEBONIOSA-N 334.444 5.056 30 20 EKED CC1(C#N)CCC(Nc2ccc(CC[C@H](O)c3ccccc3)cc2)CC1 823543961 MDZBJENDMMXEOO-KOENEWCDSA-N 348.490 5.237 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2cccs2)cc1F 917519557 RTHCLYVJOCHGIH-VOTSOKGWSA-N 329.421 5.215 30 20 EKED N#CCCCCOC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1 920713569 MLDPBZSKVUYHHK-UHFFFAOYSA-N 347.773 5.122 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2sc3ccccc3c2Cl)cn1 58465306 MIBNBDIGJGABTQ-BQYQJAHWSA-N 330.840 5.228 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1c(F)cccc1F 108408202 UVNUNOMENDUQSD-STQMWFEESA-N 332.419 5.390 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(C(F)F)cc1 185620855 SBAGRMSIFLMKMP-ZDUSSCGKSA-N 332.419 5.488 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cccc2c1CCCC2)c1ccccc1 432740952 CTTQCJHUPZKZBY-HXUWFJFHSA-N 347.462 5.122 30 20 EKED C=CCC1(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)CCCCC1 450489873 RLFXYQJANXROSO-HNNXBMFYSA-N 329.488 5.197 30 20 EKED N#Cc1ccc(CN[C@@H]2CCc3ccc(-c4ccccc4)cc32)s1 495193608 QIJSGRAZSINETE-OAQYLSRUSA-N 330.456 5.064 30 20 EKED CCCc1ccc([C@H](Nc2ncccc2C#N)c2cccs2)cc1 501942164 BMLRIQVBSDMFGC-IBGZPJMESA-N 333.460 5.169 30 20 EKED C=CCOc1cccc(CNC(c2ccccc2)c2ccccc2)c1 520191811 OMGURTKJSCUIJR-UHFFFAOYSA-N 329.443 5.131 30 20 EKED C=CCC[C@H](N[C@@H](CC)[C@@H]1CCOC1)c1ccc(C(F)(F)F)cc1 540150002 CMCQVJSOJMOGAU-NJAFHUGGSA-N 341.417 5.117 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(C(F)F)cc1 588018494 WRSTXXXCZABELV-UHFFFAOYSA-N 341.810 5.168 30 20 EKED N#CCCC[C@H](NCc1cc2cc(Cl)cnc2o1)c1ccccc1 590654516 WWMMWFQFFLQXSZ-SFHVURJKSA-N 339.826 5.006 30 20 EKED C[C@H](N[C@@H]1CCCc2c1sc1ccccc21)c1cccc(C#N)c1 610829625 BPHSGIQGRZYMTA-IFXJQAMLSA-N 332.472 5.501 30 20 EKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)ccc1OC 610829805 MYLMGYNTOZNFKA-ACJLOTCBSA-N 328.843 5.022 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)cc1 727264762 ZYXVFUPAGHMSEA-XBXARRHUSA-N 335.712 5.127 30 20 EKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)(C)C 734706671 QXQSQFNBARFOON-FZMZJTMJSA-N 346.883 5.322 30 20 EKED CC[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 735306221 KRIWELTVZVRLTO-QGZVFWFLSA-N 349.261 5.137 30 20 EKED C#Cc1cccc(NC(=O)N(C2CC2)[C@H](C)c2ccc(Cl)cc2)c1 735863153 BPKJPODGDCLMPJ-CQSZACIVSA-N 338.838 5.079 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2scnc2C)cc1 742435080 RTXWDOQKXKROJL-VAWYXSNFSA-N 335.428 5.023 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Cl)c(F)c2)c1 772983418 HSXGFLQKXHTEAB-CJNGLKHVSA-N 346.833 5.011 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccccc1 773118446 ZRHQBHHLTBIODT-KDOFPFPSSA-N 331.431 5.417 30 20 EKED C[C@H](Nc1cccc(Oc2ccccc2)c1)c1ccc(OCC#N)cc1 777709279 MJWLYYOIZOWXJQ-KRWDZBQOSA-N 344.414 5.554 30 20 EKED O=C(/C=C/c1sccc1Cl)c1cccc(-c2ccncc2)c1 782341444 JVXSLBAZCIKSGU-SNAWJCMRSA-N 325.820 5.360 30 20 EKED C[C@@H](N[C@H](C)c1ccccc1O)c1ccc(-c2cccc(C#N)c2)cc1 783531996 GYQVNVIAEDWNBN-IAGOWNOFSA-N 342.442 5.343 30 20 EKED C=CCCc1ccccc1NCc1ccc(SC(=O)N(C)C)cc1 799971884 AIDAQZBYBCPHLI-UHFFFAOYSA-N 340.492 5.191 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1O 815636456 VOSNUMVKVBYAFV-RBUKOAKNSA-N 326.415 5.007 30 20 EKED C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1ccccc1C#N 62698482 LVQJMKMTVFLNLW-CHWSQXEVSA-N 344.867 5.033 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc3ccccc3c2)c1 113952451 HSJWOPLPHMDWJJ-VGSWGCGISA-N 344.458 5.372 30 20 EKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2cccs2)cc1 180550665 XPYGKPVRZAYHAL-MRXNPFEDSA-N 348.471 5.168 30 20 EKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1 286924860 HLMXBVXZSAUNKZ-UZLBHIALSA-N 347.462 5.103 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1O 287616900 JOTOQGGRPSXPAM-ZWKOTPCHSA-N 328.843 5.131 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1nc2ccccc2s1 409447952 YJVHEICIGJIMMX-MRXNPFEDSA-N 327.497 5.153 30 20 EKED CCc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 431169730 NELPDEYARNRCJN-SFHVURJKSA-N 346.455 5.171 30 20 EKED CC(C)c1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)c(C(C)C)c1 463394477 IGIARZANLDVETI-INIZCTEOSA-N 334.463 5.547 30 20 EKED C=CCC(CC=C)C(=O)Nc1c(C)cc(Br)cc1Cl 468677003 WTHCDZMPRRJPOD-UHFFFAOYSA-N 342.664 5.118 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(-c2cccs2)c1)c1ccccc1 475534855 VVCXUSBFQMXROE-KRWDZBQOSA-N 346.455 5.441 30 20 EKED CCCN(C(=O)Nc1cc(C#N)ccc1C)[C@H](CC)c1ccccc1 476843697 NCJPQUHHZSHNHL-HXUWFJFHSA-N 335.451 5.262 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1cccc(Cl)c1F 477835156 GFCABPHFICCBGG-STQMWFEESA-N 348.874 5.904 30 20 EKED C[C@H](Nc1cc(Cl)ccc1C#N)c1nc2ccccc2n1C(F)F 486451169 NPUIKZIQJDIYRP-JTQLQIEISA-N 346.768 5.130 30 20 EKED C=CCC[C@H](NC(=O)N[C@@H](C)CCCC(F)(F)F)c1ccccc1 494793015 IBFHNIKSUTWIIS-HOCLYGCPSA-N 342.405 5.114 30 20 EKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(C#N)c1 500771841 NUIYGAKOERKRFW-GOSISDBHSA-N 341.842 5.073 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(Cl)c1C 515775791 ZYWQSQOABJDNRC-UHFFFAOYSA-N 332.806 5.008 30 20 EKED CCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@H](CC)c1ccccc1 521767359 JPHZQNRMJDDIDA-LAUBAEHRSA-N 349.478 5.192 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccsc3)n2)c(F)c1 525630961 OFXXEDZMCQMDRO-UHFFFAOYSA-N 332.450 5.175 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)c2ccccc12 576793867 YQGMPNGHUQOXGZ-RCDICMHDSA-N 330.406 5.189 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCC[C@H]1C#N 602761043 UXHQLYUNFLOALB-MAUKXSAKSA-N 327.472 5.089 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2cc(Cl)ccc2o1 618807382 UGXWZDBXPXOLRO-KZULUSFZSA-N 336.822 5.296 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(F)F)ccc1F 622851692 HQRCVQCOSLNZDU-UHFFFAOYSA-N 347.380 5.868 30 20 EKED CCCCN(Cc1ccc(OCC#N)cc1)Cc1ccccc1Cl 731212846 UROZKCWWOLQOAN-UHFFFAOYSA-N 342.870 5.045 30 20 EKED FC(F)(F)c1ccc(C=NOc2ccccc2C(F)(F)F)cc1 754712198 FXADUYFLAMWWDW-UHFFFAOYSA-N 333.231 5.137 30 20 EKED C#CC[C@H](N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 773108370 WYZPSYIXRIYDNU-UZLBHIALSA-N 346.499 5.534 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(C#N)cc3F)cs2)cc1 781111860 QSWBAIYHHPCGLX-CLFYSBASSA-N 348.402 5.025 30 20 EKED N#Cc1sc(Oc2ccc(SC(F)(F)F)cc2)nc1Cl 804838935 SJAWTMCDLZFZOL-UHFFFAOYSA-N 336.747 5.072 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc([C@@H](C)C(F)(F)F)cc1 834571281 POUCIPWOMZLYJD-UONOGXRCSA-N 348.368 5.255 30 20 EKED Fc1ccc(-c2nc(CON=Cc3ccc(Cl)cc3)cs2)cc1 920759813 FGGLDCVCNJYLGA-UHFFFAOYSA-N 346.814 5.153 30 20 EKED C=C(C)CN(CC)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 24458537 GJCXXXXYTWNJLS-UHFFFAOYSA-N 346.430 5.047 30 20 EKED CCCc1ccc([C@H](Nc2ccc(C#N)cn2)c2cccs2)cc1 58489056 GPZSMTGIVVEVNG-FQEVSTJZSA-N 333.460 5.169 30 20 EKED COc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)c2ccccc12 90665152 CQRQEMJFXNJLPX-VGSWGCGISA-N 344.458 5.544 30 20 EKED COc1ccccc1CN(CCCC(C)(C)C#N)Cc1cccs1 174809664 VIBOUZVBTDSONY-UHFFFAOYSA-N 342.508 5.089 30 20 EKED C=CCC[C@H](NCc1ncc(-c2ccc(OC)cc2)o1)c1ccccc1 180037570 FYZJOPHJFFGGKA-FQEVSTJZSA-N 348.446 5.147 30 20 EKED C[C@H](/N=C(/O)C[C@@H]1CCCC(C)(C)C1)c1ccc2c(c1)CC(O)=N2 328794489 SMSSLYYYUXWXTE-KBPBESRZSA-N 328.456 5.455 30 20 EKED CN(CCC#N)C(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1 433822443 ZVNMCURAYOKTJE-UHFFFAOYSA-N 348.233 5.038 30 20 EKED CC(C)c1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 437554604 GTQGTUFNLQODRE-NHCUHLMSSA-N 347.462 5.114 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@H](CC)c3ccc(C#N)cc3)oc12 447518556 NWAVLVXHWWVHMJ-DNVCBOLYSA-N 348.446 5.505 30 20 EKED N#CCCCC(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 462492889 VYPAKQKCUJCMFO-UHFFFAOYSA-N 348.324 5.130 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1cccc(F)c1 476149677 NBRCFSGZOGVLTE-MRXNPFEDSA-N 339.454 5.810 30 20 EKED CC(C)(C)c1ccc(-c2ccc(NC(=O)CC#N)c(Cl)c2)cc1 479538132 DTTPJLYUBYCNJS-UHFFFAOYSA-N 326.827 5.157 30 20 EKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)oc2c(Cl)cccc12 494631823 CLBOMKOIZQMWKB-UHFFFAOYSA-N 345.185 5.172 30 20 EKED CC(C)[C@@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 556205731 MGWJPAWDWVTICG-YTFSRNRJSA-N 332.491 5.896 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H]1CCc2sc(Cl)cc21 573352950 NYMKOLFIWXOQBA-IRXDYDNUSA-N 342.895 5.318 30 20 EKED FC(F)Oc1ccc(NN=Cc2c(Cl)cccc2Cl)cc1 726426933 NNUKEKVJOXVLTA-UHFFFAOYSA-N 331.149 5.041 30 20 EKED CCCCCC[C@H](C)CC(=O)Nc1nc(C)c(SCC#N)s1 727663719 IGJLTIANGRRXCM-LBPRGKRZSA-N 339.530 5.002 30 20 EKED CC(=NNc1nc(-c2ccccc2)cs1)c1ccc(F)cc1C 731314809 UWDXCMDCRCHIRI-UHFFFAOYSA-N 325.412 5.094 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc2ccccc2c1OC(F)F 742429036 DWGCARXNGLFEDI-HJWRWDBZSA-N 345.370 5.102 30 20 EKED CC1(C)CCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 750588541 PLHXLFUVDRUTMA-WOJBJXKFSA-N 347.462 5.042 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(OCC#N)cc1 776159235 WCAFFJLKNOZROF-PGRDOPGGSA-N 336.479 5.335 30 20 EKED N#Cc1ccc(-c2cccc(CNC3CCC(C(F)F)CC3)c2)s1 799718485 CNMZFNYRSGNGKO-UHFFFAOYSA-N 346.446 5.200 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(Cl)cc2)cc1)c1ccnc(O)c1 806556711 YAJGTQTZPQOEBT-KMKOMSMNSA-N 335.790 5.004 30 20 EKED O=C(/C=C/c1cn2cc(Cl)ccc2n1)c1cccc2ccccc12 920755902 TYFSNQVTQNIIDP-MDZDMXLPSA-N 332.790 5.037 30 20 EKED COc1ccc(O)c(C=Nc2cccc(COC3CCCCC3)c2)c1 921138408 JOQFEKRIXKTYJO-UHFFFAOYSA-N 339.435 5.001 30 20 EKED CCC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 72591338 VNWQBCOAHWJNIW-FZMZJTMJSA-N 332.856 5.076 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)c1c(F)cc(C#N)cc1F 191540001 NNGLQDWDQIXIAU-UHFFFAOYSA-N 342.389 5.165 30 20 EKED CCc1c(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)oc2ccccc12 208263323 LRZFEOGIQZFJMJ-WVUXNXBLSA-N 345.398 5.182 30 20 EKED CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1 330123231 ANWLFFSAQSBHMT-BFHYXJOUSA-N 334.847 5.221 30 20 EKED Cc1nc(C(C)C)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 340443195 FMLFIBIZQQOUOI-CRAIPNDOSA-N 341.524 5.661 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(C)cc1Br 410360569 BBFGVCPNUVLCBQ-UHFFFAOYSA-N 344.252 5.128 30 20 EKED CC1(C)C[C@H](c2ccccc2)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1 425124262 UJCFTBIURQTZCW-NHCUHLMSSA-N 346.474 5.074 30 20 EKED C=CCC[C@@H](N[C@H](C)c1nc(-c2ccncc2)cs1)c1ccco1 428446833 KQYCNHXFYPKIAF-GDBMZVCRSA-N 339.464 5.156 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccc(F)cc1)c1ccccc1 435100130 CAHWOXUVSZMYAA-OXQOHEQNSA-N 340.442 5.236 30 20 EKED N#Cc1cc(Cl)ccc1CN[C@H](c1ccc(Cl)cc1)C1CC1 480867533 NNLTVSASBOFWDE-SFHVURJKSA-N 331.246 5.106 30 20 EKED N#CCCCCN[C@H](Cc1ccc(F)cc1)c1ccccc1Cl 482442394 YHGVZPPDTKLFTD-LJQANCHMSA-N 330.834 5.046 30 20 EKED CC(C)(C)c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487289145 URGKFMHPTDKPOT-HXUWFJFHSA-N 334.463 5.149 30 20 EKED CC(C)c1ccc([C@@H](C)SCCCC2(C#N)CCOCC2)cc1 512314154 MTWUKDZHZDKUJS-QGZVFWFLSA-N 331.525 5.705 30 20 EKED N#CCC[C@@H](N[C@@H]1CCc2cc(F)c(Cl)cc21)c1ccccc1 527876632 TWHHDIZUXDWNQW-RTBURBONSA-N 328.818 5.101 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCC[C@@H](C)C1 530402004 JJXSWRVBTKWMPK-SJLPKXTDSA-N 329.484 5.072 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(-c2ccncc2)cc1 539609089 DCQWSWSRXBOKAW-HOTGVXAUSA-N 345.421 5.171 30 20 EKED C=CCC(C)(C)C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 556932356 WWUUNCYKLVJAQM-OAHLLOKOSA-N 339.401 5.014 30 20 EKED C=CCCCN(C)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 581146028 NINOVXYVVNIAPM-UHFFFAOYSA-N 337.341 5.004 30 20 EKED Cc1cc(C)c(-c2csc(NC(=O)CCCCCC#N)n2)cc1C 588264582 JEMPDMPYNAAFQP-UHFFFAOYSA-N 341.480 5.148 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC1CCCCC1 609434605 BZLLXRYHASQUQD-HNNXBMFYSA-N 345.512 5.173 30 20 EKED CC(C)c1ccc([C@@H](C)CC(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610361400 COXGFFSELGWBRU-DLBZAZTESA-N 334.463 5.053 30 20 EKED C=C[C@@H](CC(=O)N(C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 677504623 SGTGFYMUSNVJGZ-INIZCTEOSA-N 347.380 5.024 30 20 EKED Cc1ccc2c(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)csc2c1 684629868 IZERWHLPNKSRMD-INIZCTEOSA-N 342.423 5.248 30 20 EKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(C4CCCC4)cc3)[nH]c12 685788298 KDFCOVZVIQPMJZ-GOSISDBHSA-N 343.430 5.019 30 20 EKED Cc1cccc2c1C/C(=C/c1csc(-c3ccc(F)cc3)n1)C2=O 729151521 SUIULGDGFPACBY-ZROIWOOFSA-N 335.403 5.080 30 20 EKED CCCCCCCC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 753735449 XAHOMSQGFVLMNO-QGZVFWFLSA-N 347.890 5.240 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@H]1C[C@H](O)c1ccccc1 769735867 ZBLHQSOEKYBCBX-SFTDATJTSA-N 342.527 5.075 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cnc(-c2ccco2)s1 789127364 JEFLKZDLBRHBBT-CMDGGOBGSA-N 334.400 5.089 30 20 EKED C=CC[C@@H](NCc1sc2c(Cl)cccc2c1C)c1ccncc1 815124952 PJPILAXWFUVWEK-QGZVFWFLSA-N 342.895 5.665 30 20 EKED CCCCCCCC(=O)Nc1cccc(NC(=O)c2cccs2)c1 887344074 KNGAPMMWZARUNE-UHFFFAOYSA-N 344.480 5.299 30 20 EKED CC[C@@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1cccc(C#N)c1 902940792 ZMXUNHNUEUCOAH-LJQANCHMSA-N 349.478 5.415 30 20 EKED CC(=NNc1nccc2sccc12)c1sc(C(C)(C)C)nc1C 915980565 UOBROCNJMRSPFU-UHFFFAOYSA-N 344.509 5.195 30 20 EKED CCCOc1c(/C=C\C(=O)c2ccc(F)cc2F)cccc1OCC 916128103 KYRAVBVHFLHDNC-FLIBITNWSA-N 346.373 5.048 30 20 EKED C#Cc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)c1 916673334 BDFRMWPJVYJVTC-OAQYLSRUSA-N 346.474 5.334 30 20 EKED CCCCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1 1776033286 YWEQOAVULROQIU-UHFFFAOYSA-N 344.842 5.435 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2)o1 1776782723 CBSQQFGFYICUFV-GOSISDBHSA-N 343.467 5.240 30 20 EKED CC[C@H]1CCCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 159296812 KDICODRPZHKJLI-HOTGVXAUSA-N 345.512 5.267 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)nc1 189868227 MKCJAXGFKZXGHR-UHFFFAOYSA-N 348.368 5.205 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc1 237512251 ZQXARMAAQFMPRM-GOSISDBHSA-N 344.458 5.164 30 20 EKED Fc1ccc(NCCCCC(F)(F)F)c(OCCC(F)(F)F)c1 409846300 DXUCFYNRHSMMSH-UHFFFAOYSA-N 347.274 5.301 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)Cc1cccs1 475579600 WFXCMLVCYOILIP-OAHLLOKOSA-N 342.508 5.353 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(C)ccc2o1 476168473 XBTPLUXUCNVPRN-UHFFFAOYSA-N 333.431 5.845 30 20 EKED N#Cc1ccc(CNc2cccc(COC3CCCCC3)c2)cc1F 479503860 SJRIYLGLINMQOI-UHFFFAOYSA-N 338.426 5.159 30 20 EKED Cc1cc(C)c(C#N)c(SCc2cc(Cl)cc3cccnc23)n1 505850755 IQFVWZZDISEYNL-UHFFFAOYSA-N 339.851 5.064 30 20 EKED C[C@H](SCc1ccc(C#N)cc1F)c1ccc(OC(F)F)cc1 524238579 RUBWZBALDHDHSO-NSHDSACASA-N 337.366 5.293 30 20 EKED C=C[C@@H](CC(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 535404701 CFMIJPHANWPGCI-HNNXBMFYSA-N 333.353 5.090 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1-c1c(F)cccc1F 588757493 ASJHVWPMALPPFM-UHFFFAOYSA-N 328.362 5.044 30 20 EKED CC(C)=CCCSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 596416093 ALHPNMYXUMYSRK-HNNXBMFYSA-N 348.537 5.109 30 20 EKED C[C@H](SCC(=O)Nc1cccc(C#N)c1)c1ccc2ccccc2c1 604070544 NVSOFHZUVIMEGZ-HNNXBMFYSA-N 346.455 5.144 30 20 EKED N#CCOc1cccc(/C=C\c2nc(-c3ccc(F)cc3)cs2)c1 727745003 ZBWOJZLKLRHROI-WTKPLQERSA-N 336.391 5.022 30 20 EKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)CC(C)(C)C 730421778 PKGQLNZTZCPYAX-DGCLKSJQSA-N 332.444 5.074 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1cccc(Cl)c1Cl 734977056 AUFWTBGJXRRDJQ-UHFFFAOYSA-N 330.218 5.378 30 20 EKED C[C@@H](ON=Cc1ccccc1C(F)(F)F)c1ncc(C(C)(C)C)o1 756848054 FJQXUUJUEIXLGT-LLVKDONJSA-N 340.345 5.103 30 20 EKED CC(C)C[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 765590224 JXNOOZOEJHDXIE-SWLSCSKDSA-N 346.883 5.322 30 20 EKED C=CC[C@H](N[C@H](C)c1sc(C(C)(C)C)nc1C)c1ccncc1 766018813 JAFITRZUOMUELP-CJNGLKHVSA-N 329.513 5.112 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccc(Cl)cc1Cl)c1ccncc1 766021475 TYGVHYJFZUZZJF-ZWKOTPCHSA-N 335.278 5.747 30 20 EKED C=C(C)[C@H](N[C@H](C)c1ccc(C)c(C)c1O)c1ccc(F)c(F)c1 775556751 ACKNVTOLCVVZSS-KUHUBIRLSA-N 331.406 5.255 30 20 EKED CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2ccccc2SCC#N)CC1 781461084 WMWCCAIIWGHHJM-CVEARBPZSA-N 344.524 5.027 30 20 EKED Cc1cc2c(cc1C)C(=O)/C(=C\c1scnc1C1CC1)CS2 782352278 RMXZCDZWVGLKJO-QPEQYQDCSA-N 327.474 5.009 30 20 EKED CCCC(C)(C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 786321768 IOXCYXZDEWXODD-LBPRGKRZSA-N 334.872 5.342 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1c(F)cccc1Cl 60459882 KUGLYSQVXWXPIT-UHFFFAOYSA-N 344.238 5.022 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1c(Cl)ccc2cccnc12 63750691 MCFALLRNNAMSDW-UHFFFAOYSA-N 349.865 5.170 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccccc3C#N)s2)cc1 179085569 NZVBDYAMGUXAKK-HNNXBMFYSA-N 347.487 5.149 30 20 EKED C[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 237415987 LJQFRSHOHWGFBU-CQSZACIVSA-N 336.822 5.322 30 20 EKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1OC 358343398 HJCVXQWATCUAJT-RBUKOAKNSA-N 342.870 5.434 30 20 EKED Cc1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)ccc1C1CC1 360821932 NQWNZFXIVZOHQY-FQEVSTJZSA-N 333.435 5.039 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccc(F)cc1)c1ccccc1 435100131 CAHWOXUVSZMYAA-UZLBHIALSA-N 340.442 5.236 30 20 EKED CC[C@H](N[C@@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 447579360 KHAPLQFJDCTCIC-SFTDATJTSA-N 346.499 5.644 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)CC(C)(C)C#N)cc1 500410068 OJLXPBIRRQJILM-HNNXBMFYSA-N 338.476 5.418 30 20 EKED COc1ccccc1CCCNc1ccccc1S[C@H](C)CC#N 502635575 PREGYTDECIAPSK-MRXNPFEDSA-N 340.492 5.134 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(O[C@H](C)CC)c1 513542821 JYPJXPVPXOTXGH-QGZVFWFLSA-N 338.451 5.084 30 20 EKED N#Cc1c(NC(=O)CC2=CCCCC2)sc2c1-c1ccccc1CC2 520715381 UYOUFETVHQQYSE-UHFFFAOYSA-N 348.471 5.214 30 20 EKED Cc1oc(-c2cccs2)nc1CSCc1cccc(C#N)c1F 538149237 OZLKCMMDYYMWRO-UHFFFAOYSA-N 344.436 5.156 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(-c2ccccn2)cc1)c1ccccc1 581520450 XTTVJWKFKMJWTH-QGZVFWFLSA-N 328.415 5.047 30 20 EKED CC(C)(C)c1ccc(C#N)c(N[C@H](CCCC#N)c2ccccc2)n1 590062355 UVLCVCPBXGTMKW-GOSISDBHSA-N 332.451 5.098 30 20 EKED COc1ccc([C@H](NCCCCC(C)(C)C#N)c2ccccc2)cc1 595637409 VNZXJGLWZWLUTO-OAQYLSRUSA-N 336.479 5.094 30 20 EKED CCc1ccc(/C=C\C(=O)c2sccc2Br)s1 731157370 WDKGVBGSKPHOBZ-WAYWQWQTSA-N 327.268 5.031 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)s1 736433225 OVYGOFAKAVUCJL-BQYQJAHWSA-N 339.382 5.356 30 20 EKED C#CC[C@@H](OC(=O)C[C@@H](C)c1ccc(C(C)C)cc1)c1ccccn1 739171231 YVUBFGUBIBKYGI-DYESRHJHSA-N 335.447 5.006 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 750904781 IBUYTOPDGSBNAJ-JHMJBTLWSA-N 347.292 5.066 30 20 EKED O=C(/C=C\c1cccc(-c2cccnc2)c1)c1ccc(O)c(Cl)c1 768754226 DOVHMKXWUGZVIF-VURMDHGXSA-N 335.790 5.004 30 20 EKED CN(CCC#N)c1ccc(CN[C@@H](CC2CCC2)c2ccccc2)cc1 778113191 AUECDYKAUJDMGA-QHCPKHFHSA-N 347.506 5.058 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCCC[C@H]1c1nc(C)no1 804858717 FIEJHFGSAQGISF-WMZOPIPTSA-N 349.519 5.208 30 20 EKED CCCC[C@@H](CC)CCCN(C)C(=S)Nc1ccccc1C#N 853054957 DGKGMXDHLNMTGC-MRXNPFEDSA-N 331.529 5.183 30 20 EKED Cc1c(NN=C2CC[C@@H](c3cccc(Cl)c3)C2)cccc1C(=O)O 1776088309 DIEOWZBXXSWOIR-CQSZACIVSA-N 342.826 5.082 30 20 EKED C=CCc1ccccc1/C=C\c1nc(C(=O)O)c(-c2ccccc2)s1 1776189047 DEMBWNVYSZBCPU-YPKPFQOOSA-N 347.439 5.407 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(F)c2ccccc12)c1ccccc1 352166170 MENFCEZICKPKNW-NRFANRHFSA-N 346.405 5.144 30 20 EKED Cc1nc(S[C@@H](C)c2cccc(C#N)c2)[nH]c1Cc1ccccc1 442912106 IOKQVHUYJMEDLW-HNNXBMFYSA-N 333.460 5.034 30 20 EKED Cc1ccccc1[C@H](C)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458799532 JMNUZWRJCODPID-GHTZIAJQSA-N 349.478 5.133 30 20 EKED N#Cc1ccnc(S[C@@H](c2ccccc2)c2ccc(F)c(F)c2)c1 463252128 YYCBHPBXGCWCBJ-IBGZPJMESA-N 338.382 5.113 30 20 EKED CC[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)s1 476048723 FTMMSYYIAPFRQJ-AWEZNQCLSA-N 346.883 5.084 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(F)cc3C#N)cs2)o1 488532532 WOXYCNCFCUGERY-UHFFFAOYSA-N 344.436 5.156 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1 488682176 WWBVMJZICUKVMM-NRFANRHFSA-N 348.446 5.058 30 20 EKED CCC(CC)N(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CC1 530945630 HWNYYZVEXCZZJJ-AWEZNQCLSA-N 345.512 5.123 30 20 EKED C=C(C)[C@H](Cc1nc([C@H](c2ccc(Cl)cc2)C(C)C)no1)OCC 578099275 LQLHFLIQQWNGCD-WMZOPIPTSA-N 348.874 5.035 30 20 EKED C=CCCCN(C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C 605884791 UJMNRJMKTVFJDT-INIZCTEOSA-N 342.405 5.010 30 20 EKED CC(C)CC(=O)Nc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1 611466581 PSZYMWSGXCVLBF-NRFANRHFSA-N 347.462 5.032 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3ccc(F)cc3s2)n1 673813677 GNHNCBLZIDVSEI-LBPRGKRZSA-N 344.436 5.110 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(Cc2ccccc2)C1 682776955 BRHRBDKVINAVMN-UHFFFAOYSA-N 348.490 5.245 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cn1 732713700 FZXHKDZCZIECJO-KPKJPENVSA-N 340.492 5.395 30 20 EKED C=CCCCC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 748525357 ZMXSZUZEEPVHDK-LBPRGKRZSA-N 344.307 5.267 30 20 EKED C#CC[C@H]1CCCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 831046484 BBZPBVBHWHUSJC-KRWDZBQOSA-N 326.484 5.201 30 20 EKED N#CCCC[C@@H](NCc1cc2c(O)cccc2s1)c1ccccc1 894854650 IZZLAOZZHCZNIK-GOSISDBHSA-N 336.460 5.132 30 20 EKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 916134297 JSDXZIWQVJSRFZ-KHPPLWFESA-N 325.820 5.360 30 20 EKED CCCCCCn1c(S[C@@H](C)C#N)nnc1-c1ccc(Cl)cc1 60382870 ZCSBYIFERXGPTO-ZDUSSCGKSA-N 348.903 5.183 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(s1)CCC2 189902890 HXURBVHUDKQWFU-UHFFFAOYSA-N 325.477 5.341 30 20 EKED CC(C)c1ccc(NC(=O)c2ccccc2OCC#N)c(C(C)C)c1 194190406 UCOQWMOTTRXMAH-UHFFFAOYSA-N 336.435 5.088 30 20 EKED Cc1ccc(Nc2nnc(SCCCCC#N)s2)cc1Cl 216604021 YVYHSVJDGUKMEF-UHFFFAOYSA-N 338.889 5.030 30 20 EKED N#CCCCOc1cccc(NCc2ccc(-c3ccccc3)o2)c1 237827086 HGDUZRQTSFLURD-UHFFFAOYSA-N 332.403 5.241 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1CSCC 410347400 NNLXRQWKFKGNFI-UHFFFAOYSA-N 325.477 5.311 30 20 EKED C[C@@H]1Cc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@@H](C)C1 411011348 LVKIACKQRZZBIM-QWRGUYRKSA-N 340.448 5.028 30 20 EKED Cc1ccc(Cl)cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 431697593 PDPFMBFHDSZNFD-QGZVFWFLSA-N 341.842 5.205 30 20 EKED CC(C)(c1ccc(NCc2ccc(F)c(C#N)c2)cc1)C(F)(F)F 432320049 LJVJUPJNJCKYMD-UHFFFAOYSA-N 336.332 5.149 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccccc1SC[C@H](C)C#N 438060895 IUNMVFOTBPBOQS-CQSZACIVSA-N 333.501 5.029 30 20 EKED C[C@H](N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1(C)CC1 438688330 VMIQZBXWVFNCNM-HNNXBMFYSA-N 349.434 5.003 30 20 EKED CC[C@@H](C)c1ccc([C@H](NC(=O)CCCC#N)c2cccs2)cc1 461757938 UCMHOJPWPPPBET-QRWLVFNGSA-N 340.492 5.161 30 20 EKED Cc1ccc(Cl)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 476866699 WXSBZYGFVGDPOK-UHFFFAOYSA-N 340.835 5.296 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccc(F)cc1)C1CCC1 487366880 RCRBXJBJSKZWJE-OAQYLSRUSA-N 336.454 5.258 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCC1CCCCC1 521327183 VDRBMMWCTOOJDI-MRXNPFEDSA-N 344.524 5.770 30 20 EKED COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)cc2)cc1 540609610 UXEYEYJWXIGMGM-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 557272581 BEPWSRRORSKWQV-FZKQIMNGSA-N 333.262 5.689 30 20 EKED C=CCCCN(C)C(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 605644986 GLZLMRZGGUGXNN-UHFFFAOYSA-N 346.430 5.047 30 20 EKED C=CCN(C(=O)c1ccc(CC)cc1)c1nc(-c2ccccc2)cs1 641902261 RGJUXCFNLFKTFX-UHFFFAOYSA-N 348.471 5.205 30 20 EKED C=CCN(Cc1cc(-c2ccccc2)no1)Cc1ccc(Cl)s1 673083970 UAHDGEQBJZIOPU-UHFFFAOYSA-N 344.867 5.245 30 20 EKED C=CCC[C@@H](Nc1nnc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 683459445 SEHNWTMPBOFPGY-CQSZACIVSA-N 337.345 5.085 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1cc2ccccc2o1 727264526 VGVJVZJWAYNECO-KHPPLWFESA-N 331.396 5.452 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1cccc(Cl)c1 727264661 YAXQTAKKQMRHOC-KTKRTIGZSA-N 325.820 5.360 30 20 EKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)CSc2ccccc21 727975209 BRFKTALHCSMQGM-UVTDQMKNSA-N 335.453 5.182 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cccc4[nH]ccc34)c2)s1 740013749 KLFNNOGSXABMKB-UHFFFAOYSA-N 343.455 5.058 30 20 EKED C[C@@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 776518790 XIWARNQCHLWIGW-ZLDLUXBVSA-N 344.867 5.076 30 20 EKED N#CCOc1cccc(NCc2ccc(-c3ccccc3F)s2)c1 779585488 CTDQHGZAGZHWSD-UHFFFAOYSA-N 338.407 5.069 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(SC(F)F)cc1 782325111 KXKBLBUFJZZJSJ-KRXBUXKQSA-N 341.382 5.446 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792101833 HCVNTSQTAFDVTI-UWJYYQICSA-N 342.442 5.070 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(Cl)cc1 794996066 RYAMNUUKTKFXTF-UHFFFAOYSA-N 330.884 5.115 30 20 EKED CCc1ccc([C@@H](CC(C)C)NCc2ccc(OCC#N)cc2)cc1 795304880 YAWRFSJDNILGLH-JOCHJYFZSA-N 336.479 5.028 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccn2)c(C)c1 819841766 FQHXMMOTFJPFLD-QBFSEMIESA-N 343.426 5.174 30 20 EKED CCCCCCCC(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 918607998 UQJVYRORJOUILU-GOSISDBHSA-N 326.484 5.234 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc2ccccc2c1 1776784816 ZSQYINKKFVDBIY-FQEVSTJZSA-N 327.468 5.133 30 20 EKED Cc1ccc(-c2cc(CSCc3ccc(C#N)cc3F)on2)cc1 30526829 IEKRIVXLKOLCLF-UHFFFAOYSA-N 338.407 5.094 30 20 EKED C=CCN(C(=O)CC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 61204817 OKGPCIMPSUIBRZ-UHFFFAOYSA-N 341.263 5.046 30 20 EKED N#CCC[C@@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 90666021 JPZGUJJRZSAEGW-UXHICEINSA-N 332.447 5.068 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(SCC)nc1 189877714 QLWUTZRVSZMSSX-UHFFFAOYSA-N 340.492 5.298 30 20 EKED C[C@@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1ccc(C#N)cc1 296179313 CRYDBKHTBVEFRB-ZIAGYGMSSA-N 332.369 5.075 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C)[C@@H](C1)C2(F)F 297754731 KNPROFUFUMRMGV-VQIMIIECSA-N 348.437 5.048 30 20 EKED N#CCC[C@H](Nc1nc(-c2ccc(F)cc2)cs1)c1ccccc1 301790097 NJMIUVMGNWPHLH-KRWDZBQOSA-N 337.423 5.406 30 20 EKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](CC)c1ccccc1 303061539 UVAYOXWTGAABIK-IBGZPJMESA-N 349.503 5.298 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCC[C@H](SC)C1 475552186 BSOMDRFNDSWGFF-IRXDYDNUSA-N 346.540 5.334 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)CC(C)(C)C#N)c1 484668365 CGZPOYLCYDALHC-UHFFFAOYSA-N 326.827 5.194 30 20 EKED COc1ccccc1CCCNc1ccccc1S[C@@H](C)CC#N 502635574 PREGYTDECIAPSK-INIZCTEOSA-N 340.492 5.134 30 20 EKED Cc1cccc([C@@H](NCc2ccccc2C(C)(C)C#N)C(F)(F)F)c1 510452347 GDSLTIMNAOGROD-GOSISDBHSA-N 346.396 5.189 30 20 EKED C[C@@H](N[C@H](C)c1cncs1)c1ccc(-c2cccc(C#N)c2)cc1 542105934 HTJUSZKDJYIXDY-HUUCEWRRSA-N 333.460 5.094 30 20 EKED Cc1ccc2cc([C@H](C)N[C@H](CCCC#N)c3ccccc3)oc2c1 551214050 ALLUYBQHCZWQPZ-FXAWDEMLSA-N 332.447 5.827 30 20 EKED CC(C)c1ccoc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 551520488 IJGYUBUVJHKYQA-UHFFFAOYSA-N 342.464 5.247 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c2ccccc2c1OC 557018348 DLHYXFZSAVGPRA-UHFFFAOYSA-N 348.446 5.281 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H](c2nc3ccccc3s2)C1 580931624 JRSRMOKFVRYNRG-MRXNPFEDSA-N 341.524 5.196 30 20 EKED C=CCOc1ccc(CN[C@@H](c2cccnc2)C2CCCCC2)cc1 590798487 YTQUMJCMFUAVAJ-JOCHJYFZSA-N 336.479 5.058 30 20 EKED N#CC1(CSCc2coc(-c3cc(Cl)cc(Cl)c3)n2)CC1 600651296 GIEVGISPTWMEPA-UHFFFAOYSA-N 339.247 5.185 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cc(Cl)ccc1OC 610829807 MYLMGYNTOZNFKA-SCLBCKFNSA-N 328.843 5.022 30 20 EKED CC/C(=C/C(=O)Nc1ccccc1SCCC#N)c1ccccc1 730982334 OLMCHMOSIHVRSE-NXVVXOECSA-N 336.460 5.124 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C\C1CCCCC1 735440036 BXBADYTZQSPLGZ-QYMJWVLRSA-N 328.481 5.156 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 744119480 RXGZNWVBMQPUGS-OCCSQVGLSA-N 332.444 5.218 30 20 EKED C=CC[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccncc1 766022500 WJMXBQPARISACH-IRXDYDNUSA-N 330.884 5.179 30 20 EKED Cc1ccoc1C(=O)/C=C\c1cccc(/C=C/C(=O)c2occc2C)c1 769784548 YYCJSQBVAJIKMR-MKKAVFGOSA-N 346.382 5.282 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(N2CCCCC2)cc1 782302072 GVWULXRIXLTALU-VZUCSPMQSA-N 342.442 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](OCC)C1CCCC1 867727056 PUSFUFQXEXHXNT-FQEVSTJZSA-N 329.484 5.072 30 20 EKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)CC(C)(C)C 917046975 NYQZSKHQEFLNOS-AAEUAGOBSA-N 348.899 5.588 30 20 EKED C[C@@H](Cc1nnc(S[C@@H](C)c2ccc(C#N)cc2)o1)c1ccccc1 118172844 DORSHPJBJAYQCS-GJZGRUSLSA-N 349.459 5.141 30 20 EKED C[C@@H](Sc1cc(C#N)ccn1)c1ncc(-c2ccc(Cl)cc2)o1 119145914 CTUCQCWTGQVAGH-LLVKDONJSA-N 341.823 5.115 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C(C)(C)C)s2)n1 126043735 PZQMZQIGHKHUPB-LLVKDONJSA-N 332.494 5.116 30 20 EKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)CC2 187803056 LFTTWLFNTKKHPG-OPAMFIHVSA-N 334.463 5.050 30 20 EKED N#Cc1ccc(C(F)(F)F)c(NCc2ccc(C(F)F)cc2)c1 302403146 LHPTXGMHPKBMRG-UHFFFAOYSA-N 326.268 5.127 30 20 EKED CCCc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)sc1C 352174024 JDORRONYPLZSCW-SFHVURJKSA-N 340.492 5.174 30 20 EKED N#C[C@H](CCc1ccccc1)C(=O)Nc1ccccc1-c1ccccc1 433223769 SMQZMLUUBCGEEY-FQEVSTJZSA-N 340.426 5.065 30 20 EKED Cc1ccc(Oc2ccccc2)c(NC(=O)c2cccc(CC#N)c2)c1 440619598 WMVHBYISGZEQFH-UHFFFAOYSA-N 342.398 5.106 30 20 EKED CCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)oc2ccccc12 453689712 JFDKCCKVXCVNPZ-AWEZNQCLSA-N 338.432 5.065 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1CN(C)c1ccccc1 469306806 MCZNCQYJIIUXFC-UHFFFAOYSA-N 334.463 5.030 30 20 EKED CCCn1c(SCCCC(C)(C)C#N)nnc1-c1cccc(C)c1 476489119 LMGOJXNQXZRIMS-UHFFFAOYSA-N 342.512 5.086 30 20 EKED CC[C@@H](NCc1ccc(Cl)cc1C#N)c1ccc(Cl)s1 481067615 GLDJMPDOCDWASN-CYBMUJFWSA-N 325.264 5.167 30 20 EKED C=CC[C@H](C(=O)Nc1cnn(C(CC)CC)c1CC)c1ccccc1 482692460 SIIBPOMCNDQQMO-SFHVURJKSA-N 339.483 5.105 30 20 EKED CC(C)(C#N)CCCNc1cccc(OCc2cccc(F)c2)c1 531649317 WBXIEQVMNWQSRD-UHFFFAOYSA-N 326.415 5.147 30 20 EKED C=CCC[C@H](NCc1scnc1C)c1ccc(C(F)(F)F)cc1 532725989 WUKASEFAQGPQTM-HNNXBMFYSA-N 340.414 5.267 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CCC(C)(C)C 541624017 NGNHWMQZBGQRTM-GJZGRUSLSA-N 332.513 5.339 30 20 EKED CC[C@@H](C)n1c(SCc2ccc(C#N)cc2)nnc1-c1ccccc1 604548111 NLGPEUBZRAINMB-OAHLLOKOSA-N 348.475 5.080 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2nccn2Cc2ccccc2)cc1 734095443 AWPCQMGKTGKFOH-BUHFOSPRSA-N 344.458 5.125 30 20 EKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1cccc(OC(F)F)c1 741848508 NNQMJFNFMOXEJE-AATRIKPKSA-N 332.277 5.069 30 20 EKED Cc1cc(C)c(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1C 743057910 VPWBJNLWXODWAG-RMKNXTFCSA-N 344.414 5.090 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(C#N)s2)cc1 762448003 UKLOJDRJPCQZJT-WQLSENKSSA-N 345.423 5.191 30 20 EKED CC[C@@H](NCc1cc(Cl)ccc1OCC#N)c1cccc(Cl)c1 774874875 NFJIBDFLRQTXHC-QGZVFWFLSA-N 349.261 5.137 30 20 EKED O=C1/C(=C/c2scnc2C2CC2)CSc2ccc(Cl)cc21 782323363 NEAGOWQJRGUTTI-BJMVGYQFSA-N 333.865 5.046 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1 792759699 BUVJOJYHOACBFK-CQSZACIVSA-N 346.402 5.027 30 20 EKED C=CCC(C)(C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 814576348 AVIIUJSQAVEZLB-HXUWFJFHSA-N 347.462 5.066 30 20 EKED C=CCCC(C)(C)CNc1ccc([S@@](=N)(=O)C(F)(F)F)cc1 882679900 FBJXCIRMSWTOKB-JOCHJYFZSA-N 334.407 5.016 30 20 EKED CC(C)c1cccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)c1 1776375386 LGZALASVWPAEAA-VURMDHGXSA-N 334.371 5.151 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cccc1C(C)C 56543010 QHMHYNYJRXAODD-UHFFFAOYSA-N 340.442 5.478 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171244746 OHDIVRNACDYQFC-UHFFFAOYSA-N 347.462 5.187 30 20 EKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 193495191 PXUKPCNGERQRAK-HXUWFJFHSA-N 347.462 5.165 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1scnc1C(C)C 410750055 BFVOWNBANSWHKL-UHFFFAOYSA-N 328.481 5.371 30 20 EKED CC(C)O[C@@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 433025267 JGWUBMJHDGRHPR-VXKWHMMOSA-N 336.479 5.177 30 20 EKED CC1(C#N)CCC(NC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 449100876 CWHHPWIRTFOFMK-UHFFFAOYSA-N 340.417 5.116 30 20 EKED C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 466650556 JIKHIWYTTMZBFY-ZQIUZPCESA-N 339.401 5.217 30 20 EKED N#Cc1ccc(SC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 484282827 SEYIFGPPPGCGHR-UHFFFAOYSA-N 346.411 5.348 30 20 EKED C=CCOc1cccc(CN[C@@H](C)c2ccc(SCC)cc2)c1 504029695 DLGZVVGDNRQCDO-INIZCTEOSA-N 327.493 5.214 30 20 EKED C[C@@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 512523663 LJSGNNQGYATDRG-MRXNPFEDSA-N 349.434 5.147 30 20 EKED Cc1ccc([C@@H]2CCCN2Cc2cccc(OCCCC#N)c2)s1 513478398 CYCICRJTNMBODJ-IBGZPJMESA-N 340.492 5.076 30 20 EKED N#Cc1cccnc1N[C@@H](c1ccccc1)c1cccc2ccccc12 520330954 GNRZDOCHZIOAQD-QFIPXVFZSA-N 335.410 5.308 30 20 EKED C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554391603 ULBUVNARSGMAKI-DOTOQJQBSA-N 341.499 5.166 30 20 EKED N#CC[C@H](CC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 554778870 AOALOJAOCAKUTL-CYBMUJFWSA-N 348.780 5.304 30 20 EKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(F)c1 582519595 QEZDGZKGYSIPGQ-AWEZNQCLSA-N 333.366 5.058 30 20 EKED N#Cc1ccccc1NC(=O)c1ccc(Oc2cccc(Cl)c2)cc1 609092251 DQTITNIBSRRWTP-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(Cl)cc1 609387257 VKZHFAVUCWNGQO-ZIAGYGMSSA-N 330.884 5.765 30 20 EKED CCc1cccc2c(C=NOc3ccccc3C(F)(F)F)c[nH]c12 754710191 RSERRKZPVMFTDP-UHFFFAOYSA-N 332.325 5.162 30 20 EKED CCN(Cc1ccc(O[C@H](C)C#N)cc1)[C@H](C)c1cc2ccccc2o1 769081607 LFJKJEAPPKQBQJ-IAGOWNOFSA-N 348.446 5.307 30 20 EKED O=C(/C=C/c1ccc(-c2cccc(Cl)c2)s1)c1ccnc(O)c1 806555034 JUQWEIBWHHYANW-GQCTYLIASA-N 341.819 5.065 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1cccc2cccnc12 818198194 PPYQTYCZFZYSJX-UHFFFAOYSA-N 337.426 5.276 30 20 EKED Clc1cnc(NN=Cc2c(Cl)cccc2Cl)c(Cl)c1 916317011 VHICNUUDAXCEFM-UHFFFAOYSA-N 335.021 5.141 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)[C@H](C)c1ccc(CC(C)C)cc1 1776012434 SEXGQHCFPFZJDM-HNNXBMFYSA-N 338.451 5.175 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(/C=C/C(=O)O)cc1)CC2 1776374763 NOVMWEWBJSYOGR-AADXMYGNSA-N 346.426 5.120 30 20 EKED CCCCCOc1ccc(C(=O)Nc2sc(CC)cc2C#N)cc1 59829160 RFPJNXFMSCCLSU-UHFFFAOYSA-N 342.464 5.003 30 20 EKED N#Cc1ccc(N[C@@H](Cc2ccccc2Cl)c2ccccc2)nc1 63282311 GHAOORJJDWVBIM-IBGZPJMESA-N 333.822 5.003 30 20 EKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1cc(F)ccc1F 179799655 INENUVAXEJTQEW-IBGZPJMESA-N 328.406 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)ccc1[N+](=O)[O-] 276473983 QJHWGLQYHSZEQL-UHFFFAOYSA-N 338.407 5.007 30 20 EKED CC[C@H](C#N)Oc1cccc(CNc2nc(-c3ccccc3)cs2)c1 301623271 YWASWEWWJFKUOA-QGZVFWFLSA-N 349.459 5.103 30 20 EKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 424356103 UWJUMWCKNOHIBV-MGPUTAFESA-N 342.870 5.434 30 20 EKED CCSc1ccc([C@H](C)NCc2ccc(C#N)cc2Cl)cc1 439445380 CMMOPZRRDIIRPN-ZDUSSCGKSA-N 330.884 5.174 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cccc(C#N)c1 464370625 ZXMWYKAJWGQAAV-QGZVFWFLSA-N 340.426 5.058 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@H]2CCCc3sccc32)CC1 468048341 KJAQOCMWNSSRJH-BIXGBWIQSA-N 336.504 5.119 30 20 EKED N#Cc1nnc2ccccc2c1Oc1ccc(Cl)c2ccccc12 525358980 VUZHISLQGMIULM-UHFFFAOYSA-N 331.762 5.100 30 20 EKED CC(C)Oc1ccc2ccccc2c1CN[C@@H](C)c1cccc(C#N)c1 545236217 ZYTMNJUSJNNBMX-KRWDZBQOSA-N 344.458 5.349 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(F)cc1Cl 546048398 XNFMJHUUCRBDNN-GFCCVEGCSA-N 334.847 5.485 30 20 EKED C=CCC[C@H](NC1CCN([C@H](C)c2ccccc2)CC1)c1ccco1 556867307 GUYKZKIAMMMJNB-NQIIRXRSSA-N 338.495 5.102 30 20 EKED CC(C)c1ccc([C@H](NC(=O)CCCCC#N)c2cccs2)cc1 593953924 GKDSGGREOSYRSF-FQEVSTJZSA-N 340.492 5.161 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(F)cc1C(F)(F)F 599042266 AKEGQVLMIORUTL-ZMZPIMSZSA-N 348.343 5.054 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](OC)C1CCCCC1 613901079 NDLUQGSEOVZMIC-HXUWFJFHSA-N 329.484 5.072 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3c[nH]c4ccccc34)s2)cc1 734304222 GEXLCRYEOXPTHH-KHPPLWFESA-N 344.439 5.496 30 20 EKED CO[C@H](C/N=C/c1c(O)ccc2ccccc12)c1ccc(Cl)cc1 741755259 AKKYBWAIMLDRPH-XLKWYTADSA-N 339.822 5.005 30 20 EKED CCCCCCCCCC(=O)Nc1ccc(C)c(N2CCOC2=O)c1 746351955 FFVCHHCYTMJIPS-UHFFFAOYSA-N 346.471 5.031 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1SCc1cnc(Cl)s1 768381596 AHMOHHVAMAFJDE-UHFFFAOYSA-N 343.864 5.022 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@@H]1C[C@H](O)c1cccs1 769729659 KICOIRVCJMDNQP-MSOLQXFVSA-N 348.556 5.136 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)n1 797096234 FZHVSQIKYJMYLK-KLHDSHLOSA-N 330.497 5.049 30 20 EKED N#C[C@]1(c2nc(-c3c(Cl)cccc3Cl)no2)CC2CCC1CC2 904306790 MKTNIMDMTJXOJY-NQMJSUOBSA-N 348.233 5.015 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1OCC(C)C 1776786939 CBCRBNRHNVTDAO-IBGZPJMESA-N 349.515 5.015 30 20 EKED C=C(C)[C@H](N[C@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 186448099 RZYUNLVCIUNREG-IRXDYDNUSA-N 334.435 5.014 30 20 EKED C=C(C)[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(F)c(F)c1 187369494 PCUHXKSAVBRZCK-IBGZPJMESA-N 340.373 5.027 30 20 EKED Cc1ccc(-c2ncc[nH]2)cc1N=C(O)[C@@H](C)OC1CCCCCC1 330045627 GMADEJYDVLGOLZ-OAHLLOKOSA-N 341.455 5.101 30 20 EKED N#Cc1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)c(Cl)c1 430362495 FAUAOCYKURGYRJ-MSOLQXFVSA-N 346.817 5.107 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1SC(C)C 473845339 VQERSQHTLHHLAW-UHFFFAOYSA-N 346.521 5.469 30 20 EKED C[C@H](C#N)CSc1ccccc1NCCCc1cccc(F)c1 486201092 UBUAXKBCIKHGFP-OAHLLOKOSA-N 328.456 5.122 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1ccccc1 487349330 BDHHVGLLIOQQBM-PMXSJFBMSA-N 338.495 5.144 30 20 EKED CC(C)(C)c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)s1 487503313 QJNBPAWPEIVSQF-INIZCTEOSA-N 340.492 5.211 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCc1cccc(F)c1F 542233459 NFBOKHCOFDWQMX-ZDUSSCGKSA-N 332.419 5.014 30 20 EKED C[C@H](N[C@H]1C[C@@H]1C(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 554086293 UTQUIADOFZJEFV-CYUDJLOBSA-N 347.249 5.028 30 20 EKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Cl)cc1 566000480 DXJOBDMYOOYHNX-UHFFFAOYSA-N 335.794 5.011 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)CC2 581161253 QVUSJMRUJQSCRZ-PKTZIBPZSA-N 342.417 5.064 30 20 EKED N#Cc1cc(Oc2ccc(NCc3ccccc3C3CC3)cc2)ccn1 589324531 WAIYJGVKKHZINY-UHFFFAOYSA-N 341.414 5.235 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCC(C)(C)C 610095545 YMKOYJKSXLYQTG-AWEZNQCLSA-N 333.501 5.029 30 20 EKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)s1 727262802 YBAGCMJAOJHODI-UHFFFAOYSA-N 348.777 5.179 30 20 EKED N#Cc1c(F)cccc1N1CCC[C@H]1c1ccccc1C(F)(F)F 728053012 ZKWBGIZKTWAMLI-INIZCTEOSA-N 334.316 5.058 30 20 EKED Cc1ccc(COc2ccc(/C=C\C(=O)c3cncc(F)c3)cc2)cc1 737442922 CUBIYNUAKWOADO-FLIBITNWSA-N 347.389 5.004 30 20 EKED C=CCCNc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 740874171 FQOFGIUKHAWJRG-UHFFFAOYSA-N 330.350 5.040 30 20 EKED C/C(=C\C(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 773984987 XUFHPXYEPPSSGO-OANVXVOSSA-N 332.856 5.118 30 20 EKED C[C@@H](NCc1ccc2oc3ccccc3c2c1)c1cccc(C#N)c1 775335520 LJIBKWFAXXUKMD-OAHLLOKOSA-N 326.399 5.308 30 20 EKED CC(/C=C\C(=O)c1ccnc(F)c1)=C\c1ccccc1C(F)(F)F 794720826 IEEWPSQMNCDBSQ-WTVYDBEASA-N 335.300 5.082 30 20 EKED CC(C)(C#N)CCCNc1ccc(OCC(F)(F)F)c(Cl)c1 799969844 ORPWRKGMUVLRPQ-UHFFFAOYSA-N 334.769 5.023 30 20 EKED CCC[C@H](CC(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 835074393 RIJMSXJZWMLFFO-ZIAGYGMSSA-N 347.409 5.070 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(F)c(Cl)c1 918723847 YWZJUNUODPRCIB-UHFFFAOYSA-N 344.927 5.858 30 20 EKED COc1c(Cl)cc(Cl)cc1/C=C/C(=O)c1ccc(F)cc1F 921260883 FVQLJHFSFOPPIT-GORDUTHDSA-N 343.156 5.176 30 20 EKED O=C(O)c1cc(NN=C2CC(c3ccccc3Cl)C2)ccc1Cl 1776033913 XIJGBMSWDGUAJK-UHFFFAOYSA-N 349.217 5.037 30 20 EKED Cc1c(NN=CC2CCC(c3ccccc3)CC2)cccc1C(=O)O 1776088178 VKEXMWPKSWYPKA-UHFFFAOYSA-N 336.435 5.065 30 20 EKED CCOc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1 96316173 PGAQPQUIVRJMDJ-SEYXRHQNSA-N 335.428 5.105 30 20 EKED CSc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1F 340439195 BYRQASRBUBWGIO-HNAYVOBHSA-N 342.483 5.633 30 20 EKED COc1ccc2c(c1)CCC[C@H]2N[C@H](CCCC#N)c1ccccc1 340446783 HEWPFWZVEJTTAK-FGZHOGPDSA-N 334.463 5.097 30 20 EKED CCCc1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 443944681 FRHYEHUKIVESRN-UHFFFAOYSA-N 345.446 5.150 30 20 EKED N#Cc1ccc(CN(C(=O)Nc2cccc(C3CCC3)c2)C2CC2)cc1 463850669 XYISFNWIRJWUBP-UHFFFAOYSA-N 345.446 5.022 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2cccc(F)c2)n1 519003333 XFEPQSLBLVCJAV-SNVBAGLBSA-N 340.345 5.273 30 20 EKED C[C@H](SCc1csc(-c2ccco2)n1)c1ccc(C#N)cc1 522839961 UCBRNBGNWPASRD-LBPRGKRZSA-N 326.446 5.269 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NC(c1ccccc1)c1ccccc1 553304960 BKKCRJWTBLSDJD-HSZRJFAPSA-N 338.454 5.315 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 588273910 JWDRLHRNDNATIY-FQEVSTJZSA-N 340.854 5.020 30 20 EKED CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CCCCCC#N 588760179 WATJCKHLQSWZLL-FQEVSTJZSA-N 348.918 5.750 30 20 EKED CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)c1cccc(CC#N)c1 609509574 DYWLTJFOUVAQON-NRFANRHFSA-N 334.463 5.002 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)[C@H]1CCCCO1 654047737 UWDPNXKQCCBLBX-RTBURBONSA-N 344.499 5.008 30 20 EKED C=CCC[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CC1 676637742 QTRMZQNRMMLEQI-DGAVXFQQSA-N 343.355 5.230 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccccc1 681653346 TUQXVSPAOJUMPE-HXUWFJFHSA-N 346.430 5.257 30 20 EKED N#CCC[C@H](C#N)CNc1cccc(-c2ccc(Cl)c(Cl)c2)c1 732917176 GFGOTPIBPIZZFS-CYBMUJFWSA-N 344.245 5.516 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(SC)cc2)ccc1SC 746341678 GODUSPJWPMXHMI-WMZJFQQLSA-N 330.474 5.035 30 20 EKED Cc1ccc(-c2ccc(CNc3ccccc3O[C@H](C)C#N)o2)cc1 779993770 OANXSINWSKXKTL-MRXNPFEDSA-N 332.403 5.158 30 20 EKED C=CC[C@H](NCc1ccc(-c2ccccc2)cc1OC)c1ccncc1 781413655 HBVRHXDCPCQKRW-QFIPXVFZSA-N 344.458 5.164 30 20 EKED C[C@H](NCc1ccc(CF)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782525548 ZHNJNADMRHBNQX-KRWDZBQOSA-N 344.433 5.546 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3ncc(C(F)(F)F)s3)oc2c1 788353225 FBOZUJHJNUSZJD-PLNGDYQASA-N 337.322 5.113 30 20 EKED CC(C)(C#N)[C@@H]1CCCC1=NNc1nc(Cl)c(Cl)cc1Cl 814740840 ALNKCISXJUQNPK-MRVPVSSYSA-N 345.661 5.160 30 20 EKED N#CC1(c2cccc(-c3ccc(C(F)F)c(F)c3)c2)CCOCC1 904842722 CTGKRKXXFCGNFJ-UHFFFAOYSA-N 331.337 5.002 30 20 EKED O=C(/C=C/c1cccc(/C=C/C(=O)c2ccccc2)c1)c1ccccc1 6338059 PSWLVTPAAJSQQT-YXLFCKQPSA-N 338.406 5.479 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 160596656 HRHDLASSNHQNIU-RTWAWAEBSA-N 349.478 5.070 30 20 EKED CC(C)[C@H](C)N1Cc2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2C1 172417749 UNDSPCAIVBIGSD-IRXDYDNUSA-N 333.479 5.091 30 20 EKED C=CCC[C@H](NCc1sc(C)nc1C(F)(F)F)c1ccccc1 183644638 TWCQRRCOVODCJT-AWEZNQCLSA-N 340.414 5.267 30 20 EKED CC(O)=Nc1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 329000156 KXUGLSSISGDMQF-FVQBIDKESA-N 348.874 6.142 30 20 EKED Cc1c(C#N)cccc1NC(=O)c1ccccc1Sc1ccccc1 432836190 SMYKYLOBVDOZJT-UHFFFAOYSA-N 344.439 5.270 30 20 EKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2cccc(CC#N)c2)c1 455916819 JLJBVVMIUHSBSK-OAQYLSRUSA-N 347.462 5.210 30 20 EKED C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 463070930 PMJTWRDTCSTTMN-INIZCTEOSA-N 342.398 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2CO1 482085821 VQOBKKVKGMPKNV-UHFFFAOYSA-N 336.435 5.018 30 20 EKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@@H]1c1ccsc1 486937400 MHOQNIAEXWSKGW-QGZVFWFLSA-N 339.851 5.163 30 20 EKED C[C@@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccc(C#N)cc1 497245756 GUPJPYDNGXKUDM-SNVBAGLBSA-N 349.768 5.032 30 20 EKED CCC[C@H](CC)NC(=O)c1ccccc1Sc1ccccc1C#N 520957182 ATDJFHVQPIJJAR-INIZCTEOSA-N 338.476 5.018 30 20 EKED CCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@@H](CC)c1ccccc1 521767360 JPHZQNRMJDDIDA-UTKZUKDTSA-N 349.478 5.192 30 20 EKED C=CCOc1cccc(NC(=O)Nc2cc(Cl)ccc2Cl)c1 522771508 TXCQKJXRSOAGOR-UHFFFAOYSA-N 337.206 5.202 30 20 EKED C=CCC(CC=C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C 536820887 IRGAFBASWCNWAB-GFCCVEGCSA-N 338.278 5.208 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@H](CCC#N)c2ccccc2)o1 537325571 LZBRDZYSBNROMW-OAQYLSRUSA-N 348.421 5.529 30 20 EKED C=CCOc1ccccc1C(=O)Nc1cccc(C(F)F)c1Cl 541647167 KMKHPKUQMFZKGN-UHFFFAOYSA-N 337.753 5.095 30 20 EKED C=CCOc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)cc1 556503103 OKLXDSUZEZFRDY-UHFFFAOYSA-N 347.380 5.049 30 20 EKED CC(C)COc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 556906877 DNUPQQLWKOVASI-QFIPXVFZSA-N 336.479 5.246 30 20 EKED CC[C@@H](N[C@@H]1COc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 570243286 POGPPCQYOCAAAI-HZPDHXFCSA-N 347.245 5.039 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C1CCC1)C1CCC1 571718006 JAUSUJFXCCQXEP-AWEZNQCLSA-N 342.508 5.093 30 20 EKED C=CCOc1cccc(NC(=O)N2CCCC[C@@H]2c2ccccc2)c1 584026889 OVHYJGGJKWDNBM-HXUWFJFHSA-N 336.435 5.011 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC[C@H](C#N)CCC#N 591773844 INATZGUAFKYHPP-INIZCTEOSA-N 327.497 5.275 30 20 EKED CCC[C@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccccc1 600841912 SGKFZRUIYLZDBZ-HNNXBMFYSA-N 338.476 5.021 30 20 EKED CCc1sc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 609376503 CVWGAFPOCLVDQS-LBPRGKRZSA-N 344.505 5.123 30 20 EKED Cc1ccc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] 734982158 XYBTWVGYQFANBI-FPLPWBNLSA-N 336.174 5.106 30 20 EKED CC/C(=C\C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C)cc1 741542659 XVAHYUHPVWBGLM-OBGWFSINSA-N 348.446 5.110 30 20 EKED CC(C)(C#N)CCCCN1CCCCC[C@@H]1C[C@@H](O)c1cccs1 769729660 KICOIRVCJMDNQP-QZTJIDSGSA-N 348.556 5.136 30 20 EKED C/C(=C/C(C)(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772161365 IOCURHYALBSPCR-HZMYXVCSSA-N 332.447 5.273 30 20 EKED CCCCOc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)c(C)c1 776860667 WTYKEAZQYNLBDL-KRWDZBQOSA-N 338.451 5.249 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1Cl 792108781 YZMZAHXPRFYKPJ-SZEUEKNRSA-N 346.817 5.168 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(C(F)F)cc2)ccc1SC 794935928 VKOSLBIXUJXDES-UITAMQMPSA-N 334.387 5.251 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2ccc3ccccc3c2)s1 797572505 AXBULFSFIUEUMC-KRWDZBQOSA-N 348.471 5.013 30 20 EKED C[C@H](C#N)OCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 801655432 ZFXKHIKKTFQOBB-RDTXWAMCSA-N 331.868 5.091 30 20 EKED CC(/C=C\C(=O)c1c(F)cccc1Cl)=C\c1cccc([N+](=O)[O-])c1 809158799 DNSNMGJMCDAQRI-LVQHWDRTSA-N 345.757 5.230 30 20 EKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3cccnc3)ccc21 916137336 VJSVQWFWUHFFTB-BENRWUELSA-N 326.399 5.106 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1 1776120136 WSCHOBRAWVSIRI-FMIVXFBMSA-N 342.822 5.232 30 20 EKED CCOc1cc(/C=C\C(=O)c2cc3ccccc3o2)cc(Cl)c1O 33466980 IPTGDUZGGKGYFH-FPLPWBNLSA-N 342.778 5.087 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C)c(C)c3)n2)cc1 60477374 OPYWRGBQEVTHGU-GOSISDBHSA-N 346.455 5.225 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1 90580683 NYVYCLWSGNGDHK-OXJNMPFZSA-N 348.490 5.274 30 20 EKED Cc1c(C#N)cccc1NC(=O)Nc1ccccc1CCC(F)(F)F 178549553 XCBFENXPNGCNSS-UHFFFAOYSA-N 347.340 5.006 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1Cl 192923057 KEPQKBKKYPKNRI-OLZOCXBDSA-N 349.261 5.308 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(-c2ccccc2)noc1C 410355025 XZJMZDHRWHOJNK-UHFFFAOYSA-N 332.403 5.021 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cccc2ccsc12)c1ccccc1 433279935 XIZKQRMDDMBPCG-KRWDZBQOSA-N 349.459 5.458 30 20 EKED CC(C)(C#N)CCCN1CCCC[C@H]1c1ccccc1C(F)(F)F 472264669 YEJKOFCEPOTRTN-KRWDZBQOSA-N 338.417 5.562 30 20 EKED CC(C)c1ccccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 479656938 HESKTOAOHHWHTL-TZIWHRDSSA-N 347.462 5.114 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CC1CCCC1 510863370 BWODGQWESCDQKZ-HUUCEWRRSA-N 330.497 5.093 30 20 EKED N#Cc1cnc(Sc2nc(-c3ccc(F)cc3)cs2)c(Cl)c1 513645166 IRENKQSXCSJKTI-UHFFFAOYSA-N 347.827 5.020 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518260346 YLPRTHKHXCJWDK-SFHVURJKSA-N 349.434 5.147 30 20 EKED C[C@@H](SCc1cc(-c2cccs2)on1)c1ccc(C#N)cc1 522968213 DZIVCQOUNYQVGZ-GFCCVEGCSA-N 326.446 5.269 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@H](C)c2ccc(C#N)cc2)o1 523740094 WLXOANAIGODQIS-OAHLLOKOSA-N 334.394 5.117 30 20 EKED C=CCCCCCN(C)[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 532968986 SGNCVASEFPDTMH-CQSZACIVSA-N 333.863 5.129 30 20 EKED CC(C)[C@H](NCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 540359427 VIWQHFDHDFCDAJ-INIZCTEOSA-N 326.406 5.322 30 20 EKED C=CCC[C@H](NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccco1 552048232 LMYLDLCUUHVJOR-ZJOUEHCJSA-N 325.452 5.044 30 20 EKED CC1=CC[C@@](C)(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 598810427 GNMJEROGWLYWFB-DNVCBOLYSA-N 328.481 5.013 30 20 EKED Cc1nc(-c2ccc([C@H](C)N[C@@H](C#N)C3CCCCC3)cc2)cs1 609676986 JMUOKLKVERDYAP-LIRRHRJNSA-N 339.508 5.242 30 20 EKED N#C[C@@H]1CCC[C@H](NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)C1 618577742 CYFGQSBOMHJEFA-YPMHNXCESA-N 342.792 5.020 30 20 EKED CC(C)(C)c1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726433379 FCFZZBBGXSDSSM-UHFFFAOYSA-N 343.883 5.318 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2ccc(CC)cc2)c1 727284128 FROCHIWKHLTIIP-UHFFFAOYSA-N 326.465 5.013 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccccc2C(F)(F)F)s1 736433180 MXFORCPFDVGDRN-HJWRWDBZSA-N 339.382 5.356 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1ccc(Cl)c(Cl)c1 741735158 HXQSPPUGAVAFML-CLFYSBASSA-N 343.213 5.280 30 20 EKED C=CCC(CC=C)C(=O)OCc1nc(C)c(-c2ccc(Cl)cc2)o1 759007193 LXEJTRXFSSQFMF-UHFFFAOYSA-N 345.826 5.115 30 20 EKED C=C(C)[C@@H](NCc1cc(Cl)nc(Cl)c1)c1ccc(F)c(F)c1 775725933 XTTQMWPVYVXTRO-MRXNPFEDSA-N 343.204 5.074 30 20 EKED CC1(C)CC[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 781618736 YYORRPNNVXDZMD-ICSRJNTNSA-N 332.447 5.107 30 20 EKED CSc1ccc(C(=O)/C=C\c2scnc2C2CC2)c(Cl)c1 782352957 XWHRTFQSWGMDEN-SREVYHEPSA-N 335.881 5.292 30 20 EKED N#Cc1ccccc1NC(=S)Nc1cccc(-c2ccccc2)c1 806587476 JWBYSTUNQPYNEM-UHFFFAOYSA-N 329.428 5.034 30 20 EKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nc(C2CC2)cs1 842940563 CLLVFKKCIRJNBI-HNNXBMFYSA-N 344.505 5.061 30 20 EKED CCCCn1nc(C)c(C=NNc2c(C)cc(C)cc2C)c1Cl 916339100 BJTATWHFXOZCPW-UHFFFAOYSA-N 332.879 5.016 30 20 EKED CCCCCCCCC[C@H](C)CC=NNc1ccc(C(=O)O)cc1 1776012485 AMOOQKNCDUKCEQ-KRWDZBQOSA-N 332.488 5.949 30 20 EKED N#Cc1ccc(-c2csc(Cc3c(F)cccc3Cl)n2)cc1 23624489 HXBSFCPGDCINBU-UHFFFAOYSA-N 328.799 5.065 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc3c(s2)CCCCC3)cc1 25438450 ACICFPXXFLNZKY-UHFFFAOYSA-N 338.476 5.070 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)o2)cc1 29151034 JHCFMQLPIXRGNE-UHFFFAOYSA-N 348.377 5.139 30 20 EKED CC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46706821 RWUIIPLQHUXTRG-CYBMUJFWSA-N 332.856 5.076 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc2ccccc12 65984889 BUSMTABCZXAKAT-UHFFFAOYSA-N 330.431 5.102 30 20 EKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 71846386 WCVHTHNLMOOZGH-QZTJIDSGSA-N 345.364 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1sccc1SC 189889344 OJWXGOYEPYKYRJ-UHFFFAOYSA-N 331.506 5.574 30 20 EKED CC1(C)C(O)=Nc2cc(C(O)=Nc3ccc(F)c(C4CC4)c3)ccc21 329163238 GJQQTJJKZMNWPZ-UHFFFAOYSA-N 338.382 5.219 30 20 EKED C=CCC[C@H](NC(=O)[C@H](C)CC(F)F)c1ccc(C(F)(F)F)cc1 412210813 ZQXQPWZWCHVKNI-RISCZKNCSA-N 349.343 5.120 30 20 EKED CC[C@H](C)[C@@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458799929 KMOOSVLEQQERIS-SXLOBPIMSA-N 341.499 5.032 30 20 EKED C[C@H](C(=O)N(c1ccsc1)C1CCCCC1)c1cccc(C#N)c1 464529924 ULITUOFIMRJOCM-HNNXBMFYSA-N 338.476 5.089 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 466873490 QFGYZNSINGNSMF-YOEHRIQHSA-N 339.401 5.361 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCCC2 476085947 UDXNSPAVXAUDQA-UHFFFAOYSA-N 333.475 5.670 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc2ccccc12 476107168 GYNMZVIDKJURLK-UHFFFAOYSA-N 344.458 5.647 30 20 EKED N#CC[C@@H](CC(=O)Nc1cccc(NC2CCCC2)c1)c1ccccc1 479976122 PJWLQVYHXCKQMN-SFHVURJKSA-N 347.462 5.067 30 20 EKED C[C@H]1CCC[C@@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 482542054 FJQIEMNCVDALBI-QFBILLFUSA-N 348.446 5.001 30 20 EKED N#Cc1ccc(C(F)(F)F)nc1SCc1cc2ccccc2o1 488754634 QESNTWMQHUQUJR-UHFFFAOYSA-N 334.322 5.011 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1oc2ccccc2c1C 517689108 FEBDFNZIBLZAKO-QGZVFWFLSA-N 348.446 5.200 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)Nc3ccccc3F)cc2)c1 518237389 MDDSMCDUIWXMOB-UHFFFAOYSA-N 347.349 5.134 30 20 EKED COc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(C#N)c(F)c1 538508666 XHEHMIUFBBHDOB-YWZLYKJASA-N 340.442 5.144 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1F 559837842 SCWAWMAUVUMOQA-KGLIPLIRSA-N 336.385 5.401 30 20 EKED Cc1cc2sc(C(=O)Nc3ccccc3CC#N)c(C)c2cc1C 575902321 PWWQPHVAVIEHDQ-UHFFFAOYSA-N 334.444 5.145 30 20 EKED COCc1cccc(OCC2(CSCCC(C)(C)C#N)CCC2)c1 581213246 CQRDJHZFRSZCJC-UHFFFAOYSA-N 347.524 5.055 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](CCC)c1cccc(C(F)(F)F)c1 588726486 KJXHWNDRCRKCFT-MRXNPFEDSA-N 342.405 5.154 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3cccc(C#N)c3C)sc2c1 610907333 ZDQBBMAFRDKDGV-UHFFFAOYSA-N 340.835 5.296 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1cccc(OCc2ccccc2)c1 728699861 YOGAWQZBJRWCOP-QXMHVHEDSA-N 349.817 5.210 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2scnc2C)cc1 741467124 HBIZHGCFNLPPQQ-FMIVXFBMSA-N 335.428 5.023 30 20 EKED C[C@H](N[C@H](c1ccccc1)C1CCCCC1)c1ccc(OCC#N)cc1 776159129 IDBPJOLJWOUIPO-FDDCHVKYSA-N 348.490 5.561 30 20 EKED C=CC[C@@H](OC(=O)Cc1nc(-c2ccccc2)oc1C)c1ccccc1 778740496 ZAUPGPKCWPJJAR-HXUWFJFHSA-N 347.414 5.053 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccnc(Cl)c3)s2)cc1 782192900 CGWUAVXKVZONON-VOTSOKGWSA-N 340.835 5.063 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CC/C=C\c2ccccc2)s1 797566296 FLBRDMYJSFLAKW-UBAGTECSSA-N 338.476 5.110 30 20 EKED O=C(/C=C\c1ccc(-c2cccc(Cl)c2)s1)c1ccnc(O)c1 806555035 JUQWEIBWHHYANW-XQRVVYSFSA-N 341.819 5.065 30 20 EKED CSc1ccc(/C=C\C(=O)c2sccc2Br)cc1 915114034 ZUFVBNJXASBLEU-DAXSKMNVSA-N 339.279 5.129 30 20 EKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CSc2ccccc21 920064685 JABGLRYDQIBJFO-GHXNOFRVSA-N 341.482 5.244 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(N=Cc2ccccc2O)cc1Cl 920942262 USDQPAHKUFYGJT-LJQANCHMSA-N 346.817 5.452 30 20 EKED Cc1ccc(OC(F)F)c([C@H](C)N[C@H](CCC#N)c2ccccc2)c1 90664542 MKYBJKMHNGMKAS-MAUKXSAKSA-N 344.405 5.292 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1)c1ccccc1 125778394 HKYWUSYMQDSSSI-PGRDOPGGSA-N 349.474 5.109 30 20 EKED C[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1F 427881095 HVENFPUAYZMKSM-GHMZBOCLSA-N 337.225 5.416 30 20 EKED CC(C)(C)c1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432737578 LNCOGOAERIYFEP-LJQANCHMSA-N 349.478 5.541 30 20 EKED Cc1ccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 440588887 CFCSUAIDPXWQTK-UHFFFAOYSA-N 349.415 5.365 30 20 EKED CC[C@H](Nc1cccc(OCC(F)(F)F)c1)c1ccc(C#N)cc1 447592836 NYEJDZFXPNANEP-KRWDZBQOSA-N 334.341 5.063 30 20 EKED C=CC[C@H]1N(C(=O)CCCCC(=O)c2ccccc2)CCCC1(C)C 470298338 PVQXRJHPVRQKMI-HXUWFJFHSA-N 341.495 5.023 30 20 EKED COc1ccc([C@@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C2CC2)cc1 481636258 ATFSUXACGAPQMR-PKTZIBPZSA-N 346.474 5.075 30 20 EKED N#Cc1cccc(NC(=O)c2ccc(SCc3ccccc3)cc2)c1 512169213 XIKUGDYHOUAZPC-UHFFFAOYSA-N 344.439 5.103 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 512523662 LJSGNNQGYATDRG-INIZCTEOSA-N 349.434 5.147 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc3c4c(cccc24)CC3)n1 531331217 HENLNCJZOQCJLE-KRWDZBQOSA-N 346.455 5.008 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cccc(Cl)c1 609387373 ZDWNUNCADAQVAD-KGLIPLIRSA-N 330.884 5.765 30 20 EKED C[C@@H](SCc1cc(-c2ccc(F)cc2)no1)c1ccc(C#N)cc1 609825424 XBGPLKDXEVXRHP-CYBMUJFWSA-N 338.407 5.347 30 20 EKED CCCCCC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400890 XGADOQSKTRZIFY-JKSUJKDBSA-N 347.528 5.561 30 20 EKED C#CC[C@H](NCc1ccc(Oc2cccnc2)c(C)c1)c1ccccc1 756998490 WWQJPIOLENWULL-QFIPXVFZSA-N 342.442 5.037 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cc(F)ccc1F 757476616 XIBFUNBUZJPRLU-GQCTYLIASA-N 333.384 5.046 30 20 EKED C(=NN(Cc1ccccc1)c1ccccc1)c1cnc(C2CC2)s1 761793929 QPPMCIBINTZDQP-UHFFFAOYSA-N 333.460 5.061 30 20 EKED CCCCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 776155210 DCBCJHGJSUMKAK-PGRDOPGGSA-N 336.479 5.561 30 20 EKED CC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccc1OC 795782677 OIIVGQDIEAJJNY-RTWAWAEBSA-N 334.463 5.075 30 20 EKED Fc1ccccc1NN=C(CCC(F)(F)F)CCC(F)(F)F 853287079 ZZPKGKKEKSRBBY-UHFFFAOYSA-N 330.247 5.279 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(OC(F)(F)F)c1 90665566 TUCYPINVBYCWPJ-KDOFPFPSSA-N 348.368 5.281 30 20 EKED Cc1cccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1Cl 91208937 MEQLKLMPLZWGHZ-UHFFFAOYSA-N 332.856 5.131 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@@H]1CCc2ccc(F)cc21 178396705 DVWITRNIEARBBF-CXAGYDPISA-N 326.440 5.177 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1OC(F)F 189880070 VUPMERMGCUMSLB-UHFFFAOYSA-N 345.389 5.392 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(Cl)cc2Cl)cc1 194445714 RXONBCYCONCGAH-STQMWFEESA-N 349.261 5.135 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/[C@H](CC2CCC2)c2ccccc2)CC(O)=N1 329749803 HRRKCVWZLCDNJO-RCCFBDPRSA-N 328.456 5.020 30 20 EKED N#CCCC[C@@H](NCc1cccc(-c2ccncc2)c1)c1ccccc1 353917992 WOJSEDUPCJWQFH-HSZRJFAPSA-N 341.458 5.273 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCc3cc(Cl)ccc32)c1 391076149 JPHQACBEAUOQRO-IBGZPJMESA-N 326.827 5.122 30 20 EKED CC[C@@H]1CCCC[C@H]1N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458802305 PMXJHKUGSSHPKN-YZGWKJHDSA-N 341.499 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CCC[C@H]1C 475549333 LKMJRAIQPNHUKU-IAGOWNOFSA-N 328.500 5.581 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CC)c(CC)o1 476090908 PDQWMHDLSRDVLU-UHFFFAOYSA-N 325.452 5.509 30 20 EKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)Cc1ccc(C#N)c(F)c1 488803960 JDPZNDAMMAMNOF-LFPIHBKWSA-N 343.467 5.005 30 20 EKED C[C@H](Oc1ccccc1NCc1ccc(C#N)cc1F)c1ccccc1 522404679 BZCYTBFTSLMQLR-INIZCTEOSA-N 346.405 5.449 30 20 EKED C[C@@H](CCc1ccc(F)cc1F)N[C@H](CCCC#N)c1ccccc1 551211858 YKLQENXZIFPINS-HRAATJIYSA-N 342.433 5.311 30 20 EKED CC[C@H](C)n1c(S[C@@H](C#N)c2ccccc2)nnc1-c1ccccc1 581201786 GRBIPMAASZIEHZ-YJBOKZPZSA-N 348.475 5.273 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(C)c1 596710131 ICKYBBPCFCZCCV-HZPDHXFCSA-N 345.512 5.043 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cnccc1C 682777802 RZACWPIBLCFHAI-MRXNPFEDSA-N 337.467 5.125 30 20 EKED O=C(/C=C\c1cnn(-c2ccccc2)c1)c1cccc(Cl)c1Cl 734980701 KXRSLZHGVYHYJY-KTKRTIGZSA-N 343.213 5.075 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)n1 756571962 QIGXRRURFZFSHR-KLHDSHLOSA-N 330.497 5.049 30 20 EKED C=CC[C@H](N[C@@H](CC)c1cc(Cl)ccc1OC)c1ccncc1 766021826 UVVLNHKGDLUTTI-ROUUACIJSA-N 330.859 5.102 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccncc2CC)cc1 774475870 HLJNYGUKRLGCMQ-CVEARBPZSA-N 344.886 5.187 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(F)nc2C)cc1 782340315 AQZVPZAZFHUFKH-ACCUITESSA-N 347.389 5.101 30 20 EKED Cc1cccnc1[C@@H]1CCCC(=NNc2ccc3ccccc3n2)C1 799104389 PQBMDOFNBXAISA-QGZVFWFLSA-N 330.435 5.064 30 20 EKED N#C[C@@H](C(=O)C1CCC2(CC1)CC2)c1nc2cc(Cl)ccc2s1 850771473 OZXAPXHVMHPQAK-ZDUSSCGKSA-N 344.867 5.096 30 20 EKED CC(CC[C@@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)c(F)c1 1776076896 LCXDBKADMOGRSG-CXAGYDPISA-N 348.462 5.554 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1oc2ccc(F)cc2c1C 1776786753 JUWPPLFBANRYKJ-INIZCTEOSA-N 349.446 5.174 30 20 EKED Fc1ccc(-c2csc3ncnc(NN=C4CCCCC4)c23)cc1 7862485 FZBPJZHTBZSRAG-UHFFFAOYSA-N 340.427 5.229 30 20 EKED C=CCN(C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 71846387 WCVHTHNLMOOZGH-MSOLQXFVSA-N 345.364 5.028 30 20 EKED C[C@@H](SCc1csc(-c2ccccn2)n1)c1ccc(C#N)cc1 118444219 XVDFWVDDXXXLLI-CYBMUJFWSA-N 337.473 5.071 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](CC)c2ccncc2)cc1 163810552 GNOYJAGQGHZHBR-BEFAXECRSA-N 330.859 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(OC)c1 188063715 SXOKAOSTNFKSIU-UHFFFAOYSA-N 337.463 5.118 30 20 EKED CCc1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)C(C)C)cc1 236986865 AZDMOROEWPZMLL-VGOFRKELSA-N 336.479 5.027 30 20 EKED OC(=Nc1cccc2c1CCCC2)C1CCC(/N=C(/O)C2CC2)CC1 329974605 XMYKZZJVJIVQIP-UHFFFAOYSA-N 340.467 5.079 30 20 EKED COc1cc(Cl)ccc1[C@H](C)N[C@H](CCC#N)c1ccccc1 421839428 XMQJAQUYRBWUFQ-KBXCAEBGSA-N 328.843 5.044 30 20 EKED CC(C)(C#N)CCCCSc1ccc(C#N)c(C(F)(F)F)c1 436195472 DUHGBATVHBFVAI-UHFFFAOYSA-N 326.387 5.389 30 20 EKED N#C[C@@H]1CC[C@H](N[C@H](c2ccccc2)c2ccc3ccccc3c2)C1 442763686 BIESFPUKPHZSET-MQNAVGNWSA-N 326.443 5.211 30 20 EKED C=CCOc1cccc(CN[C@@H](CC(F)(F)F)c2ccccc2C)c1 444015032 ZLWKMFWLXFKDPB-IBGZPJMESA-N 349.396 5.343 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 464447930 UIFQHVKUUOZOBX-CXAGYDPISA-N 333.884 5.209 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1 466659318 YDIIJWWNSGPQBK-IRXDYDNUSA-N 337.463 5.142 30 20 EKED CC[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1S[C@H](C)CC#N 475773874 NCPWCNBQTNDXIU-BZUAXINKSA-N 330.497 5.236 30 20 EKED C=C(C)[C@H](CC(=O)Nc1cc(Cl)ccc1-c1ccc(C)o1)OCC 477913083 CMYWKBRBJFBFJS-SFHVURJKSA-N 347.842 5.218 30 20 EKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccc(C(F)(F)F)cc1 480874096 DFQNTFVNGZMERR-LLVKDONJSA-N 338.760 5.081 30 20 EKED CC(C)(C)C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 503338989 IAABFVQBBWEECS-IBGZPJMESA-N 335.451 5.052 30 20 EKED CC(C)c1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(C(C)C)c1 505277490 PFDSGJKRYWGTRR-UHFFFAOYSA-N 340.854 5.711 30 20 EKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccccc1SC 508318860 VTXNYKKGUBHREX-AWEZNQCLSA-N 343.517 5.178 30 20 EKED Cc1oc(-c2cccs2)nc1CS[C@H](C)c1ccc(C#N)cc1 522840431 KLFPQSAMJPENDC-CYBMUJFWSA-N 340.473 5.578 30 20 EKED CC(C)(C#N)CCCN[C@H](c1ccc(F)cc1)c1ccccc1Cl 532412975 BIAMOTHAJNDIDQ-LJQANCHMSA-N 344.861 5.488 30 20 EKED COc1ccccc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541090339 QQVKKTDPTSKGJO-QGZVFWFLSA-N 342.442 5.085 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3cccs3)o2)n1 543974707 PVUDCQHUBZMSAR-LLVKDONJSA-N 342.445 5.078 30 20 EKED C=C(C)C(C)(C)C(=O)Nc1ccc(NC(=O)C(C)(C)C(=C)C)c(C)c1 619322772 HVLKYRIQENYLKE-UHFFFAOYSA-N 342.483 5.077 30 20 EKED CC(C)C[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 727955163 ZZRLNPCRPZJFFT-ZBFHGGJFSA-N 326.465 5.059 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccccc1OCc1ccccc1 728695768 FYWBZYAGMVWOOF-SEYXRHQNSA-N 349.817 5.210 30 20 EKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1ccc(F)cc1F 751521045 DBPSSRQOVKTTFG-ZZXKWVIFSA-N 339.316 5.062 30 20 EKED C[C@@H](ON=Cc1ccccc1F)c1ncc(-c2ccc(Cl)cc2)o1 752761401 CQMLAUGXVCKYBN-GFCCVEGCSA-N 344.773 5.246 30 20 EKED Clc1nc(Cl)c(C=NNc2ccc(Cl)c(Cl)c2)s1 755632578 HZWXLDOUIVYGEG-UHFFFAOYSA-N 341.050 5.203 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC[C@H]1c1cc(C)no1 775147062 RQVZMKDWEYCMQY-AEFFLSMTSA-N 334.504 5.423 30 20 EKED C=C(C)[C@H](NCc1cc(Cl)nc(Cl)c1)c1ccc(F)c(F)c1 775725930 XTTQMWPVYVXTRO-INIZCTEOSA-N 343.204 5.074 30 20 EKED C#CCCCCCC(=O)Nc1cc2oc3ccccc3c2cc1OC 779714727 GUMRECMUTXLSBD-UHFFFAOYSA-N 335.403 5.117 30 20 EKED O=C(/C=C\c1cc(Cl)cs1)c1ccc(-c2ccncc2)cc1 782343742 XHJSAAUMQZHNRU-WAYWQWQTSA-N 325.820 5.360 30 20 EKED O=C1/C(=C/c2cnc(-c3ccco3)s2)[C@H]2CCCc3cccc1c32 789143686 QFZARKTYQQVWSR-DWKHYPNZSA-N 333.412 5.103 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1O 815636618 XZAGJJNQYDNDCS-MOPGFXCFSA-N 342.870 5.521 30 20 EKED N#CCCCCSc1nn(-c2ccc(Cl)cc2)c(=S)s1 819917509 GJASJRAACNOTKG-UHFFFAOYSA-N 341.914 5.103 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(C#N)ccc1F 825315632 KJPXGSKCFIAQJF-UHFFFAOYSA-N 342.439 5.149 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)CC(C)(C)C 917046978 NYQZSKHQEFLNOS-YPMHNXCESA-N 348.899 5.588 30 20 EKED CC[C@@H](C)c1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776698230 IYRALTQGGBLMPN-COOUDCDJSA-N 338.403 5.012 30 20 EKED CCCCCC[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 78572894 OCHDTZAYKCULIT-HZPDHXFCSA-N 347.528 5.419 30 20 EKED Cc1ccsc1CCCC(=O)Nc1ccccc1SCCC#N 121803069 GQTJNKOEWVFLDU-UHFFFAOYSA-N 344.505 5.024 30 20 EKED N#CCc1ccc(NCc2ccc(-c3nc4ccccc4s3)o2)cc1 237836364 MAPPFKPFQWZDJU-UHFFFAOYSA-N 345.427 5.234 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccc(C)o2)[nH]n1 356816906 DGCOGALBTICSCE-UHFFFAOYSA-N 349.434 5.082 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cncc(F)c1 367799516 GLCDURRJABVGET-CVEARBPZSA-N 345.421 5.171 30 20 EKED CC(C)(C#N)CCCOc1ccc2c(c1)OC1(CCCCC1)CC2=O 433605153 VHKVNMXQMWIABS-UHFFFAOYSA-N 341.451 5.063 30 20 EKED CCC[C@]1(C)CCCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458797816 GWWRYTAPQNOLTR-TZIWHRDSSA-N 341.499 5.033 30 20 EKED CC(C)(C#N)CCCSc1nc(-c2ccco2)nc2ccccc12 475956918 PZZDSHBSADOSIY-UHFFFAOYSA-N 337.448 5.312 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC/C=C\c1ccccc1 476162718 UYKUACWLCBNYCL-ZSOIEALJSA-N 333.475 5.971 30 20 EKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 483194842 HTDDGXHCSAHRKV-IBGZPJMESA-N 346.455 5.225 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 483202253 SWLWRDLPBBLAIL-IBGZPJMESA-N 328.415 5.022 30 20 EKED N#Cc1cc(F)ccc1CSCc1csc(C2CCCC2)n1 488568355 LYBSIHQQTCPVGM-UHFFFAOYSA-N 332.469 5.245 30 20 EKED C=C[C@H](CC(=O)N1CCC[C@@]1(CCC)C(F)(F)F)c1ccccc1 499521599 SBGKBGOVVZFFCD-QAPCUYQASA-N 339.401 5.070 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccsc1 505034271 CEJVYXOVUPDPFK-GOSISDBHSA-N 326.465 5.236 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(C)CCCC1 511567441 ZCXSOFILBSSLJV-UHFFFAOYSA-N 334.419 5.178 30 20 EKED C=CCCOCCCCC(=O)Nc1ccccc1-c1cccs1 539367680 ZDQKWUHOLSGJAI-UHFFFAOYSA-N 329.465 5.117 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCC#N)CC1 583870446 UAPKLXKLSCWUDV-UHFFFAOYSA-N 339.483 5.086 30 20 EKED N#CCCCCCC(=O)NCc1ccccc1-c1ccc(Cl)cc1 588155959 GOVZYPHXYDASDW-UHFFFAOYSA-N 340.854 5.097 30 20 EKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)CCCCCC#N)cc1 588663522 SNJQYQHOKAGAHB-FQEVSTJZSA-N 326.484 5.338 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2sccc21 726890579 GMGDQCKYQXBJIM-JXMROGBWSA-N 329.471 5.146 30 20 EKED CCOc1cc(/C=C/C(=O)c2oc3ccccc3c2C)ccc1OC 747137810 ABTPVZHGEWZGDX-PKNBQFBNSA-N 336.387 5.045 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 756058273 KNBUFNVITORINZ-HYVJGQCMSA-N 343.474 5.036 30 20 EKED C[C@H](CCC1CC1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 769223602 SRHJNXTYSQRVFY-IIBYNOLFSA-N 347.462 5.042 30 20 EKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 772161270 GSJFYNZPDQPWGB-VGSWGCGISA-N 340.426 5.084 30 20 EKED C[C@H](C#N)Oc1ccccc1NCCCc1ccc(C(F)(F)F)cc1 779739978 CSERYHDVJWCJHO-CQSZACIVSA-N 348.368 5.041 30 20 EKED C[C@@H](NC[C@H]1CC1(Cl)Cl)c1ccc(-c2cccc(C#N)c2)cc1 782522938 HKIFEFCCGXCDKL-FZKQIMNGSA-N 345.273 5.070 30 20 EKED CC1(C)CCc2cc(CN[C@H](CCCC#N)c3ccccc3)ccc2O1 814305073 WRZBMBJRHKYIAM-OAQYLSRUSA-N 348.490 5.315 30 20 EKED C=CCCC[C@@H](NCc1csc([C@H](C)OC)n1)c1ccccc1 880388618 MUYYHJKLEDEFMA-MAUKXSAKSA-N 330.497 5.038 30 20 EKED N#CCCC[C@@H](NCc1ccc(C(F)F)c(F)c1)c1ccccc1 894606627 IUMVNRLXHCYLAT-GOSISDBHSA-N 332.369 5.288 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)ccc1O 916141471 BDVZKWYBMQNWLT-QPEQYQDCSA-N 346.382 5.089 30 20 EKED CCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 916650300 BJNXLHHFEJIAOZ-HNNXBMFYSA-N 346.883 5.610 30 20 EKED CCCCCCCCC(=O)Nc1ccccc1-c1n[nH]c(C(C)C)n1 918685949 GLSKMDKJPLHDHF-UHFFFAOYSA-N 342.487 5.284 30 20 EKED C=CC[C@@H](N[C@@H](C)c1csc(C(F)(F)F)c1)c1ccncc1 925075315 NSZDTDBNEKUERA-SMDDNHRTSA-N 326.387 5.130 30 20 EKED CC(=NNc1ccccc1C(=O)O)[C@@H](C)c1cc2ccccc2s1 1776031786 XMCTVKPEVWSNKA-GFCCVEGCSA-N 338.432 5.191 30 20 EKED O=C(O)c1cc(/C=C/C(=O)c2cccc3ccccc23)sc1Cl 1776114151 HMOHSBWWMBIUNB-CMDGGOBGSA-N 342.803 5.149 30 20 EKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1F 78671981 ZYHFCHORBWBKIJ-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C[C@H]1C[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccsc2S1 90665810 DELGUWZUKWGUOZ-RRQGHBQHSA-N 328.506 5.308 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1c(F)cccc1Oc1ccccc1 121617737 AQWOGFNLLZYMDY-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 176097579 OBKNICLVPBASQL-AWEZNQCLSA-N 344.867 5.220 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(O)cc1Cl 188071989 SMVUTGPGAAHSEU-UHFFFAOYSA-N 343.854 5.079 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1C(F)(F)F 189909037 WKFUMMGBCLOPAA-UHFFFAOYSA-N 347.380 5.810 30 20 EKED C=CCC[C@@H](N[C@H](C)c1cnn(C(C)(C)C)c1C)c1ccccc1 191386145 YSJYTUGTSCIMFT-OXQOHEQNSA-N 325.500 5.305 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1 208002819 YJMLIGJRCLNGIU-TWLAMCEISA-N 346.213 5.180 30 20 EKED CCCCN(C(=O)CCc1ccc(C#N)cc1)[C@@H](CC)c1ccccc1 303535147 GPUWPMCFAJIHHQ-QFIPXVFZSA-N 348.490 5.271 30 20 EKED Cc1coc2ccc(N=C(O)[C@@H](C)/N=C(/O)C3CCCCC3)cc12 330071217 XWXNVMQCSAHLGT-CYBMUJFWSA-N 328.412 5.255 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cc(Cl)ccc1Cl 426134920 YBEJNKZCFIPKAZ-ZDUSSCGKSA-N 347.289 5.645 30 20 EKED C=CCC[C@H](NC(=O)c1oc2ccccc2c1COC)c1ccccc1 435279553 PJNPXHZQLXLTPL-IBGZPJMESA-N 349.430 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CCC[C@@H]1C 475549335 LKMJRAIQPNHUKU-SJORKVTESA-N 328.500 5.581 30 20 EKED C=C(C)[C@@H](NCc1ccc(OC)c(Cl)c1)c1ccc(F)c(F)c1 479420893 MPZMWPHHPFIJHT-GOSISDBHSA-N 337.797 5.034 30 20 EKED COc1cc(N[C@H](C)c2ccc(C#N)cc2F)cc(OC)c1C(C)C 512289571 TUKZYHOCVBGSKG-CYBMUJFWSA-N 342.414 5.011 30 20 EKED CC[C@@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1ccc(C#N)c(F)c1 539609726 JLCHDPXLRCIONM-CVEARBPZSA-N 340.442 5.034 30 20 EKED Cc1nc(-c2ccc([C@H](C)NCCCC(C)(C)C#N)cc2)cs1 540354736 TYWZQMSYWWNBQJ-AWEZNQCLSA-N 327.497 5.099 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccsc1 543961291 HTBHFCWSNLUVSN-CVEARBPZSA-N 332.472 5.699 30 20 EKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1 614179146 FSYPQCDKXKHZEW-IBGZPJMESA-N 326.871 5.382 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@H](CC(C)(C)C)c2ccccc2)cc1 728712090 ZMQXQIOFVCGIKS-LAUBAEHRSA-N 336.479 5.245 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C\c2nccn2Cc2ccccc2)cc1 734095444 AWPCQMGKTGKFOH-YPKPFQOOSA-N 344.458 5.125 30 20 EKED C=CCc1cc(/C=C\C(=O)c2oc3ccccc3c2C)cc(OC)c1O 747063330 HQLHWTLLTDIFTL-KHPPLWFESA-N 348.398 5.080 30 20 EKED C[C@@H](CCC(F)(F)F)Nc1ccc(OCc2cccc(C#N)c2)cc1 753571141 QBVYKWJEQUACNS-AWEZNQCLSA-N 348.368 5.280 30 20 EKED Cc1csc([C@H](C#N)C(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)n1 773942078 ADDUSHUQZLEPRS-RANJNGMFSA-N 342.508 5.015 30 20 EKED CC(C)(C#N)CCCOC(=O)Cc1coc2ccc3ccccc3c12 782061715 MMCFDTDEGRULLX-UHFFFAOYSA-N 335.403 5.002 30 20 EKED CCCCCCCCC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 786322804 JPJGMVVZKBVQOL-LLVKDONJSA-N 336.423 5.090 30 20 EKED C[C@H]1/C(=C/c2ccccc2OCc2ccccn2)C(=O)c2ccccc21 809156605 MTWJQRBADCCVSF-QAIWHXNASA-N 341.410 5.044 30 20 EKED C#C[C@@H](NCc1cc(Cl)cc2cccnc12)c1ccc(Cl)cc1 811517181 KHASGDPLCCAOFW-GOSISDBHSA-N 341.241 5.006 30 20 EKED CCCCCCCOc1cccc(CNC(C)(C)C[C@@H](C)C(=O)O)c1 1776788068 NZAGPFBIOWOXJH-QGZVFWFLSA-N 349.515 5.015 30 20 EKED C=C(C)CN(CC)C(=S)Nc1ccccc1Oc1ccccc1 54922788 CXIKLGSLMRFDLA-UHFFFAOYSA-N 326.465 5.074 30 20 EKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2ccncc2)cc1 153700208 GUIWQFRFMFTCHZ-IAGOWNOFSA-N 327.431 5.032 30 20 EKED CC(C)c1ccc(-c2nnc(SCCCC(C)(C)C#N)o2)cc1 177288524 NRSYCTMYFLAUCU-UHFFFAOYSA-N 329.469 5.282 30 20 EKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(C#N)cc2F)cc1 177859304 DTNZHFTZUZSCHG-CQSZACIVSA-N 328.456 5.049 30 20 EKED Cc1cccc(C(NCc2ccc(C#N)cc2)c2cccc(C)c2)c1 237923911 AEVVQZSXQXNXPH-UHFFFAOYSA-N 326.443 5.054 30 20 EKED Cc1ccc(-c2nc(N=C(O)[C@H]3CCC(=O)[C@@H](C)C3)sc2C)s1 329006687 XWRXHXOSMFJIOA-CABZTGNLSA-N 348.493 5.082 30 20 EKED N#CCCC[C@H](NCc1cccc(OC(F)(F)F)c1)c1ccccc1 353911828 DAGGZDXTZLCQAM-SFHVURJKSA-N 348.368 5.110 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 426015318 HCSCWPUOSWVXAU-HNNXBMFYSA-N 339.464 5.342 30 20 EKED N#CCCC[C@@H](NC(=O)Nc1cccc2ccsc12)c1ccccc1 433279936 XIZKQRMDDMBPCG-QGZVFWFLSA-N 349.459 5.458 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)c(F)c1 442863030 BRIPNWZZTJISRL-LBPRGKRZSA-N 334.847 5.485 30 20 EKED COc1ccccc1-c1ccc([C@H](C)NCC2CCC(C#N)CC2)cc1 442870001 CKGAFBYSHPJKHL-VIQWUECVSA-N 348.490 5.343 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC(c2c[nH]c3c(CC)cccc23)CC1 443341471 LALGVDCLCDXCKP-QFIPXVFZSA-N 338.495 5.039 30 20 EKED C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 464653833 XLQZGRJFGMRSEI-DYVFJYSZSA-N 333.884 5.209 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(-c2ncco2)cc1)c1ccccc1 489641456 NAVZWQNYGCWLRH-IBGZPJMESA-N 332.403 5.030 30 20 EKED CCCN(C(=O)Nc1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 517560419 URMYPJFIOZJYQZ-HNNXBMFYSA-N 347.418 5.310 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccnc1-c1ccccc1 533663857 PEVGARMZJAAWPD-UHFFFAOYSA-N 349.459 5.030 30 20 EKED C=CCCCc1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 546551504 OSBDWRDCNKTBKC-UHFFFAOYSA-N 333.165 5.025 30 20 EKED Cc1cnc(N[C@@H](CCC#N)c2ccccc2)nc1-c1ccccc1F 555169127 CLLDZUJVCDOVNZ-IBGZPJMESA-N 346.409 5.048 30 20 EKED Cc1cc2cc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)oc2cc1C 556204387 GDSFBKZARPMNAP-WIYYLYMNSA-N 346.474 6.135 30 20 EKED C[C@H](N[C@H](C)c1ccncc1F)c1ccc(-c2cccc(C#N)c2)cc1 559834340 VCLNWVYEGJMQNP-JKSUJKDBSA-N 345.421 5.171 30 20 EKED CC(C)CCN(CCC#N)Cc1cc2oc3ccccc3c2cc1O 728901299 BYONXGYARYKRDQ-UHFFFAOYSA-N 336.435 5.053 30 20 EKED CCOc1ccc(O)c(C=Nc2ccc(COC3CCCC3)cc2)c1 739427215 RDRQMDVHBLXQMZ-UHFFFAOYSA-N 339.435 5.001 30 20 EKED N#CCC[C@@H](NC(=S)Nc1ccc2ccccc2c1)c1ccccc1 747710938 XMMNXJAVGSWLCD-HXUWFJFHSA-N 345.471 5.171 30 20 EKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc2ccccc2c1 753135466 RBZCETXMJRUVMG-FPLPWBNLSA-N 342.423 5.254 30 20 EKED C=CC[C@H](N[C@@H]1CCc2cc(Cl)cc(Cl)c21)c1ccncc1 760332249 YILLTESRLIXJFB-DLBZAZTESA-N 333.262 5.283 30 20 EKED C[C@@H](CCc1cccc(C(F)(F)F)c1)Nc1cccc(OCC#N)c1 768519799 XKUOHKSZJMWJBY-AWEZNQCLSA-N 348.368 5.041 30 20 EKED CCCOc1ccc(NCc2cccc(OCCCC#N)c2)c(C)c1 770527206 FHHVGZUJXHPEBJ-UHFFFAOYSA-N 338.451 5.079 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccc(-c2cccs2)cc1 773030881 WTYBHHBQAIFRQZ-CQSZACIVSA-N 336.435 5.277 30 20 EKED C=CCC[C@@H](Nc1ccc(OCCOC)c(Cl)c1)c1ccco1 796870925 DWRPLBQBPKQNAM-MRXNPFEDSA-N 335.831 5.078 30 20 EKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1c(F)cccc1Cl 809158456 AOMUZZVVDHIEIR-MDZDMXLPSA-N 343.810 5.499 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1O 810213517 UOWBFODTASBIKA-SJCJKPOMSA-N 348.368 5.085 30 20 EKED CSc1ccc(CN[C@H](C)c2sc(C(C)C)nc2C)cc1C#N 886688185 MDWCQWKTCORUKO-GFCCVEGCSA-N 345.537 5.019 30 20 EKED Cc1cc(C)c(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1C 915983797 AIGCYKGNPJFRPH-BQYQJAHWSA-N 334.444 5.026 30 20 EKED C/C=C/C=C/C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 917876134 FGRMHRMKHNNMSX-MQQKCMAXSA-N 338.794 5.075 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)cc3)s2)cc1 107718407 GPDARWQCXHLUOQ-HNNXBMFYSA-N 347.487 5.149 30 20 EKED CC(C)Sc1ccccc1NCc1ccc(O[C@H](C)C#N)cc1 151447146 WGUOJBWLWRUGSC-OAHLLOKOSA-N 326.465 5.090 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1nc2ccccc2o1)c1ccc(F)c(F)c1 187774023 QJCUWXKRLJSIPV-KZULUSFZSA-N 328.362 5.074 30 20 EKED CCC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340444716 IPEZLPXSGSIXNJ-YADHBBJMSA-N 336.479 5.561 30 20 EKED Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1C 352217247 JADAYBGHABDRPA-GOSISDBHSA-N 340.854 5.122 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCC1(F)F 455247581 OOUVSDPKFOFWLM-HNNXBMFYSA-N 336.426 5.095 30 20 EKED CC(C)(C)OCc1cccc(CNc2c(Cl)cccc2C#N)c1 462801004 AWUCQIVSLVEGGG-UHFFFAOYSA-N 328.843 5.139 30 20 EKED N#C[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2cc3ccccc3o2)C1 463301039 MBIJUTOJFKORHK-PERKRYKHSA-N 330.431 5.194 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 464567130 GRMFLOWWQZDPET-SJORKVTESA-N 327.493 5.440 30 20 EKED C=CCCC1(C(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)CC1 474700776 AQBTZTKVMQBXBT-AWEZNQCLSA-N 340.492 5.042 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 475024892 SKKWUMUUYVWAEU-UHFFFAOYSA-N 348.490 5.987 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)COc1ccccc1 476122877 SIZXIWZYYHRDCF-QGZVFWFLSA-N 337.463 5.192 30 20 EKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 488503851 KMSNFNZZXVHTOE-QGZVFWFLSA-N 339.439 5.037 30 20 EKED CC[C@@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)CC(C)C 499537899 KILUQGCPKDUDFV-NRFANRHFSA-N 342.527 5.196 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(C2CCCCC2)cc1 505726448 LIBSTJSAIBEEMN-XMMPIXPASA-N 345.552 5.703 30 20 EKED C=CCC(CC=C)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 512015242 KYTJYZNPKLOPHQ-CQSZACIVSA-N 340.320 5.383 30 20 EKED C=CCC[C@@H](NCc1ccc(Oc2ccccc2)nc1)c1ccco1 515625308 SSODWHRKFOKLTH-LJQANCHMSA-N 334.419 5.264 30 20 EKED CC[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 517448233 HDZJPOLFOJEAMG-NRFANRHFSA-N 347.393 5.448 30 20 EKED C[C@@H](Nc1ccc(-c2cn3ccccc3n2)cc1)c1ccc(C#N)cc1 539596453 ZCPAQOAGCXXONA-MRXNPFEDSA-N 338.414 5.046 30 20 EKED C[C@@H](Sc1ccccc1)c1ccc(NC[C@H](C#N)CCC#N)cc1 575741505 ZAISAANKWDJACF-SJORKVTESA-N 335.476 5.395 30 20 EKED COc1cc(N[C@@H](C)c2cccc(C#N)c2)c(C2CC2)cc1Cl 600852695 UCRZJUYHSXGIJJ-LBPRGKRZSA-N 326.827 5.271 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@@H]1c1ccccn1 726884913 RVOWKTRANDNYMR-IKXXZMEWSA-N 328.500 5.442 30 20 EKED CCCCCCCCCn1cc(C#N)c(=O)c2cc(Cl)ccc21 728705328 UIRMTYHIVOUBOR-UHFFFAOYSA-N 330.859 5.277 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C/c1ccc(OCc2ccncc2)cc1 731321664 NFXFVMCZCPSYSV-RUDMXATFSA-N 347.389 5.004 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccccc2Cl)s1 742433237 UMVJVGSQARQHAP-SREVYHEPSA-N 345.876 5.730 30 20 EKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1ccc2c(c1)COC2 742434313 FOQMCMWWPWWTMK-HJWRWDBZSA-N 332.424 5.341 30 20 EKED CCCc1ccc([C@@H](C)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772983577 LANVKWMILDQQFS-DYESRHJHSA-N 336.479 5.171 30 20 EKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/C(=O)c1cncc(F)c1 806573859 UTZCBYIYWLSMHC-DFTQQVSXSA-N 335.300 5.082 30 20 EKED Cc1oc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 915085273 JWXXBGDTMKPHRG-HXUWFJFHSA-N 344.414 5.113 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776120199 YAGYWWNYPLVWPR-YRNVUSSQSA-N 347.414 5.060 30 20 EKED C=CCN(Cc1cc2sc(C(=O)O)cc2s1)CC1CCCCC1 1776179686 BNGAVQCOOWBOOS-UHFFFAOYSA-N 349.521 5.229 30 20 EKED CC(C)[C@H](NC[C@H](C#N)CCC#N)c1ccc(C2CCCCC2)cc1 23678016 WEVZYRSPUVNCNN-AVRDEDQJSA-N 337.511 5.465 30 20 EKED CCc1ccc2c(c1)[C@@H](CC/N=C(/O)C1(CC)CCCC1)C(O)=N2 329816330 OCMHIMMKRSBRKM-OAHLLOKOSA-N 328.456 5.251 30 20 EKED Cc1noc(C(C)C)c1C(O)=Nc1cc(Cl)c(C)c(Cl)c1 330706979 PGWRRHVBLHMEEY-UHFFFAOYSA-N 327.211 5.358 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(CC(F)(F)F)cc1 438249015 PTWLZWMAMSWGER-UHFFFAOYSA-N 348.368 5.012 30 20 EKED N#CC1CCC(CN[C@@H]2CCCSc3ccc(Cl)cc32)CC1 442870912 DWBUSZJZVTVWSP-MQBCKMQZSA-N 334.916 5.187 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(SC)c1 471135852 FVMPYFSCBBQDGD-UHFFFAOYSA-N 326.465 5.019 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 503132413 CRWNXSSMDNSDHK-LEWJYISDSA-N 347.483 5.220 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)CC(C)(C)CCC#N 508743353 MOVHIPSEJHIWCC-QGZVFWFLSA-N 326.509 5.641 30 20 EKED CCCCS[C@@H](C)C(=O)Nc1sc(-c2ccccc2)cc1C#N 511451008 VGQZYYHZGIBLGD-ZDUSSCGKSA-N 344.505 5.147 30 20 EKED N#Cc1cccnc1N[C@@H](Cc1ccccc1Cl)c1ccccc1 520139357 MTZXQYFNQNCDAN-IBGZPJMESA-N 333.822 5.003 30 20 EKED C=CCCCN(C)C(=O)N[C@H](C)c1ccccc1Oc1ccccc1 522982631 ZLNDGXJWWDKBIQ-QGZVFWFLSA-N 338.451 5.148 30 20 EKED C=C[C@H](CC(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C)c1ccccc1 533948469 VOCVAEIBGHEUQH-ZVDOUQERSA-N 333.475 5.059 30 20 EKED CC[C@@H](NCC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 556217358 MCZWVZVZERCRHL-RBUKOAKNSA-N 346.396 5.335 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(SC)oc1C 613901354 POWWVCSLIGDYKF-UHFFFAOYSA-N 329.465 5.414 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1 614058514 ATUIVOPKMMNGTB-UHFFFAOYSA-N 332.369 5.205 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCc2cc(Cl)cc(Cl)c21 618804269 KNAICWNBOMJIJR-MSOLQXFVSA-N 343.257 5.129 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1F 728813259 JFMCRGDVQYRBFL-FQEVSTJZSA-N 344.389 5.042 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C\C(=O)c2cccs2)c1 731318419 IOGWNWOZSVAPOW-KHPPLWFESA-N 345.423 5.095 30 20 EKED COc1cccc2cc(/C=C/C(=O)c3ccc(SC)c(F)c3)oc12 741846297 CDINRJQHTLZPCY-BQYQJAHWSA-N 342.391 5.199 30 20 EKED Cc1ccccc1[C@H](OC(=O)CCCCCC#N)c1cccs1 805872516 TXURTQMHGQZALO-IBGZPJMESA-N 327.449 5.163 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 808351362 OFOYDXGAQWYLKL-IBGZPJMESA-N 326.827 5.194 30 20 EKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 920791686 CEIGTVHOSJHFPB-OIISXLGYSA-N 338.476 5.203 30 20 EKED CC(C)[C@H](NC[C@@H](C#N)CCC#N)c1ccc(C2CCCCC2)cc1 23678020 WEVZYRSPUVNCNN-GCJKJVERSA-N 337.511 5.465 30 20 EKED C[C@H]1C[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccsc2S1 90665812 DELGUWZUKWGUOZ-IAOVAPTHSA-N 328.506 5.308 30 20 EKED O=C(/C(=C\c1ccsc1)c1nc2ccccc2s1)c1ccccc1 111684156 PUHKENJWQJIHDV-FOWTUZBSSA-N 347.464 5.781 30 20 EKED CN(C)C(=O)Sc1ccc(CSCCCC(C)(C)C#N)cc1 161933887 WLEUESGIWQCUIQ-UHFFFAOYSA-N 336.526 5.023 30 20 EKED N#CCC[C@H](NC(=O)Nc1cccc2ccccc12)c1ccccc1 163565478 QIBRLFSFNGLRAP-IBGZPJMESA-N 329.403 5.006 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1cccc(C#N)c1 177391364 LJENSLQFDXEKJN-ZHRRBRCNSA-N 330.406 5.138 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)ccc2CC1 329191916 RROKIGFIZNGZLP-XOKHGSTOSA-N 326.440 5.415 30 20 EKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1cccc(C#N)c1 435041304 IPWVUQZMNRCEDP-LSDHHAIUSA-N 338.476 5.191 30 20 EKED C[C@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)c1ccc(C#N)cc1 439589695 BIZUOYRYLQZAPU-AWEZNQCLSA-N 333.435 5.461 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCC1CCC(C#N)CC1 442862447 AJLOKKSWEOYWGU-ODIFPOPNSA-N 339.508 5.099 30 20 EKED CC[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)cc1 447532357 TVUCDBNEGFGPCL-HXOBKFHXSA-N 341.458 5.422 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 449447163 WMYIWDNVNKUQKI-XDKFSHSGSA-N 336.401 5.013 30 20 EKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 467714569 RBXZWBVPLWKTAP-QAPCUYQASA-N 349.434 5.003 30 20 EKED COc1cccc(CCCNc2ccccc2S[C@H](C)CC#N)c1 470539304 WFHKQKQLPUCFPT-MRXNPFEDSA-N 340.492 5.134 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cccc1CC 479764321 SATSARSWBYVFJM-UHFFFAOYSA-N 348.899 5.492 30 20 EKED C=CCC(C)(C)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 484621323 IYYZFIKZEHROLP-UHFFFAOYSA-N 337.916 5.025 30 20 EKED Cc1ccc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C 515689722 HMXNTHVWEPQEDC-UHFFFAOYSA-N 346.455 5.085 30 20 EKED CCCCN(CC)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517903156 CBIRTBQFOPCSSZ-UHFFFAOYSA-N 337.423 5.004 30 20 EKED CC(C)n1ncc2cc(CSCCC3(C#N)CCCCC3)cnc21 563622629 XHYGSTGSRXDNQW-UHFFFAOYSA-N 342.512 5.110 30 20 EKED CCCC[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(OC)cc1 565532655 LNWUCESFSWPRKG-FCHUYYIVSA-N 334.463 5.075 30 20 EKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(F)c2ccccc12 576793864 YQGMPNGHUQOXGZ-FPTDNZKUSA-N 330.406 5.189 30 20 EKED N#CCCC[C@H](NC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1)c1ccccc1 599969990 GUSIRJYGYCQBGG-VSKRKVRLSA-N 346.474 5.122 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)C[C@@H](C)O2 613900517 GHBNIYTZNMBWGI-OAHLLOKOSA-N 335.447 5.114 30 20 EKED Cc1cc(C#N)ccc1CN[C@H](c1ccc(F)cc1F)C(C)(C)C 614407466 RPQMVSLPENLKCV-LJQANCHMSA-N 328.406 5.022 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccc3c(c2)Cc2ccccc2-3)c1 726438649 BUIYLHOWERYRTN-UHFFFAOYSA-N 340.451 5.048 30 20 EKED CC(C)Sc1cccc(Cl)c1C=NNCc1cccc(F)c1 786039472 HLEWEMNWBFIIKZ-UHFFFAOYSA-N 336.863 5.103 30 20 EKED CC(C)Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 796815787 GFBGBGLOANEXAV-MAUKXSAKSA-N 346.430 5.006 30 20 EKED CC(C)c1c(Cl)ncnc1NN=CC1CCC(C(F)(F)F)CC1 797405309 PTTMRZXMFYQOPJ-UHFFFAOYSA-N 348.800 5.020 30 20 EKED C[C@H](Nc1cccc(OCc2ccccc2)c1)c1ccc(C#N)c(F)c1 864023176 OURBTUUSTGGQFK-INIZCTEOSA-N 346.405 5.449 30 20 EKED Cc1c(NCc2ccc(C3(C#N)CC3)cc2)cccc1C(F)(F)F 864025550 YDGQPPIDGCHNQL-UHFFFAOYSA-N 330.353 5.181 30 20 EKED CCCCCCCC(=O)O[C@H](C)c1nnc(-c2ccc(C)cc2)o1 919222132 JMADCDKIJPLGGA-OAHLLOKOSA-N 330.428 5.010 30 20 EKED CCC(F)(F)c1ccccc1NC(=O)Nc1ccc(CCC#N)cc1 932216006 MEFWTUSLLFLDBD-UHFFFAOYSA-N 343.377 5.289 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OC)cc1C 935606313 JVTBWUIEKYYKGR-UHFFFAOYSA-N 337.463 5.037 30 20 EKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c(C)c1 7276432 GYDAPXQEHRUOGR-UHFFFAOYSA-N 326.399 5.094 30 20 EKED COc1ccc(CNc2ccccc2SC[C@@H](C)C#N)cc1Cl 179211020 RDEAHODGGZWXDC-ZDUSSCGKSA-N 346.883 5.212 30 20 EKED N#CCCCSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 337369315 NZCPJLTZNJUDNB-UHFFFAOYSA-N 331.491 5.263 30 20 EKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 467610639 LVQITKFVGCZZDF-QAPCUYQASA-N 349.434 5.003 30 20 EKED C=C[C@@H](CC(=O)Nc1cc(C(=O)CC)ccc1Cl)c1ccccc1 471433071 WUDFRFBXTFNOKG-AWEZNQCLSA-N 341.838 5.231 30 20 EKED C[C@H](NCc1ccc(C#N)c(F)c1)c1ccc(Cl)c2ccccc12 483692128 LWYSEJFWEHWMBL-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ccc(C#N)s1 487546329 YQABCYFFQNNVDR-OAHLLOKOSA-N 346.455 5.120 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(C)c1 505023799 OSMVYZIIRFMEFX-OAQYLSRUSA-N 334.463 5.483 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)CC1(C)CCCCC1 510473870 CETVSXNNXISYBX-HNNXBMFYSA-N 330.497 5.237 30 20 EKED N#Cc1ccc(CSCc2ccc(C(F)(F)F)cn2)c(Cl)c1 551368797 QQBXEUQHJRQMKD-UHFFFAOYSA-N 342.773 5.059 30 20 EKED N#Cc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)cc1F 568683603 OKPYMSBWHNORDE-GOSISDBHSA-N 349.236 5.245 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@H](c1ccccc1)c1cccc(F)c1)CC2 581161251 QVUSJMRUJQSCRZ-DHIUTWEWSA-N 342.417 5.064 30 20 EKED N#Cc1ccc2c(c1)[C@H](NC1(c3ccc(Cl)c(Cl)c3)CC1)CC2 589342743 INGNCPNPFVYKNX-GOSISDBHSA-N 343.257 5.131 30 20 EKED CC[C@H](C)n1c(SCc2ccc(C#N)cc2)nnc1-c1ccccc1 604548110 NLGPEUBZRAINMB-HNNXBMFYSA-N 348.475 5.080 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1c(F)cccc1Cl 611394316 CDNQKBABEFFHIE-SGTLLEGYSA-N 328.818 5.079 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCCC[C@H]1c1ncc[nH]1 737821302 AHUPVSZGVBICJW-BLSFAOBESA-N 331.504 5.160 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 739142160 HAEPNYXWCJKWFL-PBHICJAKSA-N 348.471 5.229 30 20 EKED O=C(/C=C/c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccsc1 749105836 YSUGZOGCNMXINL-VOTSOKGWSA-N 349.242 5.137 30 20 EKED CC(C)CN(CCC#N)C(=O)c1cc2sc3ccccc3c2s1 792526728 VCVAKONSGZIPHY-UHFFFAOYSA-N 342.489 5.128 30 20 EKED C[C@@H]1/C(=C\c2ccc(OCc3ccncc3)cc2)C(=O)c2ccccc21 809159848 XWSABSOKNLARIB-SITPEIFSSA-N 341.410 5.044 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 915085493 BUGZPTNCBQCMIK-HXUWFJFHSA-N 346.817 5.248 30 20 EKED CCCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1 1776033156 GLWADGFCFUFNSD-UHFFFAOYSA-N 330.815 5.045 30 20 EKED CCc1c(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)oc2ccc(C)cc12 1776956178 JEQZAACULRTRJM-CMDGGOBGSA-N 348.398 5.206 30 20 EKED CC(C)C[C@@H](NCc1ccc(C#N)o1)c1cccc(C(F)(F)F)c1 174337008 VQXSWNCHZLCYOM-QGZVFWFLSA-N 336.357 5.047 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1csc(C(C)C)n1)c1ccc(F)c(F)c1 186449916 MWEOEHREDZLURA-SJKOYZFVSA-N 336.451 5.513 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cccc(-c2cccnc2)c1 255123253 UAHGKHVCTYCPHH-KHPPLWFESA-N 345.446 5.039 30 20 EKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 303752682 IJXFMACAGYUSLQ-KRWDZBQOSA-N 328.415 5.310 30 20 EKED CC(O)=Nc1ccc(CC/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1 329055414 HYJXNAPPBPWQSM-DFQSSKMNSA-N 342.483 5.400 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H]1CCSc2ccccc21 360655872 FFEKVSUXSXFRJB-WOJBJXKFSA-N 334.488 5.152 30 20 EKED CC(C)(C)c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 432474346 WCOSMCJDGSUIMV-FQEVSTJZSA-N 349.478 5.541 30 20 EKED C=CCCCN(C)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442714395 NIVTZSONZUNFTD-UHFFFAOYSA-N 337.250 5.027 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccccc1N1C[C@H]2CC[C@H]1C2 447889910 TXHROICNGSTQJR-HKUYNNGSSA-N 345.490 5.089 30 20 EKED Cc1cc2cc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)oc2cc1C 463585675 AMAIYCYYOBZUBM-UHFFFAOYSA-N 346.430 5.224 30 20 EKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474695486 CPUNBUPXLCPSHG-FUHWJXTLSA-N 346.430 5.040 30 20 EKED C[C@@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 480556787 RHFFYNPEDVRJPD-MRXNPFEDSA-N 349.434 5.004 30 20 EKED CC(C)(C#N)CCCNc1ccccc1Nc1c(F)cccc1F 486072676 AYTWGRLGTFJFFB-UHFFFAOYSA-N 329.394 5.450 30 20 EKED CC(C)(C#N)CCCCN[C@@H](c1c[nH]c2ccccc12)C(F)(F)F 513158432 HRBGGWUDBUCMCW-INIZCTEOSA-N 337.389 5.081 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 556197906 NPHJXLCORBDBBY-KUHUBIRLSA-N 330.834 5.565 30 20 EKED C[C@H](Oc1ccccc1NC(=O)CCCCCC#N)c1ccccc1 588927916 CFTFYMXAFBQRBD-KRWDZBQOSA-N 336.435 5.239 30 20 EKED C=CCCCN(C)C(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C 605973832 DEVRUQMKHHHOEU-GOSISDBHSA-N 328.456 5.046 30 20 EKED O=C(/C=C/c1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F 727973020 PSQKXELQUAWKKR-AATRIKPKSA-N 330.227 5.019 30 20 EKED O=C(/C=C\c1nccs1)c1ccc(-c2ccccc2Cl)s1 735228489 BUCLIVNBORQAEZ-YVMONPNESA-N 331.849 5.421 30 20 EKED CC(C)Oc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1 741469207 KNZZVXVGPGKESF-FLIBITNWSA-N 343.426 5.432 30 20 EKED CC(=NNc1cccc(C#N)c1)c1ccc(SCC(F)(F)F)cc1 741762127 ICURJEDLLOPAGJ-UHFFFAOYSA-N 349.381 5.049 30 20 EKED CCCCCCCC[S@@](=O)Cc1coc(-c2ccc(C)cc2)n1 790140627 VHPIHBNTDYXQJR-HSZRJFAPSA-N 333.497 5.259 30 20 EKED C[C@H](N[C@H]1CC(C)(C)CCc2ccccc21)c1ccc(OCC#N)cc1 799727125 WVFLFIYBCDUHTM-JTSKRJEESA-N 348.490 5.343 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1cc(Cl)cc(Cl)c1O 806133169 IMIJCWWZUPRTCO-GTNSWQLSSA-N 349.261 5.373 30 20 EKED Fc1ccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c(F)c1 818196582 SUWIVXUMPGXTIZ-UHFFFAOYSA-N 335.568 5.371 30 20 EKED CC(C)C[C@H](C)N(C(=O)CCCCC#N)c1ccc2[nH]ccc2c1 846850106 VKJVRWJANVQMCC-INIZCTEOSA-N 325.456 5.019 30 20 EKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccccc2F)cc1OC 916545883 ZLSYZQOURCYCKO-HJWRWDBZSA-N 348.801 5.173 30 20 EKED C=C(CC)C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 1548649945 LITVKSNGRDLONK-KRWDZBQOSA-N 338.451 5.095 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)CC(C)(C)CCC#N 93612763 XDXMGXMBKMYVIG-INIZCTEOSA-N 341.524 5.441 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(S[C@@H](C)c2ccc(C#N)cc2)o1 118176873 CEDRRVYLKSVTHF-KSSFIOAISA-N 349.459 5.336 30 20 EKED Cc1cc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)s1 119251383 CXEWHYRYFYBJTC-CYBMUJFWSA-N 341.480 5.049 30 20 EKED C[C@@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(OCC#N)cc1 181265093 KBHZFVWFRMBMDP-VGOFRKELSA-N 334.463 5.171 30 20 EKED CC(C)(Cc1nc2ccccc2[nH]1)/C(O)=N/[C@@H]1CC[C@@H]2CCC[C@H]2C1 328806776 LZQGETRSWKREKR-HRCADAONSA-N 339.483 5.057 30 20 EKED C[C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(-c2ccccc2)cc1 404577964 UANXSNFYGROZJP-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccccc1C(F)(F)F 439429514 HXCUMNVSZHHGCV-NSHDSACASA-N 338.760 5.081 30 20 EKED Cc1nc(N[C@H](C)c2ccc(-c3cccnc3)cc2)c(Cl)cc1C#N 461958198 QNFUUZXZLPOEGI-CYBMUJFWSA-N 348.837 5.150 30 20 EKED C=CCN(C(=O)[C@@H](C)c1ccccc1)c1nc(-c2ccccc2)cs1 483936505 ZTZWAHYAMWGGAL-INIZCTEOSA-N 348.471 5.133 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(Cl)c2ccccc2n1C 504296445 SHTGXVGIBIXLDM-UHFFFAOYSA-N 338.838 5.203 30 20 EKED C[C@H](Oc1ccc(C#N)cc1F)c1ncc(-c2ccc(Cl)cc2)o1 507828875 HZFLTMDMNVKFLJ-NSHDSACASA-N 342.757 5.146 30 20 EKED N#CCCSc1ccccc1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 511839190 UHTUKQIGFNCNDT-GVDBMIGSSA-N 342.508 5.237 30 20 EKED C=CCC[C@H](NC(=O)Nc1cccc(-c2ncco2)c1)c1ccccc1 533162023 ASIQLKGTGYUEEU-IBGZPJMESA-N 347.418 5.171 30 20 EKED CC(C)(C)c1cc(NC(=O)[C@H]2CCCc3sccc32)c(C#N)s1 539173181 APRPEBRLBGKREU-LBPRGKRZSA-N 344.505 5.037 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cc(OC)c(OC)cc1C)c1ccccc1 540146808 MOKCEECWFOCUIW-FXAWDEMLSA-N 339.479 5.370 30 20 EKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1ccc(C#N)s1 540618589 WLTASBGSZVFXGM-QGZVFWFLSA-N 348.899 5.159 30 20 EKED COc1ccc(Cl)cc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 550826144 AJJPGDMZZKPIBP-KXBFYZLASA-N 342.870 5.434 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1nc(-c2cccc3ccccc23)c(C)s1 552441696 SDOPXSMTJPTEET-FQEVSTJZSA-N 349.459 5.150 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 555810531 BHZCIMLMJZAMIZ-UHFFFAOYSA-N 346.386 5.319 30 20 EKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)sc1C 603969143 HNUWFYYPHHNKOW-UHFFFAOYSA-N 338.457 5.217 30 20 EKED C=CC[C@H](C)NC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 604906950 GPILISZQTFCKTO-DLBZAZTESA-N 338.451 5.221 30 20 EKED N#CCc1cccc(C(=O)Nc2cccc(Sc3ccccc3)c2)c1 609375187 JPBZHTREZKRGHB-UHFFFAOYSA-N 344.439 5.156 30 20 EKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)csc2c1 647379578 WQKQSUJAICLVFH-CYBMUJFWSA-N 338.457 5.034 30 20 EKED CC(=NNc1ccc(C)cc1)c1csc(-c2csc(C)n2)c1 729141208 UXGXRCMGICNSMU-UHFFFAOYSA-N 327.478 5.325 30 20 EKED N#Cc1ccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)s1 748999301 QZGQHEOJUMHBCC-VGOFMYFVSA-N 347.226 5.665 30 20 EKED C[C@H](OC(=O)CCCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 770760095 BIHIZBOPRVVRKH-QMMMGPOBSA-N 346.242 5.181 30 20 EKED C=CCC1(C(=O)OCc2nc(C)c(-c3ccc(Cl)cc3)o2)CCC1 791559992 DUABLYKEAHDSRK-UHFFFAOYSA-N 345.826 5.093 30 20 EKED CC(C)(CCC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792096385 OIIZDENCPQOTBL-FQEVSTJZSA-N 342.442 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@]2(C1)CC2(F)F 844641799 FWFCKUCJLLEKKK-IBGZPJMESA-N 348.437 5.192 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccccc2)cc1 915124250 AEDRCNNWWDXMLP-FQEVSTJZSA-N 343.455 5.151 30 20 EKED Cc1ccc(C(=O)/C=C\c2cc(C)c(OCc3ccccn3)c(C)c2)o1 97053892 ZZQAYWWCKUGHGL-HJWRWDBZSA-N 347.414 5.075 30 20 EKED CSc1ccccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 171819234 XTYTWJFQPBWACF-ZDUSSCGKSA-N 342.489 5.055 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1csc(C2CCCCC2)n1 182552157 NFPAYLJQOSPLTA-AWEZNQCLSA-N 341.480 5.094 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@@H]1C1CC1 289605589 GDLGJRFDFVOFPV-FQEVSTJZSA-N 338.495 5.335 30 20 EKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1coc2ccccc12 329342332 PNJCCBHRTMDDOS-GOSISDBHSA-N 349.434 5.127 30 20 EKED CC(C)(C#N)CCCC[S@](=O)Cc1cc(Cl)sc1Cl 417224125 QZIGZJRMTLTOCI-IBGZPJMESA-N 338.325 5.024 30 20 EKED C[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 436275341 PAWZKJILSPHGEX-NSHDSACASA-N 338.760 5.081 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CCCC2)CC1 475548173 MJPACIYLAUAKAQ-UHFFFAOYSA-N 340.511 5.727 30 20 EKED Cc1ccc2c(c1)[C@H](NCc1ccc(C#N)cc1C(F)(F)F)CCC2 492466595 ZAYNUYWROXKYCR-LJQANCHMSA-N 344.380 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)ccc1Cl 506045516 GIDWHJJEYBXHSX-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C[C@@H]1CC[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc21 507434535 MYZVPPMRHVPMCX-QRWLVFNGSA-N 347.462 5.248 30 20 EKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC(C)C)c1cccs1 515850379 APXSTIZICHAEQO-GOSISDBHSA-N 342.508 5.233 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 559865969 XEPKPTXFJIRDLX-KUHUBIRLSA-N 347.289 6.079 30 20 EKED N#Cc1ccc(SC(c2ccc(F)cc2)c2ccc(F)cc2)nc1 589793941 ROGNESHGEFZJAR-UHFFFAOYSA-N 338.382 5.113 30 20 EKED N#CC1(c2ccc(CN[C@H](c3ccc(Cl)cc3)C3CC3)cc2)CC1 594916391 DPDQNGDKKILEQK-FQEVSTJZSA-N 336.866 5.136 30 20 EKED Cc1cc(C)c(N[C@H](C)c2cccc(C#N)c2)cc1Br 600849388 MEPDSSCQAGPNPS-CYBMUJFWSA-N 329.241 5.111 30 20 EKED Cc1ccc(-c2cc(CS[C@@H](C)c3ccc(C#N)cc3)on2)cc1 609825347 SECJTDMUHFMFGQ-HNNXBMFYSA-N 334.444 5.516 30 20 EKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(C(C)C)c1 615480928 BGKALHKBGUGNKS-UHFFFAOYSA-N 338.451 5.039 30 20 EKED Cc1cc2occ(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2cc1C 681173642 NCASPUNKNAGMJF-QGZVFWFLSA-N 340.382 5.088 30 20 EKED CC(C)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(Cl)cc1 728713293 YLCPBEPPTZWRSX-MGPUTAFESA-N 342.870 5.118 30 20 EKED COc1cc(CON=Cc2ccc(C(C)C)cc2)ccc1SC 731663950 JPIPWTRWKCOGRJ-UHFFFAOYSA-N 329.465 5.091 30 20 EKED C#CC[C@@H](OC(=O)CC1CCC(c2ccccc2)CC1)c1ccccn1 733691939 LPRXQSFWSKDUKP-ZOGYUUGASA-N 347.458 5.053 30 20 EKED CC(=NNc1cccc2ncccc12)c1cccc(Cl)c1Cl 734980211 PBJXISCYMSDGGH-UHFFFAOYSA-N 330.218 5.378 30 20 EKED COc1ccc2cc(/C=C\C(=O)c3c(C)nn(C(C)C)c3C)ccc2c1 746346267 OHOSGAVBAQUTNI-XFFZJAGNSA-N 348.446 5.139 30 20 EKED C[C@H](Nc1ccc(F)cc1OCC#N)c1ccc(Cl)c(Cl)c1 760218809 HDJRKHYDZBYECV-JTQLQIEISA-N 339.197 5.208 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc2cc(OC)ccc2c1)c1ccncc1 766018930 JRQAUOVRQFNZQY-ZHRRBRCNSA-N 332.447 5.211 30 20 EKED C[C@@H](N[C@H]1CC(C)(C)CCc2ccccc21)c1ccc(OCC#N)cc1 799727130 WVFLFIYBCDUHTM-VGSWGCGISA-N 348.490 5.343 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1C 916847270 BFZDORPENJOTHK-KBOKABMXSA-N 346.455 5.111 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NC[C@@H]1CCCC1(F)F 926520900 AMRKOVXZZBJKQH-VIFPVBQESA-N 341.286 5.065 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC/C=C/c1ccc(Cl)cc1 1776783037 DIAXIELBSIGYFD-LKGOPFMKSA-N 337.891 5.147 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66907342 GOZBQJIWUHYZEE-AWEZNQCLSA-N 325.437 5.033 30 20 EKED COc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)c2ccccc12 90665151 CQRQEMJFXNJLPX-JTSKRJEESA-N 344.458 5.544 30 20 EKED Cc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1NC(=O)C(C)(C)C 179847646 DEKBZRYCOOBYGO-HNNXBMFYSA-N 335.451 5.024 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 189880255 YBNOWQIFCRKTIN-UHFFFAOYSA-N 338.407 5.007 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)C1CCCCC1 303344909 MKNKMBZFVGNZKT-CVEARBPZSA-N 344.524 5.626 30 20 EKED C[C@H](C(=O)Nc1ccc(C#N)cc1Cl)c1ccc2ccccc2c1 430357282 RQPLGRYOMGBOMG-ZDUSSCGKSA-N 334.806 5.107 30 20 EKED C[C@H](NC(=O)c1ccc(CC#N)cc1)c1ccc(Cl)c2ccccc12 462229504 YBEBMOUVHQWUSP-AWEZNQCLSA-N 348.833 5.050 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 464558355 GEZNLVSYAIMTON-ZIAGYGMSSA-N 327.390 5.217 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 477485546 RNHQUHQOTOAENX-UHFFFAOYSA-N 326.465 5.186 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 514504186 SINUSAKREKMNHG-UHFFFAOYSA-N 342.826 5.338 30 20 EKED C=CCn1c(SCc2cc(C)sc2C)nnc1-c1ccoc1C 517997063 VVWVLXVQRFWJBE-UHFFFAOYSA-N 345.493 5.003 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)c1cccc(C)c1 523484547 OWVKSNIAFONVTG-CQSZACIVSA-N 333.884 5.028 30 20 EKED Cc1ccc(Oc2ccccc2NC(=O)c2ccc(CC#N)cc2)cc1 534600723 RSAMGWNAIIZMHC-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C=CCCCCCN(C)C(=O)Nc1c(F)cc(Cl)c(C)c1F 534909270 RDTHZEDXXPIQKV-UHFFFAOYSA-N 330.806 5.137 30 20 EKED C=CCN(C(=O)Nc1ccccc1O[C@H](C)c1ccccc1)C1CC1 536818359 WDRUCRXUAYIPGJ-MRXNPFEDSA-N 336.435 5.009 30 20 EKED C[C@H](NCCCSCC#N)c1ccccc1-c1ccc(Cl)cc1 539316673 IEBWJOOXKZCAPJ-HNNXBMFYSA-N 344.911 5.304 30 20 EKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1C(F)(F)F 553261870 WRWQHPWJTBJYLO-DJJJIMSYSA-N 344.380 5.305 30 20 EKED CCCC(=O)Nc1cccc(N[C@H]2CCCc3cc(C#N)ccc32)c1C 611469060 LXFUGCRTWAMVAF-NRFANRHFSA-N 347.462 5.095 30 20 EKED C=CCN(C(=O)Nc1cccc(OCc2ccc(C)cc2)c1)C(C)C 732434679 BRHUGEYTDBDOAP-UHFFFAOYSA-N 338.451 5.002 30 20 EKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1coc(-c2ccccc2)n1 749893528 ZGOKSKPPFMQSSG-QXMHVHEDSA-N 328.371 5.027 30 20 EKED C[C@@H](N[C@H](C)c1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 751924347 PDTZZKMRMHLZRN-CHWSQXEVSA-N 332.419 5.285 30 20 EKED N#CCCCCCC(=O)OC/C=C\c1cc(Cl)cc(Cl)c1 809101695 JPGNYKRZADVBLC-WAYWQWQTSA-N 326.223 5.024 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1 848547716 APLHNYFJJYTWCW-AVRDEDQJSA-N 345.490 5.089 30 20 EKED FC(F)Oc1ccc(NN=C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 853299096 JHUDJUDKAVBERM-MNOVXSKESA-N 336.304 5.054 30 20 EKED C=CC[C@]1(C(=O)O)CCCN(CCCCCCCCCC2CC2)C1 1776156432 KFQJQOKUPKVCEP-NRFANRHFSA-N 335.532 5.260 30 20 EKED CCOc1ccc(/C=C/C(=O)c2cc3ccccc3o2)cc1OCC 60108402 NRTKAEBBQIMSBC-PKNBQFBNSA-N 336.387 5.126 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Br)s1 90664493 MIXGBDJZJJBIOY-GXTWGEPZSA-N 349.297 5.206 30 20 EKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CCCCC1 111766906 VKLUUFTYZOWOAG-HNNXBMFYSA-N 345.512 5.267 30 20 EKED CC(C)(C#N)CCCNc1ccc(Cl)cc1[C@H](O)c1ccccc1 154047978 YBOXSMJTGVZAKP-LJQANCHMSA-N 342.870 5.164 30 20 EKED C[C@H](SCc1nc(C(F)(F)F)cs1)c1ccc(C#N)cc1 155614311 YDZBVABAACJFJA-VIFPVBQESA-N 328.384 5.028 30 20 EKED N#CCC[C@H](NCc1ccc(SC(F)F)cc1)c1ccccc1 181938486 WTHRULKJIAYRJT-KRWDZBQOSA-N 332.419 5.136 30 20 EKED C=C(C)[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)c(F)c1 187778001 ZTVASZIVBHHOOM-FQEVSTJZSA-N 340.417 5.173 30 20 EKED Cc1c([C@@H](C)NCc2cccc(OCCCC#N)c2)oc2ccccc12 191677074 KVLIYDRZWSZPGG-QGZVFWFLSA-N 348.446 5.275 30 20 EKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329298753 UNWBWAJILWUOSZ-ZNFSNMQZSA-N 334.504 5.083 30 20 EKED CCC1(NC(O)=Nc2c(C(C)C)cccc2C(C)C)CCOCC1 330715691 YMFMLWUHPSNKJA-UHFFFAOYSA-N 332.488 5.028 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCC#Cc1ccc(Cl)cc1 443540877 LXCPNVQLNZNQGN-HNNXBMFYSA-N 340.879 5.198 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccccc1OCC(F)(F)F 486436361 SXMPPWHEKWFDMA-UHFFFAOYSA-N 348.368 5.041 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)Cc1ccccc1C#N 521815437 GYBSUAZUTPZWEM-KRWDZBQOSA-N 332.472 5.383 30 20 EKED C[C@H](c1cccc(C#N)c1)N1CCC[C@H](c2nc3ccccc3s2)C1 527482131 PYKFHXDXHNGVDW-QAPCUYQASA-N 347.487 5.109 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 540594778 NYDWOXDNPXACMZ-OPAMFIHVSA-N 346.861 5.652 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(CCC#N)CCC(C)C)sc2c1 609175605 OHYWNGXUVBGLDQ-UHFFFAOYSA-N 348.899 5.265 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N[C@]3(C#N)CCC[C@H](C)C3)sc2c1 609736834 RDUZLZSSRHOUCN-KPZWWZAWSA-N 346.883 5.065 30 20 EKED C[C@@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1cccc(C#N)c1 611166830 AEIJOGHAOHPFNF-DIFFPNOSSA-N 331.246 5.203 30 20 EKED CC(=NNc1cccc2cnccc12)c1sc(C(C)(C)C)nc1C 728432611 YYKAZPYSIHWEMA-UHFFFAOYSA-N 338.480 5.133 30 20 EKED CCCCCCCCCC(=O)N1CCC(OC2CCCCC2)CC1 747670293 UNZGSCYVUUXKHH-UHFFFAOYSA-N 337.548 5.467 30 20 EKED CCC(CC)[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 762042709 WQJOEUVUPSEROD-GXFFZTMASA-N 334.872 5.198 30 20 EKED C=CCC(CC=C)C(=O)Nc1cccc(CC[C@@H](O)c2ccccc2)c1 762991325 HDDAXFNKIFCLMX-JOCHJYFZSA-N 349.474 5.060 30 20 EKED C[C@H](CCc1cccc(C(F)(F)F)c1)Nc1cccc(OCC#N)c1 768519800 XKUOHKSZJMWJBY-CQSZACIVSA-N 348.368 5.041 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C[C@@H]1CCC(F)(F)C1 798212428 FVHZDIWJHFMIQU-LBPRGKRZSA-N 346.402 5.051 30 20 EKED CC[C@H]1c2ccccc2CN1C(=O)N[C@@H](CCCC#N)c1ccccc1 895042014 QHYWLQIDNCKNSA-SFTDATJTSA-N 347.462 5.098 30 20 EKED CC(C)C(CCc1ccc(Cl)cc1)=NNc1ccccc1C(=O)O 1776030186 OMQXFDWMARYIIJ-UHFFFAOYSA-N 344.842 5.095 30 20 EKED CSc1ccc2ncnc(N[C@@H](CCCC#N)c3ccccc3)c2c1 431498093 YHXDCVANCMIDBO-SFHVURJKSA-N 348.475 5.199 30 20 EKED N#CCCC[C@H](NCCCOc1cccc(Cl)c1)c1ccccc1 433024783 YPSJSVGGUVORPH-FQEVSTJZSA-N 342.870 5.134 30 20 EKED CCCCCN(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C(C)C 438645199 XUXPRYGUDZSSBQ-UHFFFAOYSA-N 341.377 5.010 30 20 EKED N#C[C@@H]1CC[C@H](Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 442860817 SRCJVBLUFXFAQW-QAPCUYQASA-N 326.827 5.023 30 20 EKED CC[C@H](C)[C@@H](C)N(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CC1 458806261 VXAIYXHKSKPVKS-QKLQHJQFSA-N 341.499 5.030 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)c2sccc2C#N)c(C)c1 498456880 IKLVBNLWOGYGED-GFCCVEGCSA-N 330.478 5.071 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C 505009995 AEKRSHYROSVCQR-YLJYHZDGSA-N 334.463 5.215 30 20 EKED CO[C@H](CSCc1ccc(CC#N)cc1)c1ccc(Cl)cc1 509138264 NLTZANCKKILCDX-GOSISDBHSA-N 331.868 5.027 30 20 EKED CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 525412328 SPQCBCJWZKGKFG-XHSDSOJGSA-N 345.512 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC[C@H](C(F)(F)F)C1 573824734 QKYOUPBRRIXIKD-GJZGRUSLSA-N 339.401 5.456 30 20 EKED N#C[C@@H](Cc1ccccc1)N[C@@H](CCc1ccccc1)c1ccccc1 603955319 QKWHUDNCRNOIQB-RPWUZVMVSA-N 340.470 5.085 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(F)c(F)c1 728439548 MOAHDGRLXWIANT-XQRVVYSFSA-N 333.384 5.046 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C\C1CCCCC1 735440106 DFYVHKAJYBMQRW-QYMJWVLRSA-N 328.481 5.013 30 20 EKED Oc1ccc2ccccc2c1C=Nc1cccc(Oc2ccccn2)c1 743045370 HLGYCMXYOWWKGA-UHFFFAOYSA-N 340.382 5.483 30 20 EKED CSc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990748 XMTICOYMYZLXFJ-WCIBSUBMSA-N 331.440 5.367 30 20 EKED CC(=O)Nc1ccc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cc1 746347097 XQIHRZCOIYAPFG-QINSGFPZSA-N 341.410 5.208 30 20 EKED C=CCCCC(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763991510 PBMZDTGNYJBJSO-ZDUSSCGKSA-N 333.815 5.264 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2ccsc2)cc1 766767751 XXQMBLDXHGHHRZ-HNNXBMFYSA-N 334.444 5.318 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1cc(Cl)ccc1Cl 779713400 SHSCLHDJOYNVTA-NWDGAFQWSA-N 335.234 5.457 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](CCC(C)C)c2ccoc2)c1 796815424 DMGAGIYVXHDZMH-TZIWHRDSSA-N 340.467 5.228 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)s1 797568831 WSSNUKWSEKCCJH-KLHDSHLOSA-N 344.524 5.223 30 20 EKED O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)c1ccnc(O)c1 798231176 RNIGMCSVKIKTFL-ALCCZGGFSA-N 341.819 5.065 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1ccccc1SC(C)(C)C 815594954 DDFNICWJFOENFE-AWEZNQCLSA-N 342.483 5.439 30 20 EKED CCCCCCCCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 915104078 JTDQTVJNBVSBGI-CQSZACIVSA-N 347.409 5.358 30 20 EKED CCOc1ccc(/C=C\C(=O)c2ccccc2Cl)cc1OCC 920991385 SGWCXUKQRYNNCN-LUAWRHEFSA-N 330.811 5.034 30 20 EKED O=C(O)c1csc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c1 1776131009 DLSHMEZZNJBGGL-KHPPLWFESA-N 334.396 5.009 30 20 EKED CC(C)Sc1ccccc1NCc1ccc(O[C@@H](C)C#N)cc1 151447067 WGUOJBWLWRUGSC-HNNXBMFYSA-N 326.465 5.090 30 20 EKED N#CCC[C@@H](NC(=O)Nc1ccc2ccccc2c1)c1ccccc1 159623455 WYBBNKDPLGUYSV-HXUWFJFHSA-N 329.403 5.006 30 20 EKED O=C(/C=C/c1ccc2ccccc2c1)c1c(Cl)nc2sccn12 303834377 AJWHYIGMFVZDGA-SOFGYWHQSA-N 338.819 5.099 30 20 EKED CSc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1F 340439193 BYRQASRBUBWGIO-DNVCBOLYSA-N 342.483 5.633 30 20 EKED Cc1ccc(Cl)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 433242870 BUAFLNUQDFTOEF-QGZVFWFLSA-N 341.842 5.205 30 20 EKED C[C@@H](NC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(C#N)c(F)c1 482070911 GAKJTSQIVDZKEC-BLJYYBPWSA-N 346.808 5.029 30 20 EKED CCCCc1noc([C@H](C)SCc2ccccc2C(C)(C)C#N)n1 486748187 VZVQCBZAWDVTOT-AWEZNQCLSA-N 343.496 5.208 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccco1 505059920 CEVORRKEJNABGC-NRFANRHFSA-N 346.430 5.309 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1cccc(CSC2CCCCC2)c1 512728898 OETUMOXQUVHJFO-IBGZPJMESA-N 330.497 5.131 30 20 EKED C=CCCOCCCCC(=O)N1CCCCC[C@@H]1c1cccc(C)c1 540501435 UQKNWMULWGIEJW-OAQYLSRUSA-N 343.511 5.202 30 20 EKED Cc1ccc(N(CCC#N)C(=O)C[C@@H](c2ccccc2)C(C)C)cc1 728518877 UXIVMZSTLPAGIO-OAQYLSRUSA-N 334.463 5.072 30 20 EKED CCCCCCCC(=O)Nc1cccc(OCc2cscn2)c1 751165375 CGZPNGTWPRACMR-UHFFFAOYSA-N 332.469 5.021 30 20 EKED C[C@H](Nc1ccc(F)cc1OCC#N)c1cc(Cl)ccc1Cl 751525107 SVAVGCKXUNDHRP-JTQLQIEISA-N 339.197 5.208 30 20 EKED C#CC[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 757899998 AZOKSKLYLCUGJX-HNNXBMFYSA-N 348.780 5.164 30 20 EKED C#CCCCCCC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C 779981512 RUOMUXZJFJRUDA-CYBMUJFWSA-N 338.278 5.023 30 20 EKED COc1c(C)cc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1Cl 796838790 ZLSUVKGIMPTENJ-KXBFYZLASA-N 342.870 5.353 30 20 EKED C[C@H](C#N)Oc1ccc(CNC(C)(C)c2ccc3ccccc3c2)cc1 858321177 VDQNEHBEPDBWCK-QGZVFWFLSA-N 344.458 5.156 30 20 EKED CC(=NNc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1Cl 915963111 ZMADDGKQGNQCGK-UHFFFAOYSA-N 338.625 5.355 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccn1)C1CC1 931062362 PRGXPGAGBVWJOL-OAQYLSRUSA-N 349.478 5.206 30 20 EKED O=C(O)c1cc(NN=C2CCCCC[C@@H]2c2ccccc2)ccc1F 1776064521 SJLPMKWTKZPXCU-MRXNPFEDSA-N 340.398 5.040 30 20 EKED CCCC[C@@H](CC)CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 78573334 PBVWNJIQLSTJMX-JKSUJKDBSA-N 347.528 5.276 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccccc1C(C)(C)C#N 131708347 KXTQFKSQMDFOGW-MRXNPFEDSA-N 349.503 5.494 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2[nH]ccc2c1 159000545 PRAGVLWIUQQZLV-UHFFFAOYSA-N 345.855 5.103 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 159295458 BOBXIZUWXZMVSX-MRXNPFEDSA-N 345.512 5.291 30 20 EKED C[C@@H](Cc1nnc(S[C@H](C)c2cccc(C#N)c2)o1)c1ccccc1 189796732 ZFNFCKLVDUYUBT-LSDHHAIUSA-N 349.459 5.141 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc(C)cc1 195565368 VPMGLHDLGXRMEU-AWEZNQCLSA-N 348.899 5.169 30 20 EKED C=C[C@@H](CC(=O)N(c1cnc2ccccc2c1)C(C)C)c1ccccc1 448459619 PNLXHCBXEZQRLI-SFHVURJKSA-N 344.458 5.336 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 466407315 WNTYNRCCYVPNJW-UHFFFAOYSA-N 326.465 5.186 30 20 EKED C=CCC(CC=C)C(=O)N(Cc1cccs1)Cc1cccs1 467829703 WSFVXUYZMVPWLD-UHFFFAOYSA-N 331.506 5.107 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 467988981 RTZPSOMFUJFEDR-SFHVURJKSA-N 337.916 5.025 30 20 EKED COc1ccc2c(c1)CN(CCCC(C)(C)C#N)[C@H](c1ccccc1)C2 469026455 OMCPMFBHBPCHPO-QFIPXVFZSA-N 348.490 5.125 30 20 EKED CCc1ccc([C@@H](C)CC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487176305 LHPXIDTXNDRNPM-AVRDEDQJSA-N 348.490 5.294 30 20 EKED CC(C)c1cc(C(=O)Nc2ccc(Cl)c(C#N)c2)c2ccccc2n1 494946115 DBTCZTVBYZNASN-UHFFFAOYSA-N 349.821 5.136 30 20 EKED C[C@@H](CCC(F)(F)F)Nc1ccc(F)cc1OCCC(F)(F)F 504582527 NYOQGLDMPGCFQZ-VIFPVBQESA-N 347.274 5.300 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1sc(C)nc1C 505011622 YAOSHQGVQCJSEW-AWEZNQCLSA-N 343.496 5.103 30 20 EKED CCCCN(C(=O)NCc1ccc(C#N)cc1)[C@@H](CC)c1ccccc1 526985048 KSHOMHPZKOATBS-NRFANRHFSA-N 349.478 5.021 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)ccc1Cl 555995441 JNPWHLNBDGKERO-NSHDSACASA-N 348.830 5.126 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccccc1Br 618285203 QVZKZFMQBDIMJA-KRWDZBQOSA-N 349.316 5.306 30 20 EKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1cc(C)ccc1C 726471318 LBCDDJGHZRWELN-UHFFFAOYSA-N 343.883 5.052 30 20 EKED C#CC[C@@H](N[C@@H](C)c1cc(C)ccc1OC(F)F)c1ccccc1 773106948 NHLFGESNVKXICW-MAUKXSAKSA-N 329.390 5.012 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](CCC(C)C)C(=O)O)c1 1776787703 WBNWWXGLJNFSBH-FQEVSTJZSA-N 349.515 5.015 30 20 EKED CCN(C(=O)CCCCc1ccc(C)cc1)[C@H](C)c1ccc(C#N)cc1 63576117 UALDBELCXVFFSD-LJQANCHMSA-N 348.490 5.189 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2cccc(Oc3ccccc3)c2)cn1 214915802 NWYQVWOCQGSSHO-QXMHVHEDSA-N 332.403 5.152 30 20 EKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)C[C@@H](C)C#N 264064696 LSKHNSIXIPLBEF-AWEZNQCLSA-N 345.512 5.043 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cccc(COCC)c1)c1ccccc1 435604643 PXBQUQCXUXSKLQ-HXUWFJFHSA-N 338.451 5.052 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cl)s1 475542374 ACDUFXLODVYGGJ-UHFFFAOYSA-N 348.899 5.575 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CCc1ccco1 475552778 SAVXMUAQJODHOU-MRXNPFEDSA-N 340.467 5.274 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(Cl)c1 476093845 CDTQIBQCXZFTCI-UHFFFAOYSA-N 331.818 5.583 30 20 EKED CC[C@@H](C)[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Cl)cc1 498012555 BHERQVXBNDNBOX-RHSMWYFYSA-N 349.906 5.056 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC1CCCCC1 510881502 WLFVXBQEMHEULX-CVEARBPZSA-N 344.524 5.626 30 20 EKED CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)CCc1ccc(C#N)cc1 518922548 VYDMTFSOFZGKDE-QFIPXVFZSA-N 348.490 5.127 30 20 EKED C=CCCC(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 522483560 TVJKIMQAQBNJQI-UHFFFAOYSA-N 333.265 5.083 30 20 EKED N#Cc1c(NC(=O)c2cccc(-c3ccoc3)c2)sc2c1CCCC2 535477997 AVVBXTONEOIRPP-UHFFFAOYSA-N 348.427 5.011 30 20 EKED CC(C)c1ccc(-c2nnc(SCc3ccc(CC#N)cc3)o2)cc1 543144944 WLAVKMTVKCGPSQ-UHFFFAOYSA-N 349.459 5.218 30 20 EKED Cc1c(-c2nc([C@@H]3CCCCS3)no2)sc2ccc(C#N)cc12 564396841 IGXVHGWPJKUAOS-AWEZNQCLSA-N 341.461 5.090 30 20 EKED N#CCc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)cc1 567037132 VTTMNIDPRPVWKA-IBGZPJMESA-N 345.273 5.300 30 20 EKED C[C@@H](NC1(c2ccc(Cl)cc2)CCC1)c1ccc(C#N)c(F)c1 575337587 YEOQPGLGVXBEBY-CYBMUJFWSA-N 328.818 5.081 30 20 EKED COc1ccc([C@H](CCC#N)NCc2c(Cl)cccc2Cl)cc1 576579624 OVBVOGLWVZISJD-SFHVURJKSA-N 349.261 5.137 30 20 EKED CC(C)(CCC#N)CN[C@H](c1ccc(F)cc1)c1ccccc1Cl 577204791 NYOIMORDRJYHNZ-LJQANCHMSA-N 344.861 5.488 30 20 EKED N#CCCCOc1cccc(CNc2cccnc2-c2ccccc2)c1 579657724 HCLPXUILTKRLLO-UHFFFAOYSA-N 343.430 5.043 30 20 EKED Cc1coc(-c2ccc(C)c(NCc3ccc(C4(C#N)CC4)cc3)c2)n1 594958334 PYHKGLGZNFIKAC-UHFFFAOYSA-N 343.430 5.126 30 20 EKED CC1(C)/C(=C\c2csc(-c3cccs3)n2)C(=O)c2ccccc21 728439941 HROSWTSKOCHGQW-GDNBJRDFSA-N 337.469 5.429 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1cc2c(ccc3ccccc32)o1 728700959 ZBCSRUGSJUKSIE-CLFYSBASSA-N 333.774 5.531 30 20 EKED O=C(/C=C/c1ccc(OC(F)F)c(Cl)c1)c1ccc(F)cc1F 731489388 FINIXKJBUMFQBK-ORCRQEGFSA-N 344.691 5.116 30 20 EKED C#CCOc1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 741504924 MCFXIHXWLWNYSV-UHFFFAOYSA-N 335.447 5.198 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(OCCC(C)C)cc1)c1ccncc1 766020996 SEIHPFASBWCWQW-GCJKJVERSA-N 338.495 5.475 30 20 EKED CC1(C)CC[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 768869315 USTUJVLLONQQPR-WOJBJXKFSA-N 347.462 5.042 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(C#N)c(F)c3)s2)cc1 776726508 KCPWDZCLDPIUQU-HJWRWDBZSA-N 348.402 5.025 30 20 EKED CSc1ccc(C(=O)/C=C/c2cnc(-c3ccco3)s2)cc1 789131415 XWGHBMFHRHNSEO-CMDGGOBGSA-N 327.430 5.021 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797572631 DWWJILLSTGLYMJ-GOEBONIOSA-N 340.492 5.201 30 20 EKED Cc1ccc(-c2ccccc2C=NNc2cccc(C(=O)O)c2)c(C)c1 1776038239 YVCLUSCZYPUJHT-UHFFFAOYSA-N 344.414 5.115 30 20 EKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)c(C)c1 1776784621 SYWIWDQIDDCYOH-UHFFFAOYSA-N 333.516 5.656 30 20 EKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(Cl)cc1 59269340 CRLLDIHRQMISFG-FMIVXFBMSA-N 349.817 5.210 30 20 EKED Cc1cc(CSCCCCC#N)nc(-c2ccc(Cl)cc2)n1 155895089 LJZWNXAPHFMDHZ-UHFFFAOYSA-N 331.872 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccccc2C1 191512905 RFANEEIIQCBUEU-UHFFFAOYSA-N 334.463 5.129 30 20 EKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(OCC#N)cc3)c2)cs1 192995603 AXZJXQSQXZCTCT-CQSZACIVSA-N 349.459 5.194 30 20 EKED N#Cc1c(Cl)nsc1N[C@H](Cc1ccccc1)c1cccs1 301957792 NWTRFPMVBRQIMS-CYBMUJFWSA-N 345.880 5.126 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 303766133 IMOMRVAEOHZXSE-UHFFFAOYSA-N 328.387 5.048 30 20 EKED C[C@@H]1C[C@H](C(O)=Nc2cccc(COC3CCCCC3)c2)CCC1=O 328954129 MTEJYRCVEUKXIC-NVXWUHKLSA-N 343.467 5.129 30 20 EKED C[C@@H]1Oc2ccc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)cc2N=C1O 328988151 HMUOFOKGTCZNRI-DARAHFNDSA-N 342.439 5.250 30 20 EKED CC[C@@H](N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)cc1 447537392 VNMYEHLKFCZAIK-DHIUTWEWSA-N 344.433 5.528 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 447602142 SQDYCNGTFDGZAQ-FZMZJTMJSA-N 349.297 5.184 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCC1CCCC1 463750769 NMHOBNZQOWGTQU-HNNXBMFYSA-N 330.497 5.237 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cc(C)oc1C 475584977 UJZPFTQMHBDCIP-HNNXBMFYSA-N 340.467 5.631 30 20 EKED Cc1ccc(F)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482213143 ACDIOQNXMRXERJ-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C[C@@H](c1ccccc1)N(Cc1cccc(OCCCC#N)c1)C1CC1 506602534 QCOIBYSDTLPEBE-SFHVURJKSA-N 334.463 5.095 30 20 EKED C=CCN(C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 521936040 QVJATUHDAKYRPP-MSOLQXFVSA-N 345.364 5.028 30 20 EKED N#CCCSc1ccccc1NCc1cc(Cl)ccc1Cl 525687801 ZAVSHYFZKLXEOL-UHFFFAOYSA-N 337.275 5.611 30 20 EKED CC(C)CCc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1 525999337 SQCZHCZFSYREKI-HXUWFJFHSA-N 334.463 5.301 30 20 EKED C[C@H](NCc1ccc(CC#N)cc1)c1ccc(Oc2ccccc2)cc1 541329155 XTLFPCVNUXOJJF-SFHVURJKSA-N 342.442 5.396 30 20 EKED Cc1sc([C@@H](C)NCCC(C)(C)C#N)nc1-c1ccc(Cl)cc1 542574619 PVAMLSPZORFMBI-GFCCVEGCSA-N 347.915 5.362 30 20 EKED COc1cccc2cc([C@H](C)N[C@@H]3CCCc4cc(C#N)ccc43)oc12 561140592 OCOLMWZHUMXCDZ-IFXJQAMLSA-N 346.430 5.041 30 20 EKED CN(Cc1ccc(C(C)(C)C#N)cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 588982883 LULMFOLOIXQNOL-CALCHBBNSA-N 338.417 5.041 30 20 EKED N#CCCCOc1cccc(NCc2ccc(F)c3ccccc23)c1 600852173 MWBGFDFJOCKUSM-UHFFFAOYSA-N 334.394 5.274 30 20 EKED C[C@@H](Nc1ncc(C#N)cc1Cl)c1cc(F)c(Cl)cc1Cl 608884808 AQIMJMGEKBRMIZ-SSDOTTSWSA-N 344.604 5.226 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc2oc(C3CC3)nc2c1 611468618 CUKHVPRZJBQIMU-GOSISDBHSA-N 329.403 5.066 30 20 EKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2cccc(F)c2)s1 618742790 SJIDTKGENPKSRQ-FQEVSTJZSA-N 348.446 5.203 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc4c(c3)COC4)cs2)cc1 742437869 YKVNTLXOJNFVQL-HJWRWDBZSA-N 347.439 5.045 30 20 EKED N#Cc1ccsc1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 748053493 QEFHOKLNDQCUDS-UHFFFAOYSA-N 332.388 5.287 30 20 EKED O=C1C(=Cc2ccc(-c3cccc(F)c3)s2)C(=O)c2ccccc21 750896721 RVEQSIGLEAFUEM-UHFFFAOYSA-N 334.371 5.017 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc(F)c(F)c1 751514292 XVEHRBRHDNPSHB-GQCTYLIASA-N 333.384 5.046 30 20 EKED O=C(/C=C/c1cncs1)c1ccc(-c2ccccc2Cl)s1 767721608 MRNAZCQYCRQPRB-AATRIKPKSA-N 331.849 5.421 30 20 EKED C#CCCCCCC(=O)Nc1cccc(COC(C)(C)CC)c1C 779930570 QPKZRNHBGMGBIJ-UHFFFAOYSA-N 329.484 5.222 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1csc(Cl)c1 787185612 GOTHUJGOQSQTDE-ARJAWSKDSA-N 337.878 5.483 30 20 EKED Cc1c(C(=O)/C=C\c2c(Cl)oc3ccccc23)cnn1C(C)C 787186836 OCOMYAYNPFDRMN-HJWRWDBZSA-N 328.799 5.068 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(n2cncc2C)CC1 793849119 IENYWGTVNQBTFH-GOSISDBHSA-N 347.547 5.132 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CC2(CCOCC2)[C@@H]1C1CC1 818796551 WVCPFXCOBBOMCH-NQIIRXRSSA-N 349.559 5.181 30 20 EKED O=C(/C=C\c1cn(C2CCCC2)nc1-c1ccccn1)c1ccsc1 840715404 BBBZGWATGLQENB-HJWRWDBZSA-N 349.459 5.018 30 20 EKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)sc1C 915086288 JJUUWROFRNCMPX-LJQANCHMSA-N 346.455 5.273 30 20 EKED N#CC1CCC(CSc2nn(-c3ccccc3)c(=S)s2)CC1 915801881 HYGUETOBVBKBFV-UHFFFAOYSA-N 347.534 5.085 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 52662639 GCDQEMXCUMHYES-OAQYLSRUSA-N 332.834 5.091 30 20 EKED N#Cc1ccc(CNc2ccccc2Oc2cccc(F)c2)c(F)c1 60458455 MVZRYZXKPAMHHQ-UHFFFAOYSA-N 336.341 5.241 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1[N+](=O)[O-] 80468088 GUNFOFQPPFBFDH-ZIAGYGMSSA-N 341.436 5.020 30 20 EKED CC(C)(C)CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 122081624 HKFWTCWRCCCUNW-NSHDSACASA-N 348.418 5.091 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](CC)CSC 191465190 JZPHLWPTQCFVFX-INIZCTEOSA-N 334.529 5.144 30 20 EKED C[C@@H](CC(O)=Nc1cccc2c1CCCC2)/N=C(/O)C1CCCC1 328783549 GLERUKICXHYJPL-AWEZNQCLSA-N 328.456 5.079 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)N[C@H](CCC#N)c1ccccc1 438836176 MXXHDQQHVDRLBU-NHCUHLMSSA-N 349.478 5.214 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 464435833 HCABVOLKDKDTPP-HNNXBMFYSA-N 333.435 5.079 30 20 EKED Cc1ccc(F)c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 466962345 UVGGRSHZUUYISN-CYBMUJFWSA-N 343.427 5.172 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(CC[C@@H](C)C2)C1 475578077 LLECFNRGLGMFLO-VGSWGCGISA-N 340.511 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc2cc(F)ccc12 476999286 GYFPECIQPAVNFH-UHFFFAOYSA-N 337.394 5.676 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)s1 477863745 PCTRTAHJMBFTLB-NSHDSACASA-N 340.473 5.145 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1cnc(C2CCCC2)s1 507140376 DHWAFPJTPLOUBY-UHFFFAOYSA-N 339.508 5.083 30 20 EKED CCCN(Cc1ccc(C#N)cc1)Cc1ccc(Cl)c2cccnc12 516196487 XGVUHFALBGOQJV-UHFFFAOYSA-N 349.865 5.172 30 20 EKED C=CC1CCN(C(=O)c2ccc(CSc3ccccc3)cc2)CC1 520328261 VYKQIEQBEHOJFY-UHFFFAOYSA-N 337.488 5.017 30 20 EKED C[C@H](NCc1ccc(Cl)cn1)c1ccc(-c2cccc(C#N)c2)cc1 582440465 RIVYUAUGOSJXSF-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C(C1CCC1)C1CCC1 588925255 HJYCRCDKVDUQJP-CQSZACIVSA-N 342.508 5.236 30 20 EKED C=CCCCCCN(C)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 606973535 PYKVIWCHRSXFMK-INIZCTEOSA-N 342.405 5.068 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)[C@@H]1C[C@H]1c1ccc(Cl)s1 618988275 HOGVWWZPWREMBP-UQCMEYCASA-N 342.895 5.042 30 20 EKED CC(=NNc1ccc(C#N)cc1)c1ccc(SCC(F)(F)F)cc1 741760727 CMIZEQNJNYTTCP-UHFFFAOYSA-N 349.381 5.049 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1cc(Cl)ccc1Cl 742429296 LCIHLOJALRGJTJ-VQHVLOKHSA-N 343.213 5.280 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCCC1 757307116 VEJZMFFFBZWIAG-MRXNPFEDSA-N 338.476 5.265 30 20 EKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 764566831 GRNUSSGDQKJTLQ-CVEARBPZSA-N 326.465 5.059 30 20 EKED N#CC[C@@H](CC(=O)Oc1ccc(C2CC2)cc1Cl)c1ccccc1 816217843 RHKNRDHITPQJKD-KRWDZBQOSA-N 339.822 5.210 30 20 EKED C[C@H](Nc1ccc(OC(C)(C)C)c(C#N)c1)c1cc2cnccc2o1 826049549 VBISUOMZUHFRQI-ZDUSSCGKSA-N 335.407 5.050 30 20 EKED CCCCC/C(C=NNc1cccc(C(=O)O)c1)=C/c1ccccc1 1776036596 CKUJNGHHSVPZNZ-ZZSUSEOTSA-N 336.435 5.446 30 20 EKED CCCCCCCCC[C@@H](C)CCN1CCC[C@@](CC)(C(=O)O)C1 1776785096 CEJPQKUSLFIKNC-TZIWHRDSSA-N 339.564 5.730 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccc3oc(C(C)(C)C)nc3c2)cc1 156652163 REWSAVVIUNEIOI-AWEZNQCLSA-N 349.434 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCO[C@H](C)CC(C)C 189895635 MFJQYOUKMXGIIW-QGZVFWFLSA-N 331.500 5.318 30 20 EKED Cc1c(Cl)cccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 192512167 MPABCJRUIRZFCS-LBPRGKRZSA-N 344.867 5.295 30 20 EKED C[C@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(OCC#N)cc1 193013857 RUVSBALTDVWLKH-MGPUTAFESA-N 340.442 5.166 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2s1 326027944 MTDCZPCKRDMWGF-HNNXBMFYSA-N 336.460 5.757 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(C)ccc1OC 340449127 LDOGILNZKIDBQL-LEWJYISDSA-N 336.479 5.480 30 20 EKED N#CCCC[C@H](NC(=O)CC1CC(c2ccccc2)C1)c1ccccc1 352199025 SZJZOYWHFYOGTA-UDJZJCJKSA-N 346.474 5.122 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(N2CCCCC2)cc1 410359825 NWQSRNCYQHIVNW-UHFFFAOYSA-N 334.463 5.048 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1cccc(OCc2ccccc2)c1 434797086 WPYYWDCXSLTFDE-INIZCTEOSA-N 348.471 5.050 30 20 EKED N#Cc1cccc(SCc2cccc(C(=O)Nc3ccccc3)c2)c1 435042967 OMWFTIIMOWUCGH-UHFFFAOYSA-N 344.439 5.103 30 20 EKED CCc1cc(C)cc(CC)c1NC(=O)C[C@H](CC#N)c1ccccc1 484880384 XUQOAZZSQJJBON-FQEVSTJZSA-N 334.463 5.146 30 20 EKED C[C@H](NC(=O)CC(C)(C)C#N)c1ccc(-c2ccc(Cl)cc2)s1 503326906 VDCMWKWHLHBQTQ-LBPRGKRZSA-N 346.883 5.186 30 20 EKED CCc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 511943505 OKIVERARFQXBCC-KRWDZBQOSA-N 341.458 5.033 30 20 EKED C[C@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(C#N)cc1F 512664955 CHJXOLWIDQLDKS-YVEFUNNKSA-N 336.332 5.042 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCCC(C)(C)C 521812129 HMAPTHIHADWDCH-HNNXBMFYSA-N 347.528 5.419 30 20 EKED C=CCC[C@H](N[C@@H](C)c1nc2c(s1)CCCC2)c1ccccc1 540147086 OVBZMCOARVDDJR-RDJZCZTQSA-N 326.509 5.380 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(F)c(OC)c1)c1ccc(F)c(F)c1 547829946 YFOMACVMWQRKEC-BUXKBTBVSA-N 335.369 5.081 30 20 EKED C[C@H](CCc1c(F)cccc1F)N[C@H](CCCC#N)c1ccccc1 551222460 LJJJLDDPLLZBDY-IIBYNOLFSA-N 342.433 5.311 30 20 EKED CCCCOc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 551532857 HHMSKCFNYKCFAO-GCJKJVERSA-N 336.479 5.561 30 20 EKED Cc1csc(NC(=O)CCCCCO[C@@H]2CCC[C@H](C)C2)c1C#N 554774492 NBDDSUJENRKZMH-GOEBONIOSA-N 348.512 5.022 30 20 EKED C[C@H](CCCC(F)(F)F)NCc1cc(F)c(C(F)(F)F)cc1F 558258333 VCRRAEOUQHNHCB-MRVPVSSYSA-N 349.265 5.194 30 20 EKED COc1ccc([C@@H](CCC#N)NCc2cccc(Cl)c2Cl)cc1 562592657 QAPSZBPYBIYANG-QGZVFWFLSA-N 349.261 5.137 30 20 EKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccccc2)c1 609722523 IPCZALPTEINGMB-UHFFFAOYSA-N 348.789 5.256 30 20 EKED CC(C)c1cccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1 726440509 DJJSAQGBBQDFIO-UHFFFAOYSA-N 329.856 5.144 30 20 EKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 728764614 SZBBXVLYIOJKMT-IAGOWNOFSA-N 348.471 5.302 30 20 EKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cccnc2Cl)cc1 741467909 AZUYWSRSFXCVOV-SEYXRHQNSA-N 349.817 5.307 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2cc(F)ccc21 747439464 FQFIIELLZORNAB-XYOKQWHBSA-N 341.432 5.223 30 20 EKED COc1ccc2cc(C(=O)/C=C\c3scnc3C3CC3)ccc2c1 782301772 MKFSQVSNFOLBDJ-HJWRWDBZSA-N 335.428 5.078 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1O 789890464 ROEWGEVDGVWMTI-UHFFFAOYSA-N 329.827 5.150 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1ccc(Br)cc1 834675322 GFBRNWWUHSHFAM-FNORWQNLSA-N 327.630 5.060 30 20 EKED C/C=C/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 915656349 SMLKRENTXBXDFO-PYGTZFSQSA-N 336.822 5.066 30 20 EKED O=C(O)c1cc(NN=Cc2cccc(C3CCCC3)c2)ccc1Cl 1776034297 YSJJCCORLTZTAE-UHFFFAOYSA-N 342.826 5.142 30 20 EKED COc1ccc(C(C)(C)C)cc1N[C@H](C)c1ccc(OCC#N)cc1 326865392 WMKGAFYEJRTJJR-OAHLLOKOSA-N 338.451 5.068 30 20 EKED C=CCC[C@H](NC(=O)[C@@H](C)CC(F)F)c1ccc(C(F)(F)F)cc1 412210811 ZQXQPWZWCHVKNI-FZMZJTMJSA-N 349.343 5.120 30 20 EKED C=C(C)[C@H](NCc1ccc(C(F)(F)F)s1)c1ccc(F)c(F)c1 428880217 JCOKYVOWMNGOJI-HNNXBMFYSA-N 347.352 5.452 30 20 EKED CC(C)(C#N)CCCSCc1csc(-c2ccc(F)cc2)n1 480395095 KRSATYGNRZUJRQ-UHFFFAOYSA-N 334.485 5.512 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1sccc1Br 537948840 HGCHLDLDOBASHL-WFASDCNBSA-N 349.297 5.206 30 20 EKED N#CCCCCCC(=O)Nc1cccc(-c2ccc(F)c(F)c2)c1 590875619 AFBHSJQLRDMBCR-UHFFFAOYSA-N 328.362 5.044 30 20 EKED C[C@@H](SCc1cc(C#N)ccc1F)c1ccc(OC(F)F)cc1 609391025 GSZLCYADHVCTFH-LLVKDONJSA-N 337.366 5.293 30 20 EKED C=Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 671065151 NQDKUWZGXQGFRJ-AWEZNQCLSA-N 338.819 5.083 30 20 EKED CCC[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 726445227 UBJNALUBPPLAME-KRWDZBQOSA-N 343.883 5.039 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nc2ccccc2n1C 744010281 FTLAGOSNTNAQAU-IERDGZPVSA-N 339.483 5.136 30 20 EKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2ccc(F)c(F)c2)ccc1OC 749453116 RDHVJVRGTLIFOL-NEXMIYJRSA-N 346.373 5.047 30 20 EKED CC1(C)CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc2ccccc2s1 752473328 FZURDELYLQKTEN-ZIAGYGMSSA-N 326.465 5.079 30 20 EKED CC[C@H](C)c1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1 755199300 CSNHRYYZDPLQHY-INIZCTEOSA-N 336.435 5.135 30 20 EKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccccc1-c1cccs1 767811391 FXHFBIJJOKMYBY-KRWDZBQOSA-N 344.480 5.325 30 20 EKED Cc1cccc(C)c1NC(=S)N[C@@H](CCCC#N)c1ccccc1 814209836 GRTGAKREURZLNS-SFHVURJKSA-N 337.492 5.025 30 20 EKED Cc1c(CNc2cccc(OCC#N)c2)sc2c(Cl)cccc12 816564339 BQGLJAYULQJHNS-UHFFFAOYSA-N 342.851 5.378 30 20 EKED C[C@@H](C#N)Oc1ccccc1NCc1ccc([C@H](C)C(F)(F)F)cc1 834571276 POUCIPWOMZLYJD-KBPBESRZSA-N 348.368 5.255 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(-c2ccccc2)no1 926481291 SXOINSJLQONWEH-FXAWDEMLSA-N 345.446 5.427 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 90665549 OBJWDESEPBQLPD-KBXCAEBGSA-N 332.369 5.401 30 20 EKED CCN(C(=O)Nc1cc(Cl)ccc1C)[C@@H](C)c1ccc(C#N)cc1 118793223 JFWUUDWSXCXUGA-AWEZNQCLSA-N 341.842 5.135 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@@H](CCC#N)c1ccccc1 159724000 JURVOJOLMARNPU-IBGZPJMESA-N 335.451 5.285 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(CSC(C)C)c2C)CC1 173879417 FZBZMWCPLYQSNL-UHFFFAOYSA-N 332.513 5.067 30 20 EKED Cc1cccc(/N=C2\N=C(O)/C(=C/c3ccc(F)cc3F)S2)c1 206061069 KKPNXJJUSMKZSA-NVNXTCNLSA-N 330.359 5.005 30 20 EKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 436464731 QVRUFLJDOOJWCQ-IBGZPJMESA-N 349.902 5.157 30 20 EKED CC(C)(C)c1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1 439297244 QHNJNPLFMSZNQC-LJQANCHMSA-N 335.451 5.151 30 20 EKED CC(C)(CCC#N)CNCc1ccccc1-c1ccc(Cl)cc1 462770984 AQGOLWQRJZNVLG-UHFFFAOYSA-N 326.871 5.427 30 20 EKED C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 466416374 IVFUGMYCCOECGK-ZDUSSCGKSA-N 330.815 5.068 30 20 EKED N#Cc1ccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)s1 471442472 HDDWSYXCKCVVHJ-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#Cc1ccc(SCc2csc(-c3ccc(Cl)cc3)n2)cc1 476735914 WECIKXNSQZNHSR-UHFFFAOYSA-N 342.876 5.627 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccoc1C1CC1 503902786 PZXYROOBJNDIQJ-UHFFFAOYSA-N 334.400 5.009 30 20 EKED C[C@@H](NCc1ccc(-c2ccc(F)cc2)s1)c1ccc(C#N)cc1 520216543 QHOSKGJPSONVKX-CQSZACIVSA-N 336.435 5.277 30 20 EKED CCCCN(C(=O)NCc1cccc(C#N)c1)[C@H](CC)c1ccccc1 523705229 DZTATCHFBOTQOM-OAQYLSRUSA-N 349.478 5.021 30 20 EKED CC(C)[C@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)cc1F 543186382 VQKJEFOMOATVKY-IBGZPJMESA-N 330.834 5.032 30 20 EKED Cc1c(Cl)cnc(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1C#N 544067986 XVLHJBDXJWPTKF-CQSZACIVSA-N 348.837 5.150 30 20 EKED C=CCC[C@@H](NCc1ccccc1OCC(F)(F)F)c1ccco1 552038030 GAEMTEBYUBYCRJ-OAHLLOKOSA-N 339.357 5.018 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)c(F)c1 553770827 WAZWHYIRQQBTTL-IVZQSRNASA-N 348.396 5.277 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(-c3ccccc3)c2)c1 554031729 KJXZTIRNPITALI-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccsc1Cl 556438478 NDZLBUXRGDYLIC-UHFFFAOYSA-N 349.883 5.271 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(C(F)(F)F)cc1 563575068 ZCIOHPPMOZNRLE-RYUDHWBXSA-N 336.332 5.128 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3NC1(c2cccc(C#N)c2)CC1 575021113 QFXQZWIWMMWDMU-OAQYLSRUSA-N 341.458 5.004 30 20 EKED C[C@H](NC[C@H](C#N)CCC#N)c1ccc(-c2ccc(Cl)cc2)s1 580543412 XXOWJPRZUFEOHU-KBPBESRZSA-N 343.883 5.163 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 588371702 AFRCGZINXPXEHR-SFHVURJKSA-N 332.875 5.258 30 20 EKED N#Cc1ccc(CN[C@H](CC2CC2)c2ccccc2)c(C(F)(F)F)c1 589506612 JKHCINAEJYLBBC-LJQANCHMSA-N 344.380 5.208 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1c(F)cccc1Cl 611394314 CDNQKBABEFFHIE-KPZWWZAWSA-N 328.818 5.079 30 20 EKED CC(C)c1ccc(C(C)(C)NCc2ccc(O[C@H](C)C#N)cc2)cc1 729686651 RBQFYOXDISXXFC-QGZVFWFLSA-N 336.479 5.126 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(COCCCCCC)c2)CC1 732428519 INEUXFUDPWMYJN-UHFFFAOYSA-N 344.499 5.213 30 20 EKED N#Cc1ccc(NC(=S)Nc2csc3ccccc23)cc1Cl 778528062 JXTJSJIKDCOFJV-UHFFFAOYSA-N 343.864 5.235 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3csc(Cl)c3)co2)cc1 787186955 ULMONWTYWVRZEF-SREVYHEPSA-N 329.808 5.261 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Cl)cc1 915086842 NGRSIPJCMYQIOD-IBGZPJMESA-N 346.817 5.248 30 20 EKED CCCCCCCCCCC(=O)Nc1cc2c(cc1F)CCC(=O)N2 915855253 FOKQNJAXKMJUHY-UHFFFAOYSA-N 348.462 5.180 30 20 EKED CCC(=NNc1ccc2ccccc2n1)c1ccc(OC(F)F)cc1 916285924 PVKFSNAFUOMTOS-UHFFFAOYSA-N 341.361 5.062 30 20 EKED N#CCC[C@H](NCc1cnc(-c2ccsc2)s1)c1ccccc1 130439826 VEIUBGOKQZJSHS-KRWDZBQOSA-N 339.489 5.006 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)C1CCCC1 131008430 ZLRWYLZODQVJLW-CQSZACIVSA-N 330.497 5.093 30 20 EKED Cc1ccc(-c2ncc(CNc3ccccc3O[C@@H](C)C#N)s2)cc1 181128227 ZOHHXMZDYIOWBJ-HNNXBMFYSA-N 349.459 5.022 30 20 EKED C=CCN(CC1CCCCC1)C(=O)N[C@H]1CCSc2ccccc21 303446537 IZJHTBQVPLYGCK-SFHVURJKSA-N 344.524 5.001 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCCc3c(Cl)sc(Cl)c32)C1 453284660 BFDGMKOSABYMEW-NHCYSSNCSA-N 329.296 5.104 30 20 EKED N#CCSCCCN(Cc1cccc2ccccc12)C1CCCC1 466746145 OHDJYDQVYDNBMA-UHFFFAOYSA-N 338.520 5.231 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(Cl)cc1 476080764 QIPBWTBYFCTGOY-UHFFFAOYSA-N 341.882 5.763 30 20 EKED C=C(C)[C@H](NCc1cc(-c2ccccc2)no1)c1ccc(F)c(F)c1 481603605 ZKEKXRQIMGEDDM-FQEVSTJZSA-N 340.373 5.027 30 20 EKED Cc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)ccc1C#N 488149239 LCFQHLIOMZXJAA-LJQANCHMSA-N 344.380 5.126 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(C)ccc1Br)c1ccccc1 489611765 OANXZSAEGJTZFW-OAHLLOKOSA-N 344.252 5.056 30 20 EKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(C#N)cc1 500438680 FIIMYQNVKDUROG-INIZCTEOSA-N 346.455 5.023 30 20 EKED C=C[C@@H](CC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2)c1ccccc1 500629223 IMTPAKYVVASOPN-CDNPAEQRSA-N 343.470 5.193 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)c1ccc(C#N)c(F)c1 539609088 DCQWSWSRXBOKAW-CVEARBPZSA-N 345.421 5.171 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1c(Cl)cccc1Cl 557508783 SZNPFVNJFFOZRQ-SFHVURJKSA-N 331.246 5.032 30 20 EKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nc(C)cs3)sc2c1 591019500 XWTNVOLVIMQGBQ-NSHDSACASA-N 346.864 5.118 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)cc1Cl 618807474 ZVKADAABUIVMMM-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)cn1 727267225 QDMBRBOSOWGTCU-XQRVVYSFSA-N 342.748 5.032 30 20 EKED C#Cc1cccc(N(C(=S)Nc2cccc(Cl)c2C)C(C)C)c1 728226700 JJSCRURQAUMGLP-UHFFFAOYSA-N 342.895 5.242 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1cccc(OC(F)(F)F)c1 730949543 XYPLIBUEIMAHTH-CLFYSBASSA-N 343.304 5.030 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)c1cc(Cl)ccc1Cl 739422579 WBTXGNAYCMVYLY-UHFFFAOYSA-N 348.155 5.243 30 20 EKED C[C@@H](OC(=O)Cc1ccc(C#N)cc1)c1ccccc1-c1ccccc1 750411430 JBUPNXMMUHTROP-QGZVFWFLSA-N 341.410 5.072 30 20 EKED C#CCCCCC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 773299434 YCGSDMQJNYBYHC-GOSISDBHSA-N 335.447 5.267 30 20 EKED C=CCC1(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)CCC1 790760382 VOOTXOOKGUISQD-NRFANRHFSA-N 349.474 5.038 30 20 EKED C=CCC[C@@H](NC(=O)c1cc(C2CC2)cnc1Cl)c1ccccc1 793698352 YGQSCECVDOMMFZ-GOSISDBHSA-N 340.854 5.050 30 20 EKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1O 810221195 MILAHCDPOFSTLE-SJKOYZFVSA-N 348.368 5.085 30 20 EKED FC(F)Oc1ccc(CON=Cc2cccc(Cl)c2Cl)cc1 918732930 CYJQHXJITRYHNU-UHFFFAOYSA-N 346.160 5.146 30 20 EKED Cc1c(NN=C2CCCC[C@H]2C2=CCCCC2)cccc1C(=O)O 1776088010 KHDUADHJSDMVQW-KRWDZBQOSA-N 326.440 5.152 30 20 EKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776119618 GUWCJFDIJFZKMX-ONNFQVAWSA-N 348.398 5.325 30 20 EKED CC1(C)CCC/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C1=O 1776551019 YSERMAYSAKZSGL-NTCAYCPXSA-N 340.444 5.276 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(CC2CCC2)cc1 1776783923 AROKCQJHHUWGKB-OAQYLSRUSA-N 345.527 5.323 30 20 EKED C(=Nc1cccc2c(N=Cc3ccncc3)cccc12)c1ccncc1 2332239720 FJXHPRVSTIXUPE-UHFFFAOYSA-N 336.398 5.131 30 20 EKED COc1ccc2c(c1)CC/C(=C\c1nc(-c3ccccc3)cs1)C2=O 60370889 UWZOUQBRKJFAMY-FOWTUZBSSA-N 347.439 5.031 30 20 EKED C[C@@H](Nc1cc(Br)ccc1Cl)c1cccc(C#N)c1 61690923 SJUFIESKDXDHOR-SNVBAGLBSA-N 335.632 5.147 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(C(F)(F)F)cc1 182241836 WQAWPKPODIBANB-QWHCGFSZSA-N 334.341 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(F)c(F)cc1F 189895538 AGTXSQYHCWYRSJ-UHFFFAOYSA-N 347.380 5.137 30 20 EKED C[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Cl 190892359 FQQVTSXWCFBWHX-STQMWFEESA-N 344.867 5.033 30 20 EKED CCN(Cc1cc(-c2ccc(C)cc2)no1)[C@H](C)c1ccc(C#N)cc1 195594387 NAHYIYKDXDDCFU-QGZVFWFLSA-N 345.446 5.105 30 20 EKED C[C@@H](Nc1ccccc1SCC(F)(F)F)c1cccc(C#N)c1 319837387 RSLJCYFPUKGVLK-GFCCVEGCSA-N 336.382 5.386 30 20 EKED Cc1nnc([C@H](C)/N=C(/O)C2(C3CCCCC3)CCCCC2)s1 329558347 HZJNJZRXPZZFDK-ZDUSSCGKSA-N 335.517 5.395 30 20 EKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 445616595 QZXDEBJSKLVVAS-BEFAXECRSA-N 335.513 5.053 30 20 EKED Cc1ccc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)n1 478378056 KJXRQMVKNILLNR-UHFFFAOYSA-N 347.393 5.114 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C)c(F)cc1Cl 487262895 CERBMEFQSHERBX-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C=CCN(CC=C)C(=O)Nc1ccc(Sc2ccccc2)cc1C 510888437 VLUCNPXWUKTGLU-UHFFFAOYSA-N 338.476 5.352 30 20 EKED CC[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 521259898 SOIPRNHCLHXPCH-ARFHVFGLSA-N 345.512 5.029 30 20 EKED N#CC1(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CCC1 522936940 MVASORNLEMZMRP-UHFFFAOYSA-N 342.851 5.124 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(CSC)c1 525831898 YMWGONDIMZTWEI-UHFFFAOYSA-N 340.492 5.160 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccccc1 537950068 HKNSNMINBHSMON-LPHOPBHVSA-N 325.452 5.062 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc[nH]c3C(C)C)n2)cc1 563241874 JMJAGTZKJCMJKF-MRXNPFEDSA-N 349.459 5.060 30 20 EKED CC(C)[C@H](C#N)c1ccc(-c2ccccc2OC[C@@H]2CCOC2)cc1 592987214 XHACBYYTDMMDNM-UTKZUKDTSA-N 335.447 5.032 30 20 EKED N#CC1(CC(=O)Nc2c(Cl)cc(Cl)cc2Cl)CCCCC1 598806689 CEIVLOKMNRFYPT-UHFFFAOYSA-N 345.657 5.449 30 20 EKED Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)CCCCC#N 598895602 PDXKMOYNYBEVDL-UHFFFAOYSA-N 344.361 5.088 30 20 EKED CC(C)C[C@@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608861137 WIKKUGIRBCAYPC-LJQANCHMSA-N 346.396 5.454 30 20 EKED Cc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1[N+](=O)[O-] 734981725 SLFBMLNACOTXEC-RUDMXATFSA-N 349.358 5.114 30 20 EKED CCCCCC[C@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 741924002 BCBMSRSWDAERGR-HOTGVXAUSA-N 332.513 5.626 30 20 EKED CC(C)(CCC#N)CNc1ccc(CC[C@H](O)c2ccccc2)cc1 770558831 LSBDFSIZWTYQAN-NRFANRHFSA-N 336.479 5.095 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(Cl)c1C 794995148 LZJSEOIWGOQVBD-UHFFFAOYSA-N 344.911 5.424 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H]1CC[C@@H](CC#N)C1 840788384 NXUVGFMAADCDEK-HOTGVXAUSA-N 343.540 5.302 30 20 EKED C=CCC[C@H](NCc1cccc(F)n1)c1ccc(C(F)(F)F)cc1 851905104 HWFIFHDRENOMQL-INIZCTEOSA-N 338.348 5.037 30 20 EKED CC(=NNc1ncccc1Cl)c1cc(F)c(Cl)cc1Cl 917549072 ICXVBJUZOOBZDN-UHFFFAOYSA-N 332.593 5.017 30 20 EKED Cc1cccnc1[C@@H](NCc1ccc(C(C)(C)C#N)cc1)C(C)(C)C 934287188 BIMAQRRLTWHZSS-HXUWFJFHSA-N 335.495 5.068 30 20 EKED CC(C)[C@@H]1/C(=C\c2cc(C(=O)O)c(Cl)s2)C(=O)c2ccccc21 1776308582 FMWAAFKMRQWTDK-COSNYCCFSA-N 346.835 5.119 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)(F)F 90665615 SSXJENLEVHMIDD-WMLDXEAASA-N 348.368 5.281 30 20 EKED C=CCN(Cc1ncc(-c2ccc(Cl)cc2)o1)Cc1cccs1 247990699 KGTYVSFRHLAGKC-UHFFFAOYSA-N 344.867 5.245 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(C(F)F)c1 280022362 JYCPMEQWMFHGKX-CYBMUJFWSA-N 332.419 5.631 30 20 EKED CC(C)(C)/C(O)=N/C1CCC(c2nc(CC3CCCCC3)no2)CC1 329724176 CZBHIWJRCRVFAK-UHFFFAOYSA-N 347.503 5.221 30 20 EKED Cc1ccccc1C1(C(O)=Nc2ccc3occ(C)c3c2)CCOCC1 330038845 FDIUWMRNCFKIMK-UHFFFAOYSA-N 349.430 5.386 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 340443168 FLNJWOBEIHTEHJ-WOJBJXKFSA-N 326.871 5.816 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1ccc(C(F)(F)F)cc1 410360734 ALJJQDAJQUBJOZ-UHFFFAOYSA-N 333.353 5.005 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455388993 WABNAGQWYFGMAT-NRFANRHFSA-N 347.462 5.362 30 20 EKED CCN(C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 461537811 ZAOSCJAQFWGLQC-UHFFFAOYSA-N 342.398 5.017 30 20 EKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 467714568 RBXZWBVPLWKTAP-MAUKXSAKSA-N 349.434 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(C)c(C)ccc2[nH]1 476794641 HLAXENMDODEPBB-UHFFFAOYSA-N 346.474 5.889 30 20 EKED CC(C)n1c([C@H]2CCCN2CCCC(C)(C)C#N)nc2ccccc21 483063219 LXFUMBYCGRJFQC-LJQANCHMSA-N 338.499 5.084 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487486635 PNIVOMBZGUWGGU-DENIHFKCSA-N 348.490 5.197 30 20 EKED C[C@H](NC1CC(c2ccc(C(F)(F)F)cc2)C1)c1ccc(C#N)cc1 544041409 LGFVVQVBPSJLQF-LJSZUPLFSA-N 344.380 5.174 30 20 EKED CCSc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 551211857 YJWVUDDGYLERRZ-UWJYYQICSA-N 338.520 5.884 30 20 EKED N#Cc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)cc1F 568683604 OKPYMSBWHNORDE-SFHVURJKSA-N 349.236 5.245 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 580101750 HHNMIBCCOXGUED-MBSDFSHPSA-N 328.459 5.926 30 20 EKED CC(C)(C)c1ccc(Cl)cc1NCCCC1(C#N)CCOCC1 619745774 WYJGKTILGLSMJJ-UHFFFAOYSA-N 334.891 5.150 30 20 EKED N#CCOc1cccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)c1 730150173 PHPXOJAVRGCDHM-IZZDOVSWSA-N 345.423 5.214 30 20 EKED C[C@H]1CCCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734059817 IWTFVKFIIUIJQK-UWJYYQICSA-N 347.462 5.138 30 20 EKED C=CC[C@H](NC(=O)c1ccc(C2CCCCC2)cc1)c1ccncc1 734234548 QLFWETYILDYTCN-NRFANRHFSA-N 334.463 5.177 30 20 EKED CCC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 745948389 ZJOYHFDROXLFKV-OAHLLOKOSA-N 326.465 5.121 30 20 EKED CCC(CC)CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 759536810 AJXGRAIZPOZEGQ-INIZCTEOSA-N 326.465 5.121 30 20 EKED C/C=C(/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC 764841761 YHPZQUGIVQORNH-LOLJJCHOSA-N 330.431 5.193 30 20 EKED C=CC[C@H](N[C@H](C)c1oc2ccc(OC)cc2c1C)c1ccncc1 766020596 QOUAIDOFMOMETG-BEFAXECRSA-N 336.435 5.113 30 20 EKED O=C(/C=C/c1cncc2ccccc12)c1ccc(-c2ccncc2)cc1 772806238 LBFRJLABSPTJHY-MDZDMXLPSA-N 336.394 5.193 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2cccc(Oc3ccccc3)c2)cc1 776494646 PWZWFFJXBVHQRW-QGZVFWFLSA-N 344.414 5.382 30 20 EKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813218059 SAYGBYMPFDSMFN-LRDDRELGSA-N 346.352 5.104 30 20 EKED Clc1ccc(-c2nc(C=NOCc3ccccc3)cs2)cc1 839421799 NGUZFXJVBFGWDQ-UHFFFAOYSA-N 328.824 5.014 30 20 EKED CCCCCCCCC(=O)N(C)[C@H](C)c1nc2ccccc2s1 886731542 HPLAVINXEVEOAE-OAHLLOKOSA-N 332.513 5.566 30 20 EKED C=CCN(C(=O)c1sc2cc(Cl)ccc2c1Cl)C(C)C 915147575 DQQPUKJLGGVXLF-UHFFFAOYSA-N 328.264 5.245 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352874 OJAZRNJUFIOUFE-LEWJYISDSA-N 347.462 5.138 30 20 EKED CCOc1cccc2cc(C(=O)/C=C\c3ccc4ncccc4c3)oc12 916130120 IPAYOAPVBCJZTJ-LUAWRHEFSA-N 343.382 5.276 30 20 EKED CC(=NNc1cccc(C(=O)O)c1C)c1sc2ccccc2c1C 1776086260 JUSDZJGFJRMNOZ-UHFFFAOYSA-N 338.432 5.052 30 20 EKED Cc1c(NN=C2C[C@H](C)C[C@@H](c3ccccc3)C2)cccc1C(=O)O 1776087054 GHEJHJXBGGDOBO-RHSMWYFYSA-N 336.435 5.065 30 20 EKED CCCCCCCCCCCN(C)CCc1ccccc1C(=O)O 1776784546 BNVCAYOUWYFHOY-UHFFFAOYSA-N 333.516 5.390 30 20 EKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cc1 5186315 LJENTZINEWOWPR-CXUHLZMHSA-N 341.410 5.208 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 25438137 YTAOCUPBHMRHMY-UHFFFAOYSA-N 333.218 5.047 30 20 EKED C[C@H](C#N)Oc1ccccc1NCc1csc(C2CCCCC2)n1 182552174 NFPAYLJQOSPLTA-CQSZACIVSA-N 341.480 5.094 30 20 EKED O=C1/C(=C\c2csc(-c3ccc(F)cc3)n2)CCc2ccccc21 212103897 LEIRMUICSYOOOH-PTNGSMBKSA-N 335.403 5.162 30 20 EKED CCCOc1ccc(Cl)cc1N[C@H](C)c1ccc(OCC#N)cc1 324273559 ZALPEHOMQBKEMS-CQSZACIVSA-N 344.842 5.204 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)SCCC(C)(C)C#N)o2)cc1C 419472382 HQFAJVPGSZGDQO-CQSZACIVSA-N 329.469 5.088 30 20 EKED Cc1ccc2ccccc2c1CN[C@H](CCCC#N)c1ccccc1 433035889 OJHBWAZOZAOTRO-HSZRJFAPSA-N 328.459 5.673 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(C(C)(F)F)c1 444937474 OZMPLJCASCNICM-UHFFFAOYSA-N 344.405 5.061 30 20 EKED CC(C)c1nc2ccc(NC(=O)[C@@H](C)c3cccc(C#N)c3)cc2s1 461927149 HHPJDYPZXGUYMW-ZDUSSCGKSA-N 349.459 5.034 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)C1 463237698 WYVGNRAHQRSSOK-KKBFJZEXSA-N 336.401 5.013 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1ccc(C#N)c(F)c1 479457774 SBZPBRKVHBYPSD-UHFFFAOYSA-N 326.415 5.015 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(CCSC)cc1 485330414 KATDXZIAIZVEBP-UHFFFAOYSA-N 346.540 5.192 30 20 EKED CC[C@@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1ccc(C#N)cc1F 512628099 CWRXRCRKGVUNSD-CVEARBPZSA-N 340.442 5.034 30 20 EKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3ccc(C)o3)s2)s1 513664740 ZBDQRIICXDCXBG-UHFFFAOYSA-N 342.445 5.064 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(SC)ccc1C 540558752 QHSPADHVOTUNTA-UHFFFAOYSA-N 344.455 5.076 30 20 EKED N#Cc1c(N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cccc1C(F)F 572687362 YWEZMPRBYPCZTE-IRXDYDNUSA-N 348.780 5.091 30 20 EKED CC(C)c1ccoc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 574539506 ZBBXFRHUCMGVOU-LBPRGKRZSA-N 344.823 5.156 30 20 EKED CC[C@@H](NC[C@@H](Cc1ccccc1)C(F)(F)F)c1ccc(C#N)cc1 581041694 YNCALAHYHYESTA-RTBURBONSA-N 346.396 5.020 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccnc2)C2CCCCC2)cc1Cl 593711997 KRWMYHRLQFOBPK-HXUWFJFHSA-N 339.870 5.018 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)F)nc1 595038135 JOGKHLDPORBXEZ-WMLDXEAASA-N 329.394 5.105 30 20 EKED N#CCOc1cccc(/C=C/c2nc(-c3ccc(F)cc3)cs2)c1 727745002 ZBWOJZLKLRHROI-RUDMXATFSA-N 336.391 5.022 30 20 EKED N#CCC[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccccc1 747690013 CUZUUHTVHJHWAG-NBZOHKLQSA-N 333.218 5.163 30 20 EKED C[C@H](ON=Cc1ccccc1F)c1ncc(-c2ccc(Cl)cc2)o1 752761403 CQMLAUGXVCKYBN-LBPRGKRZSA-N 344.773 5.246 30 20 EKED C[C@@H](C=NOc1ccccc1C(F)(F)F)c1cccc(Cl)c1 763370316 NZXMNROSWXPWFL-NSHDSACASA-N 327.733 5.527 30 20 EKED CC[C@@H](C)c1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)cc1 764272612 NBCLDTDVQCAZMW-CYBMUJFWSA-N 326.827 5.002 30 20 EKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(C)C 764566834 GRNUSSGDQKJTLQ-JKSUJKDBSA-N 326.465 5.059 30 20 EKED C=C(C)[C@@H](NCc1cc2cccc(OC)c2o1)c1ccc(F)c(F)c1 775317977 BPUGFHVEAJZRJM-LJQANCHMSA-N 343.373 5.127 30 20 EKED CCCCC[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352026 IFTAVJXXLZXAFO-UTKZUKDTSA-N 349.478 5.432 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(N2CCCCC2)cc1 90665260 YKAKEPSVVCSGCL-XXBNENTESA-N 347.506 5.373 30 20 EKED CC1(C)C[C@@H](c2cccc(Br)c2)Nc2ccc(C#N)cc21 91691853 IQLMLECCXBUHPO-KRWDZBQOSA-N 341.252 5.155 30 20 EKED CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 159296949 KDICODRPZHKJLI-HZPDHXFCSA-N 345.512 5.267 30 20 EKED CC[C@@H](C)Oc1ccc(NCc2cccc(OCCCC#N)c2)cc1 236925246 RRFZQBAQUVYBKE-QGZVFWFLSA-N 338.451 5.159 30 20 EKED Cc1nc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 367805155 VYVXBIXQGVAYLI-LSDHHAIUSA-N 347.487 5.402 30 20 EKED CCC(CC)n1ccc(CNc2ccccc2SC[C@@H](C)C#N)n1 433502425 PKTSCRCWCLWRSL-HNNXBMFYSA-N 342.512 5.108 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 467822968 DHGLGVYTJPJSGA-UHFFFAOYSA-N 342.826 5.234 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)c1cccc(-c2cscn2)c1 470644049 YDVWKUZVHAUBHT-UHFFFAOYSA-N 348.471 5.029 30 20 EKED C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1F 512646759 CWPJFCNUISMQCG-ORAYPTAESA-N 328.406 5.274 30 20 EKED C=C(C)COc1cc(CN[C@H](CCC)c2ccccc2)ccc1OC 518768972 XYNPORPHHDPQMY-HXUWFJFHSA-N 339.479 5.281 30 20 EKED C=CCOc1ccccc1CNc1ccc(COC2CCCC2)cc1 523519692 WXDMEBINVFTARF-UHFFFAOYSA-N 337.463 5.323 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1Cc2c(Cl)cccc21 529134080 BMGQYFMEYBWDLG-GOSISDBHSA-N 339.866 5.470 30 20 EKED C[C@@H](NCc1ccc(F)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542013112 FGNDLPVPOORKFY-MRXNPFEDSA-N 330.406 5.215 30 20 EKED CCC(C)(C)OCc1cccc(NC(=O)CCCCCC#N)c1C 588160874 SUDQYUKRIFRFAU-UHFFFAOYSA-N 330.472 5.113 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccncc2s1 595039299 QXUOSRBKEGVEDN-CRAIPNDOSA-N 335.476 5.382 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2occc2s1 605450206 HEOJRRVPGDUNSB-UHFFFAOYSA-N 337.853 5.038 30 20 EKED C=CCCCCCN(C)C(=O)c1cnc(-c2ccccc2Cl)s1 606816222 RDQLDBAKLGFLHM-UHFFFAOYSA-N 348.899 5.282 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1sc2ccc(F)cc2c1C 609189523 UNHXOZBDDIYMCY-UHFFFAOYSA-N 346.471 5.141 30 20 EKED C=CCOc1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1 680403950 HWYQTOREUQUSDK-UHFFFAOYSA-N 337.753 5.095 30 20 EKED CCCC(=CC(=O)Nc1ccccc1SC[C@@H](C)C#N)CCC 770725452 CEMBRQHHXQJDHZ-HNNXBMFYSA-N 330.497 5.403 30 20 EKED CC(C)c1ccc(/C=C/CC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780166410 XAGHSXJVWMDRMK-LXXRFIIISA-N 348.446 5.143 30 20 EKED CSc1ccc(C(=O)/C=C\c2cnc(-c3ccco3)s2)cc1F 789143073 OCEOPWVLYGPZRY-WAYWQWQTSA-N 345.420 5.160 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)C1(c2ccc(C#N)cc2)CCCC1 859844674 NJVMBZYLXNTHCM-UHFFFAOYSA-N 346.474 5.441 30 20 EKED CC(C)(CC(F)(F)F)C(=O)Nc1ccc([C@@H](F)C(F)(F)F)cc1 893911443 UYBLPZGGLAOGEP-SNVBAGLBSA-N 345.258 5.177 30 20 EKED CCCCCCCCC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 920232917 XWRLCERKMGFEEL-TZIWHRDSSA-N 331.500 5.021 30 20 EKED Cc1c(NN=C2CCC(C3CCCCC3)CC2)cccc1C(=O)O 1776087879 CJCSWUBGBUCGBG-UHFFFAOYSA-N 328.456 5.232 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1 1776697835 QJWHJSFMEOEMON-CWVZWOLNSA-N 334.415 5.194 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C2CC2)c(C)c1 1776784332 WKRSEWYYVNULBD-LJQANCHMSA-N 331.500 5.166 30 20 EKED CCC[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 59281307 ULHNSKXFKVWCHV-KDOFPFPSSA-N 340.854 5.370 30 20 EKED C=CCOc1cccc(NC(=O)c2sccc2-c2ccccc2)c1 65749471 LWNBSHOQKVGFHE-UHFFFAOYSA-N 335.428 5.232 30 20 EKED CC(C)(C)[C@@H](NCc1ccc(C#N)o1)c1cccc(C(F)(F)F)c1 179431688 YXXRBCXAMBCVQZ-INIZCTEOSA-N 336.357 5.047 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OC(F)F)c1 189891861 BDZBPTHFNZTVBT-UHFFFAOYSA-N 345.389 5.392 30 20 EKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/[C@@H]2CCCCC23CCCC3)C1 329799179 IBPGFRCYAVPUNI-NVXWUHKLSA-N 344.430 5.361 30 20 EKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 439586761 AENHDQIKAFWQPL-MRXNPFEDSA-N 339.398 5.395 30 20 EKED N#C[C@H]1CC[C@@H](Nc2ccc(SCc3ccccc3Cl)cn2)C1 442833342 HLRXSFGQXIKLIX-DZGCQCFKSA-N 343.883 5.131 30 20 EKED CCCCC[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458799766 KDLIHNJRJILQKT-UXHICEINSA-N 341.499 5.176 30 20 EKED C[C@H]1CCCC[C@@H]1N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482605777 OBFGLNNKUWRORM-KKSFZXQISA-N 348.446 5.001 30 20 EKED C=CCN(Cc1cccs1)C(=O)c1cc2c(ccc3ccccc32)[nH]1 486199106 ODNXLTKHNWZGCG-UHFFFAOYSA-N 346.455 5.211 30 20 EKED C[C@H](N[C@H](C)c1ccc(Oc2cccnc2)cc1)c1ccc(C#N)cc1 487935559 NFKLUGIAYDUXDX-DLBZAZTESA-N 343.430 5.157 30 20 EKED C=C[C@H](CC(=O)N1CC2(CCC2)[C@H]1c1ccccc1)c1ccccc1 495359600 SMKZFZIYMBVFJW-XMSQKQJNSA-N 331.459 5.100 30 20 EKED N#Cc1cccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 521813964 MVICYEQKBXTYNT-JOCHJYFZSA-N 346.861 5.285 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536816401 MGSHNFUZMLUJCC-MAUKXSAKSA-N 349.434 5.145 30 20 EKED CCc1ncc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541256871 FHJURDUCUZFROC-HNNXBMFYSA-N 347.487 5.095 30 20 EKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(CCC#N)CC1 592135568 LJFMAHMPMSPOAS-AWEZNQCLSA-N 343.858 5.072 30 20 EKED Cc1cc2cc([C@@H](C)N[C@@H]3CCc4cc(C#N)ccc43)oc2cc1C 618803020 GMSPYKQPGTXYHY-FOIQADDNSA-N 330.431 5.259 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCC[C@@H]1c1ccncc1 726883877 NOKGHXONXOYROZ-KTZABMDBSA-N 328.500 5.442 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 727974232 JFPBWYKDYLXDMM-KHPPLWFESA-N 330.412 5.188 30 20 EKED CC(=NNc1cc(Cl)nc(C)n1)c1ccc(-c2cccs2)cc1 741766385 KWEIAELVRAGWJC-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CCCCCC[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N 741899403 NNCPYKGCERPBKY-QGZVFWFLSA-N 338.451 5.291 30 20 EKED C[C@@H](ON=Cc1ccc(C(C)(C)C)cc1)c1nnc(-c2ccccc2)o1 748094348 BCXWOMMLUMODEE-OAHLLOKOSA-N 349.434 5.146 30 20 EKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 756518888 JOALYZYVAALUFX-AINHQSCGSA-N 346.817 5.168 30 20 EKED Fc1ccc(CC=NOc2ccccc2C(F)(F)F)c(Cl)c1 766454460 ZBLWNLHVCAIRJK-UHFFFAOYSA-N 331.696 5.105 30 20 EKED C#CCCCCCC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C 779982254 AKVMTOCVEFMRRD-CYBMUJFWSA-N 338.278 5.023 30 20 EKED Oc1ccc(C=NN(Cc2ccccc2)c2ccccc2)cc1Cl 921253224 KVXLWAWGYIVYCD-UHFFFAOYSA-N 336.822 5.086 30 20 EKED CC(C)c1ccc(CSc2nnc(SCCCC#N)s2)cc1 72099059 LLIXTXREXYODDR-UHFFFAOYSA-N 349.550 5.350 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCSc3ccc(F)cc32)c1 179822742 XEXNYVOMUNQKCE-SFHVURJKSA-N 342.439 5.157 30 20 EKED C[C@@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(OCC#N)cc1 181265061 KBHZFVWFRMBMDP-VGSWGCGISA-N 334.463 5.171 30 20 EKED COc1ccccc1-c1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1 237344286 PLFCREOBIPSUIS-QGZVFWFLSA-N 342.442 5.085 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCC1(CC#N)CC1 430764446 RZSMDPQKGALUEA-LBPRGKRZSA-N 345.899 5.116 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(Cl)ccc(C)c1C 434476648 KONQKAILEPWLHW-UHFFFAOYSA-N 346.833 5.316 30 20 EKED C=CCC[C@H](NC(=O)N(C)[C@H]1CCc2ccccc21)c1ccccc1 435762003 RMBKGTUCWKWSPW-SFTDATJTSA-N 334.463 5.023 30 20 EKED CC[C@H](NCC1CCC(C#N)CC1)c1ccc2cc(OC)ccc2c1 442871088 VXJDHJZWHICPKK-XWTGJVNOSA-N 336.479 5.219 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C 466248882 VVUHRVQOWZLXQV-RYUDHWBXSA-N 326.267 5.041 30 20 EKED C=C(C)[C@@H](N[C@@H]1CCc2cc(F)c(OC)cc21)c1ccc(F)c(F)c1 467362377 OYVWYCRZAKTYHD-UYAOXDASSA-N 347.380 5.007 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1 474957072 XHCOTSAYFWPOLE-SFHVURJKSA-N 348.446 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(F)c(F)c1 475584251 RUXSZUYKYLNYLI-UHFFFAOYSA-N 344.405 5.138 30 20 EKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)C[C@H](CC#N)c1ccccc1 475908032 VNOBVJZGJIPKHT-REWPJTCUSA-N 348.490 5.238 30 20 EKED C[C@H]1CC(C)(C)N(C(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc21 479273482 DIZXJDQRIHFMTA-INIZCTEOSA-N 344.458 5.174 30 20 EKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCC2)c1nccc2ccccc12 483204102 SMNGWRGMPIFLCJ-QGZVFWFLSA-N 346.455 5.055 30 20 EKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCCC(C)(C)C#N)C1 483641255 JAOVBTAEMGZDSD-YOEHRIQHSA-N 338.417 5.418 30 20 EKED N#Cc1ccc(SCc2nc3ccccc3o2)cc1C(F)(F)F 542002918 KGIGXBCSNMPGDT-UHFFFAOYSA-N 334.322 5.011 30 20 EKED CN(Cc1ccccc1)c1ccccc1NCc1ccc(CC#N)cc1 543164905 CEPCHWINYUUKDG-UHFFFAOYSA-N 341.458 5.001 30 20 EKED C=CCOc1cccc(NC(=O)N(CCC)Cc2ccc(C)cc2)c1 619350922 YFXVUKFHKAFSCS-UHFFFAOYSA-N 338.451 5.004 30 20 EKED Cc1ccc(NC(=S)Nc2ccccc2SCCC#N)c(C)c1 730953044 LAAIZZNUVBHPRN-UHFFFAOYSA-N 341.505 5.118 30 20 EKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccccc1-c1cccs1 767811392 FXHFBIJJOKMYBY-QGZVFWFLSA-N 344.480 5.325 30 20 EKED C[C@@H](N[C@H](C)c1csc2ccccc12)c1ccc(OCC#N)cc1 776157088 PEXPVKQOLVHWAK-HUUCEWRRSA-N 336.460 5.215 30 20 EKED C[C@H](NCc1cccc(SC(F)(F)F)c1)c1cccc(C#N)c1 781339542 NUEPOLBYVNZSEE-LBPRGKRZSA-N 336.382 5.021 30 20 EKED CC(=NNc1ccccn1)c1ccc(-c2ccccc2Cl)s1 915110441 VGHFRGWURCZZTC-UHFFFAOYSA-N 327.840 5.300 30 20 EKED O=C(O)c1cccc(/C=C\C(=O)c2cccc3ccccc23)c1Cl 1776114663 WJRZLBRCZVQBRE-QXMHVHEDSA-N 336.774 5.088 30 20 EKED CC(C)Cc1cccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)c1 1776341485 SJRMCSBSNGKRSB-KTKRTIGZSA-N 342.822 5.133 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccc(F)cc1 1776785108 CVSLYIYJWPDOBM-LJQANCHMSA-N 337.479 5.414 30 20 EKED O=C(O)c1ccc2scc(/C=C\C(=O)c3csc(Cl)c3)c2c1 1777683933 DBIMZNQISSBYIY-IWQZZHSRSA-N 348.832 5.211 30 20 EKED Cc1cc(C)c(C#N)c(SCc2csc(-c3ccsc3)n2)n1 7371398 CABKOURDBBIUBS-UHFFFAOYSA-N 343.502 5.047 30 20 EKED Cc1ccsc1-c1nc(-c2cn(CCC#N)c3ccccc23)cs1 71872665 FUYMCQJOXLKPOP-UHFFFAOYSA-N 349.484 5.715 30 20 EKED CC(C)c1ccc([C@@H](Nc2ncccc2C#N)c2cccs2)cc1 302804357 JHFSMYAZIUAOOM-LJQANCHMSA-N 333.460 5.340 30 20 EKED Cc1cscc1NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 439396692 ZCTFQJSFTCAKGV-UHFFFAOYSA-N 349.415 5.365 30 20 EKED CC[C@@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 447509976 OBJJPSKMBZDGBZ-JOCHJYFZSA-N 326.443 5.389 30 20 EKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 466419650 OYMNJFFBHKBOHS-CYBMUJFWSA-N 330.815 5.068 30 20 EKED CC[C@@]1(C)CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 467908769 HTORDJBZLBKSJE-NRFANRHFSA-N 349.434 5.004 30 20 EKED N#Cc1cscc1C(=O)Nc1cc(-c2ccccc2)ccc1Cl 510122557 YNRNLBZJWGFCSB-UHFFFAOYSA-N 338.819 5.192 30 20 EKED N#CCCSc1ccccc1NC(=O)Nc1cccc2ccccc12 519417329 SLISJNMUTOGSRE-UHFFFAOYSA-N 347.443 5.490 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 536836661 BUYJIEZFOFYKJM-GUYCJALGSA-N 333.262 5.689 30 20 EKED C=CCC[C@H](NCc1cc(Cl)ccc1OC(F)F)c1ccco1 556869477 IDOBPELOTFXEPN-AWEZNQCLSA-N 341.785 5.332 30 20 EKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 614179885 QRUUHXVRZZCONM-IBGZPJMESA-N 326.871 5.382 30 20 EKED Cc1cc(C#N)ccc1CSCc1coc(-c2cccc(F)c2)n1 614394904 YEURAILXLHFATO-UHFFFAOYSA-N 338.407 5.094 30 20 EKED Cc1cc(C#N)ccc1CN[C@H](C)c1cc(F)c(Cl)cc1Cl 614407711 XJHQXWLYNRAGPW-LLVKDONJSA-N 337.225 5.163 30 20 EKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1nccc2ccccc12 682994581 JRNFWHCNUGZHBM-MRXNPFEDSA-N 346.386 5.079 30 20 EKED CCC(=NNc1ccc(C(F)(F)F)cn1)c1ccc(Cl)s1 733201466 UVLLITYNWGYFRX-UHFFFAOYSA-N 333.766 5.042 30 20 EKED Clc1ccc([C@H]2CCCC2=NNc2cnnc3ccccc23)cc1 741460615 OQMTZDBDCQWGQA-OAHLLOKOSA-N 336.826 5.019 30 20 EKED O=C(/C=C\c1cccc(OCc2ccccc2Cl)c1)c1cccnc1 747003666 LLNCXWMZOMXJGZ-KHPPLWFESA-N 349.817 5.210 30 20 EKED C#CC[C@@H](NC(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1 757770674 FMBJZQMNJTWVGO-OAQYLSRUSA-N 348.490 5.820 30 20 EKED C=CCC[C@@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 778597367 CUPNPOPKLULJMT-UXHICEINSA-N 340.426 5.161 30 20 EKED C/C(=C/C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1Cl 792108778 YZMZAHXPRFYKPJ-FFWXCITRSA-N 346.817 5.168 30 20 EKED CC[C@H](C)CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 796902984 HXFRKLQNEBTRNW-RYUDHWBXSA-N 348.418 5.091 30 20 EKED C=CC[C@H](OC(=O)c1ncoc1CC)c1ccc(Cl)c(Cl)c1 797553930 CSYOJYHITDRQQO-AWEZNQCLSA-N 340.206 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H]1CC1(Cl)Cl 834314918 SCTVGSJQIWJSKO-AWEZNQCLSA-N 340.294 5.451 30 20 EKED N#Cc1cccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 834693766 QSYQHRZZDHNXIR-QPJJXVBHSA-N 336.605 5.415 30 20 EKED FC(F)(F)c1ccccc1ON=C[C@@H]1CCC[C@@H](C(F)(F)F)C1 853324428 GDNYERZQITUJMW-GHMZBOCLSA-N 339.279 5.439 30 20 EKED CC(=NNc1ccccc1Cl)c1sc2nc(C)nc(C)c2c1C 863950895 UESLBWQQPMVEBV-UHFFFAOYSA-N 344.871 5.106 30 20 EKED Cc1ccc(C)c(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c1 1776133654 HMDGSDJXEWXMAB-FNORWQNLSA-N 336.412 5.112 30 20 EKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776339840 WDEQVACJGYMODV-MDZDMXLPSA-N 342.822 5.133 30 20 EKED CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 302979496 CRZUYWWQQMQHFP-IUODEOHRSA-N 346.883 5.466 30 20 EKED N#CC1(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)CCCCC1 302990662 JJNMGHDLJLADKH-UHFFFAOYSA-N 338.382 5.031 30 20 EKED O/C(CC/C(O)=N\C1CCCC1)=N\[C@@H]1CCCC[C@@H]1c1ccccc1 328796101 ULRVIIPFXHQUKB-RTBURBONSA-N 342.483 5.349 30 20 EKED O/C(CCc1cc2ccccc2o1)=N/[C@@H]1CCOC2(CCCCC2)C1 330202763 ZSKBHUDFQSIQEF-QGZVFWFLSA-N 341.451 5.204 30 20 EKED N#CCCC[C@H](N[C@@H]1CCCc2c(Cl)cccc21)c1ccccc1 340431026 BOCZPGWNIVJUQE-LEWJYISDSA-N 338.882 5.742 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430584430 OOLZZBMYLOUTOI-HNNXBMFYSA-N 326.465 5.054 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cccc(Cl)c1F)c1ccccc1 432628447 CESWVQQQDVOVPH-HNNXBMFYSA-N 345.805 5.036 30 20 EKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1ccc(Br)cc1 444587625 AHDSZQMRWGTUOE-QGZVFWFLSA-N 349.316 5.306 30 20 EKED Cc1c([C@@H](C)NC(=O)c2ccc(C(C)(C)C#N)cc2)oc2ccccc12 474948217 QJDPTVALYRCQCL-OAHLLOKOSA-N 346.430 5.033 30 20 EKED N#Cc1cccc(CN[C@H]2CCCc3c(Cl)sc(Cl)c32)c1 480795475 MQYSSSXTWIWIAS-ZDUSSCGKSA-N 337.275 5.094 30 20 EKED CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1SC[C@H](C)C#N 510869746 YEGKTRLHFGUKCQ-NVXWUHKLSA-N 344.524 5.483 30 20 EKED N#Cc1cc(Cl)ccc1NCc1nc2cc(Cl)ccc2s1 511393851 KCMUCFFZEAMTLF-UHFFFAOYSA-N 334.231 5.087 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1F)C(C)(C)C)c1ccc(C#N)cc1F 512641642 JBSAMKAVOINDBW-BLVKFPJESA-N 346.396 5.414 30 20 EKED N#Cc1ccc(/C=C/c2nc(-c3c(Cl)cccc3Cl)no2)cc1 517609313 DIUMBGRCMHLCEA-CMDGGOBGSA-N 342.185 5.085 30 20 EKED C[C@@H](N[C@@H]1CCCc2c1sc1ccccc21)c1ccc(C#N)cc1 532465293 WAKMIGZLPHEXCH-AUUYWEPGSA-N 332.472 5.501 30 20 EKED Cc1oc(-c2ccccc2)nc1CSCc1ccc(CC#N)cc1 543150633 ZZYVCQQMJWWGQE-UHFFFAOYSA-N 334.444 5.150 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C1CC1)C(F)(F)F 564125723 RYQNJJYIVJJABF-INIZCTEOSA-N 340.389 5.001 30 20 EKED N#CCCCCCC(=O)Nc1cc(-c2ccccc2)ccc1Cl 588760039 TWNSUQCJTBBGOK-UHFFFAOYSA-N 326.827 5.420 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)cc2cccnc12 606943707 PGAXHQPQDBOAFI-UHFFFAOYSA-N 331.847 5.098 30 20 EKED C[C@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1cccc(C#N)c1 610830270 JFQQAUCMVKXVKH-DLBZAZTESA-N 327.431 5.032 30 20 EKED Cc1cc(Cl)c(NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1Cl 611051283 FEXCTVFRSLTNGX-LLVKDONJSA-N 348.233 5.056 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(F)c(Cl)c1 728440877 XEPZZIUQOXJPQS-GQCTYLIASA-N 349.839 5.560 30 20 EKED Cc1ccccc1NC(=S)Nc1ccccc1SC[C@H](C)C#N 730954715 IMJVGOPRIFROJJ-CYBMUJFWSA-N 341.505 5.056 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccccc1F 731320669 LIFZGCNEQMHNDF-GFCCVEGCSA-N 345.468 5.029 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccccc2C(F)(F)F)s1 736433179 MXFORCPFDVGDRN-CMDGGOBGSA-N 339.382 5.356 30 20 EKED C#Cc1cccc(NC(=S)N(CC2CCC2)[C@@H](C)c2ccccc2)c1 740773837 YQPBCKALTLQTKR-KRWDZBQOSA-N 348.515 5.228 30 20 EKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744037707 CCYYXIFULJZTFA-UONOGXRCSA-N 347.409 5.214 30 20 EKED CC[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(Cl)c1O 841760474 FNKDLJLFUMLADJ-OALUTQOASA-N 340.854 5.036 30 20 EKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3F)o2)c(F)c1 917033581 JAYLEJYVEPNORC-YFHOEESVSA-N 340.325 5.130 30 20 EKED CCCCCCCC[C@@H](C)C(=O)N[C@H](CC(=O)O)c1ccc(C)cc1 1776786165 STLJDEXSKKJQAE-IEBWSBKVSA-N 347.499 5.014 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)s1 66800715 LCXPQVHULASUCB-SNVBAGLBSA-N 336.869 5.048 30 20 EKED N#CCC[C@@H](NCc1cc(Cl)cc2cccnc12)c1ccccc1 130576356 FDMPUXHFEPNHJD-LJQANCHMSA-N 335.838 5.023 30 20 EKED N#CCCC[C@@H](NCc1cnc(-c2ccccc2)s1)c1ccccc1 353917912 VYWGDNSLOTUVIE-HXUWFJFHSA-N 347.487 5.335 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)CC(F)(F)F 417036637 HKHBOFGCSWMANC-CYBMUJFWSA-N 342.405 5.249 30 20 EKED CC[C@@H](Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(C#N)cc1 447590940 BALWYBJLOBRVES-HXUWFJFHSA-N 331.419 5.393 30 20 EKED CCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](CC)c1ccccc1 461990352 XBVOYDWWBWGIJI-DYESRHJHSA-N 334.463 5.052 30 20 EKED C=C[C@@H](CC(=O)Nc1c(F)cccc1SCC)c1ccccc1 484931430 CURAFTONVXDWLX-AWEZNQCLSA-N 329.440 5.236 30 20 EKED CCN(Cc1cc(Cl)cc2cccnc12)[C@@H](C)c1ccc(C#N)cc1 497594480 ZGJJPUPHFAHFID-HNNXBMFYSA-N 349.865 5.343 30 20 EKED CC(C)(C#N)CCCN[C@H](c1cccc(F)c1)c1cccc(Cl)c1 531648604 UGZIJDBWCOUPES-IBGZPJMESA-N 344.861 5.488 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(-c2ncco2)c1C)c1ccccc1 552710495 WSZQEBUNFXOZML-IBGZPJMESA-N 346.430 5.339 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1Nc1c(F)cccc1F 588957295 SQZOIRLDCQGJEV-UHFFFAOYSA-N 343.377 5.121 30 20 EKED COc1cc(NC(=O)CC2(C#N)CCCCC2)c(C2CC2)cc1Cl 597828533 JMGSJNNJZMVMOP-UHFFFAOYSA-N 346.858 5.029 30 20 EKED C=CCOc1cccc(CNc2ccc(COC3CCCC3)cc2)c1 606913437 VIGLFZAFGVFTTD-UHFFFAOYSA-N 337.463 5.323 30 20 EKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 614178721 BSQRCUGYTYCUFV-CYBMUJFWSA-N 347.289 5.645 30 20 EKED Clc1ccc(-c2ccc(C=Nn3cnc4ccccc43)s2)cc1 725849298 ZHHWJYMEYKPONU-UHFFFAOYSA-N 337.835 5.300 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1sccc1C 733746755 ZNYCQSNBVMNOGA-UHFFFAOYSA-N 334.659 5.248 30 20 EKED CC(=NNc1ccc(Cl)nc1)c1cc(F)c(Cl)cc1Cl 743450484 RMPXKPHMEHLZST-UHFFFAOYSA-N 332.593 5.017 30 20 EKED COc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1OC1CCCC1 743465950 UBPGXFYLXFWOKQ-OAHLLOKOSA-N 336.435 5.061 30 20 EKED CCn1nc(C)c(C(=O)/C=C\c2ccccc2-c2ccccc2)c1C 750909275 KIHIJEHMQOLGJZ-PFONDFGASA-N 330.431 5.083 30 20 EKED C=CCC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 761528339 RBZDYTGCBCZKPX-KRWDZBQOSA-N 330.815 5.045 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2ccc(F)cc21 776192293 IRBCZQGPUGGUPD-KPKJPENVSA-N 341.432 5.223 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1cccc(-c2ccncc2)c1 782341413 JAFYPZMDZPRKAG-FNORWQNLSA-N 336.394 5.193 30 20 EKED C#CCCCCCC(=O)N(C(CC)CC)[C@@H]1CCCc2cccnc21 800958433 QJXMHJMBGWNPGO-HXUWFJFHSA-N 340.511 5.060 30 20 EKED N#C[C@H](C(=O)C1(C2CCC2)CCC1)c1nc2cc(Cl)ccc2s1 835074554 STHWGALCOOCJKU-CYBMUJFWSA-N 344.867 5.096 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H]1CC(C)(C)CO1 890166104 XWTSCKBNCSUXQW-KRWDZBQOSA-N 329.484 5.072 30 20 EKED O=C(c1occc1-c1ccccc1)N(O)Cc1cccc2ccccc12 900094511 NWOGJDKQUKSGSO-UHFFFAOYSA-N 343.382 5.131 30 20 EKED Fc1ccc(CNN=Cc2c(Cl)ccc(Cl)c2Cl)cc1F 915974789 LBVKTHVRMWZLIK-UHFFFAOYSA-N 349.595 5.049 30 20 EKED C=CCN(Cc1cccs1)C(=S)Nc1cccc(C(C)C)c1 917573265 ZGUKBKKJCWUWJL-UHFFFAOYSA-N 330.522 5.257 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2)o1 1776782725 CBSQQFGFYICUFV-SFHVURJKSA-N 343.467 5.240 30 20 EKED CSc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 25720659 IHJAMZKZDJJXCI-UHFFFAOYSA-N 344.439 5.199 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)s1 176957875 URPCKDBGYKKCBG-IBGZPJMESA-N 338.863 5.152 30 20 EKED CCC(CC)(NCc1ccc(C#N)o1)c1ccc(Cl)c(Cl)c1 236916751 NSZSHYRRYPYBTI-UHFFFAOYSA-N 337.250 5.263 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1Cl 247707862 GLGIMAAJVMEMFX-IBGZPJMESA-N 346.817 5.248 30 20 EKED CCCCC[C@H]1CC[C@H](C2CCC(c3ccc(C#N)cc3)CC2)CC1 263617472 NYIIMCUQDTTYJB-TYIZDMKQSA-N 337.551 7.219 30 20 EKED C[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1F 426288405 JEKMYPYXEVCQQW-BMIGLBTASA-N 334.847 5.140 30 20 EKED CN(C(=O)c1cc2sc3ccccc3c2s1)c1ccc(C#N)cc1 439946019 TUZJGQCWNNFINK-UHFFFAOYSA-N 348.452 5.264 30 20 EKED CC[C@@H](NCC1CCC(C#N)CC1)c1ccc2cc(OC)ccc2c1 442871086 VXJDHJZWHICPKK-CNXQINBVSA-N 336.479 5.219 30 20 EKED CC[C@@]1(C)CCCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 464595893 BFMPSNJTTGVTLD-QFIPXVFZSA-N 348.446 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)Cc1cccs1 475579599 WFXCMLVCYOILIP-HNNXBMFYSA-N 342.508 5.353 30 20 EKED C=C(C)[C@H](NC(=O)Nc1cccc(C)c1C)c1ccc(F)c(F)c1 479767595 JUEVJTXGYFNGDU-SFHVURJKSA-N 330.378 5.021 30 20 EKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CC(C)(C)C#N)c1ccccc1 486170527 WGHAQTHKRCHZJG-HNNXBMFYSA-N 340.854 5.374 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 539048643 RCXPHSFBJOQSTF-KSSFIOAISA-N 334.385 5.459 30 20 EKED CC(C)[C@H](NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 562042608 GHKOHGIZJVEJPR-INIZCTEOSA-N 326.406 5.322 30 20 EKED C=CCC[C@H](N[C@@H](C)c1ccc(Br)cn1)c1ccccc1 568702101 PWJYYPHPOBORKP-KSSFIOAISA-N 345.284 5.202 30 20 EKED CC(C)c1cccc(NC(=O)CS[C@H](C)c2ccc(C#N)cc2)c1 609825892 ZFIXPDVKGCZMPK-OAHLLOKOSA-N 338.476 5.115 30 20 EKED COc1ccc([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)c2ccccc12 618807879 XVVRJGNZEZQNLP-OYHNWAKOSA-N 342.442 5.058 30 20 EKED Cc1cccc(COc2ccc(C(=O)/C=C/c3c(C)noc3C)cc2)c1 727654581 NSHBTNKWRTUCKC-VAWYXSNFSA-N 347.414 5.075 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCC(C)(C)C)n2)cc1 729070609 SAFJHYGOGHVDJM-INIZCTEOSA-N 340.492 5.511 30 20 EKED CC#CCCCC(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 767664132 AIEZZDFJTMUZIZ-CQSZACIVSA-N 345.826 5.101 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Cl)c(F)c2)c1 772983419 HSXGFLQKXHTEAB-CZUORRHYSA-N 346.833 5.011 30 20 EKED C=CCN(C(=O)Nc1ccccc1Oc1cccc(F)c1)C(C)C 918544634 AVRMWCTWFWGYPH-UHFFFAOYSA-N 328.387 5.046 30 20 EKED CC(C)(C#N)c1ccccc1CN[C@@H]1CC2(CCC2)Oc2ccccc21 932217070 CJAJQDZSCNLFOV-HXUWFJFHSA-N 346.474 5.024 30 20 EKED Cc1c(NN=C2C[C@@H](C)C[C@H](c3ccccc3)C2)cccc1C(=O)O 1776087056 GHEJHJXBGGDOBO-YOEHRIQHSA-N 336.435 5.065 30 20 EKED C[C@H]1Cc2ccccc2C(=O)/C1=C/c1csc2ccc(C(=O)O)cc12 1776666066 WHEMUCBTMZVQEM-VAKHEIKFSA-N 348.423 5.058 30 20 EKED C[C@@H](Nc1ccc(NC(=O)c2sccc2C#N)cc1)c1ccccc1 52148221 RGRLJTLNXGIKNS-CQSZACIVSA-N 347.443 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1ccc(F)cc1 189869800 ALURPVRJBYRWFU-UHFFFAOYSA-N 341.426 5.085 30 20 EKED COc1cc(C(=O)/C=C\c2ccc(F)cc2)ccc1SC(F)F 214928163 OKXNGTCUKNWYNU-YWEYNIOJSA-N 338.350 5.045 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2s1 326027945 MTDCZPCKRDMWGF-OAHLLOKOSA-N 336.460 5.757 30 20 EKED Cc1cc2occ(C(=O)N[C@H](CCCC#N)c3ccccc3)c2cc1C 352180154 IWKWKNRZHNUUCP-HXUWFJFHSA-N 346.430 5.215 30 20 EKED CC(C)CN(C(=O)[C@@H](C)c1ccc(Cl)s1)c1ccc(C#N)cc1 426103676 WAVMXQURCAHJJX-ZDUSSCGKSA-N 346.883 5.066 30 20 EKED CCN(CC1CCC1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 431970880 RSXMLAPFDJRKMQ-UHFFFAOYSA-N 349.434 5.004 30 20 EKED Cc1ccccc1-c1noc([C@H](C)S[C@@H](C)c2cccc(C#N)c2)n1 443138590 FDPTZRCYTFNZCJ-GJZGRUSLSA-N 349.459 5.472 30 20 EKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CC(C)(C)C#N)c1ccccc1 486170528 WGHAQTHKRCHZJG-OAHLLOKOSA-N 340.854 5.374 30 20 EKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 494560157 GCTPHNYFJQBUIU-VKAVYKQESA-N 347.462 5.055 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@@H](C)C[C@H]1C 503221171 CACUNRQQVJUJPV-WCVJEAGWSA-N 345.512 5.027 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(SCC)c1 506864447 PKKFUVAJBUJNEJ-UHFFFAOYSA-N 344.455 5.158 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1 532206868 KZOFWNMQIYMRTK-UONOGXRCSA-N 328.843 5.022 30 20 EKED CCC(CC)[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccs1 538508417 LNEZUMMLKBKVSB-BFUOFWGJSA-N 330.472 5.587 30 20 EKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2o1 543862518 WUDHOEBWHMCFQM-SNVBAGLBSA-N 348.349 5.572 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1cccc(C#N)c1 599029157 CVSZYRANSPGEGF-VXGBXAGGSA-N 336.332 5.128 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cccc(Cl)c2Cl)cc1 605166555 ZWEQBSFJMMAAFD-ZDUSSCGKSA-N 336.262 5.409 30 20 EKED C=CCCCCCN(C)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 740454186 PJQGJNCQHOQMIH-UHFFFAOYSA-N 349.906 5.150 30 20 EKED C#CC[C@H](NC(=O)c1sc2ccccc2c1Cl)c1ccccc1 757596457 CPJRWSQIYHZTQP-HNNXBMFYSA-N 339.847 5.049 30 20 EKED Cc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cnc1Cl 760265991 RAFANOQRZYMSQJ-AATRIKPKSA-N 334.806 5.002 30 20 EKED CC[C@@H](NCc1cc(C#N)ccc1F)c1ccc(Cl)c(Cl)c1 773027442 QRUTYIOPXSRVQC-QGZVFWFLSA-N 337.225 5.245 30 20 EKED O=C(/C=C/c1ccc(F)nc1)c1ccc(Oc2ccccc2)c(F)c1 777468648 UYZIDXSZTPHTRV-RMKNXTFCSA-N 337.325 5.048 30 20 EKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1nccc2ccccc12 792103578 LJBAJVGSLPYUNN-MMTROXRISA-N 332.447 5.018 30 20 EKED C#Cc1cccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)c1 23010048 JFCQAPJMMLBQGU-UHFFFAOYSA-N 325.367 5.128 30 20 EKED C=CCN(Cc1cccs1)Cc1c(C)cc(C)c(C(C)=O)c1C 60942813 HKXVQRBBCXFRPR-UHFFFAOYSA-N 327.493 5.064 30 20 EKED CCCCCCCC(=O)N1CCC(Oc2cc(C)ccc2C)CC1 105411383 RDPQGBRUKGXTNU-UHFFFAOYSA-N 331.500 5.034 30 20 EKED C=CCn1c(S[C@H](CC)c2ccc(F)cc2)nnc1-c1ccco1 303840249 LYCCTXKOVVYQGM-MRXNPFEDSA-N 343.427 5.107 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1cccnc1 373715111 ZYBARVUNAKQGSO-HXUWFJFHSA-N 349.478 5.303 30 20 EKED C=CCCc1ccccc1NC(=O)CCc1c[nH]c2c(C)cccc12 410343302 BZJXQTDAWRJTLB-UHFFFAOYSA-N 332.447 5.166 30 20 EKED CC[C@H](c1ccc(F)cc1F)[S@@](=O)CCC1(C#N)CCCCC1 417153536 VJIMOEQHWKOLBK-HXOBKFHXSA-N 339.451 5.029 30 20 EKED C[C@@H](N[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 442875944 UQFKMCWUWAATOI-IAGOWNOFSA-N 342.442 5.343 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccccc2)C1 451337542 XREYXRNOALHHCI-LJQANCHMSA-N 348.490 5.004 30 20 EKED CCC(CC)c1cc(CNc2ccc(C#N)c(C(F)(F)F)c2)on1 462900309 AMKQUYPHWFTFFC-UHFFFAOYSA-N 337.345 5.081 30 20 EKED Cc1ccc(-c2nnc([C@@H](C)Sc3ccc(C#N)cc3)o2)cc1C 468632032 UWTOZRXAJJNODV-CQSZACIVSA-N 335.432 5.078 30 20 EKED CCN(C(=O)[C@H](C)CC1CCCCC1)[C@@H](C)c1ccc(C#N)cc1 510303933 AXHHCHRIUZDCNF-SJORKVTESA-N 326.484 5.074 30 20 EKED CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 525412325 SPQCBCJWZKGKFG-ARFHVFGLSA-N 345.512 5.029 30 20 EKED Cc1c([C@@H](NCc2cccc(C#N)c2F)C(C)C)oc2ccccc12 537059692 TWCQMGKQYMXEKE-FQEVSTJZSA-N 336.410 5.239 30 20 EKED CCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](CC)c1ccccc1 538537687 RUCVJCILWOEGCE-OAQYLSRUSA-N 346.474 5.245 30 20 EKED C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)c1cccc(C#N)c1 539495389 OKSSTNQLSLACPO-MBSDFSHPSA-N 326.443 5.193 30 20 EKED N#CCc1ccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 545365751 HGUHNUMRJJNZLH-UHFFFAOYSA-N 349.415 5.001 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 553398214 PPTJOSPZVLJVJD-AOMKIAJQSA-N 346.861 5.652 30 20 EKED COc1cccc2cc([C@@H](C)N[C@@H]3CCCc4cc(C#N)ccc43)oc12 561140590 OCOLMWZHUMXCDZ-AUUYWEPGSA-N 346.430 5.041 30 20 EKED C[C@@H](Nc1ccc(COc2ccccc2)cc1)c1cccc(C#N)c1 600850391 JOHIIUMCNSFQGX-QGZVFWFLSA-N 328.415 5.310 30 20 EKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(O)c(C)c3)s2)cc1 734304393 IIGSNDPJSOILPW-CSKARUKUSA-N 335.428 5.029 30 20 EKED CC(C)CC(C)(C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 753400418 NESWGBANNHGYLK-LBPRGKRZSA-N 334.872 5.198 30 20 EKED CCCC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 760008046 NJHDRHYHQMTQFK-FQEVSTJZSA-N 347.462 5.044 30 20 EKED CC(/C=C\C(=O)c1ccc(C#N)cc1)=C/c1ccccc1OC(F)F 811685068 ILWHNAYCPIVZES-ZKCBKFBFSA-N 339.341 5.002 30 20 EKED Cc1cccc2c(C(=O)/C=C\c3ccc4oc(C(=O)O)cc4c3)coc12 1777448781 DQZSNFMPUBAQNR-ALCCZGGFSA-N 346.338 5.082 30 20 EKED FC(F)(F)c1ccc(NN=C2CCC(c3ccccc3)CC2)nc1 7008908 FMLXJFDFCBUYSK-UHFFFAOYSA-N 333.357 5.226 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(C)c1 65680140 XMCRMIKHQCVWHE-UHFFFAOYSA-N 342.398 5.220 30 20 EKED O=C(/C=C\c1cccnc1)c1ccc(-c2ccc(Cl)cc2)s1 96861735 VQNWBJKUMLJKES-BAQGIRSFSA-N 325.820 5.360 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1 153724340 CBGZXKLROXHIIX-LSDHHAIUSA-N 347.487 5.402 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C2(C#N)CC2)cc1 182249890 DZDTXVBWCXIYPJ-UHFFFAOYSA-N 346.474 5.741 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1nc2ccccc2o1)c1ccc(F)c(F)c1 187774040 QJCUWXKRLJSIPV-SGTLLEGYSA-N 328.362 5.074 30 20 EKED C=CCOc1ccc(CN[C@@H](C)c2cccc3ccccc23)cc1OC 302220299 FKWHRLRFVNFJMG-KRWDZBQOSA-N 347.458 5.264 30 20 EKED Cc1nc2ccc(N=C(O)c3scnc3C3CCCC3)cc2s1 329787583 RFUQWYLQNJOPAP-UHFFFAOYSA-N 343.477 5.355 30 20 EKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)c1cccc2ccccc12 475384695 ZQNOSJUSZGITPW-HXUWFJFHSA-N 342.442 5.280 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 477499969 OKBZIHMMWQWSLI-MRXNPFEDSA-N 340.492 5.580 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cnc2ccsc2c1)c1ccc(F)c(F)c1 480678150 SHZIDDSVKSEWPO-HXPMCKFVSA-N 344.430 5.543 30 20 EKED CC(C)c1occc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 483349056 WXSKFMOLJGWUNB-UHFFFAOYSA-N 342.464 5.247 30 20 EKED C=CCN(Cc1ncc(-c2cccc(Cl)c2)o1)Cc1cccs1 501466531 JWMPKEXBPMSPKL-UHFFFAOYSA-N 344.867 5.245 30 20 EKED Cc1ccccc1[C@@H](C)CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 522534318 CANWAMKVWDEFBV-IBGZPJMESA-N 348.490 5.045 30 20 EKED CC(C)C[C@H](NCCCSCC#N)c1cccc(C(F)(F)F)c1 538159058 AQLKEVQFPKAFIP-INIZCTEOSA-N 344.446 5.029 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 538394661 JONPKPBHCXSPFF-JLTOFOAXSA-N 336.435 5.199 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)o1 538413788 RJABIHRAVQIJRI-LJQANCHMSA-N 328.843 5.216 30 20 EKED C[C@@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cccc(C#N)c1 538642509 YUZAEDMJJDECHN-CQSZACIVSA-N 329.403 5.264 30 20 EKED C=CCC[C@H](NCc1nc(-c2ccsc2)oc1C)c1ccccc1 539359323 QXRZURUOGWHKAM-SFHVURJKSA-N 338.476 5.509 30 20 EKED CC(C)(CCC#N)CN[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 554363447 MEJSIUZPERGFNW-LJQANCHMSA-N 344.861 5.488 30 20 EKED Cc1cc(OCCC[C@@H](C)NCC(C)(C)CCC#N)ccc1Cl 554367460 XOXKDXIWUSNTHS-MRXNPFEDSA-N 336.907 5.116 30 20 EKED CC1(C)C[C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccc21 589508445 MALFZDHWFXIQJT-GOSISDBHSA-N 344.380 5.089 30 20 EKED Cc1cc(NC(=O)N2CCC(CCC#N)CC2)ccc1-c1ccccc1 592246935 JBDJQNHBTJBCOZ-UHFFFAOYSA-N 347.462 5.210 30 20 EKED CCCc1sc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1CC 613290791 LKTVPXVPYDXTGA-INIZCTEOSA-N 348.471 5.301 30 20 EKED CCSc1ccccc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619754476 AIJHHQFJUYJSKD-ZDUSSCGKSA-N 330.884 5.174 30 20 EKED C=CCC[C@@H](NCc1ccnc(Oc2ccccc2)c1)c1ccco1 671740484 DYZOXOWLBLNHFJ-LJQANCHMSA-N 334.419 5.264 30 20 EKED C#Cc1cccc(NC(=S)Nc2cccc(Nc3ccccc3)c2)c1 726442681 DIORZAVXPVAAKL-UHFFFAOYSA-N 343.455 5.220 30 20 EKED C/C(=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 731332019 ASTMPXIQKHJCBQ-FCFCDCELSA-N 336.460 5.123 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1 735793277 RRNJGBDSJWDEJP-HOCLYGCPSA-N 325.456 5.044 30 20 EKED CC(=NNc1nc2ccccc2s1)c1ccc(-c2ccncc2)cc1 745193517 WUAPLRUBQHOPOD-UHFFFAOYSA-N 344.443 5.194 30 20 EKED CSc1ccc(NCc2ccc(N(C)CCC#N)cc2)cc1Cl 770559828 QAUWTMBWDFSNGT-UHFFFAOYSA-N 345.899 5.024 30 20 EKED C[C@@H](CC(C)(C)C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 773981705 CITGJAQCOLPONZ-ZFWWWQNUSA-N 326.465 5.059 30 20 EKED CC(C)c1ccc(NC(=S)N(C)[C@H](C)c2cccc(C#N)c2)cc1 819028727 PCDRGYLSSBMSPM-OAHLLOKOSA-N 337.492 5.071 30 20 EKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCCCC1 915353317 SKULLGVMUBUGRX-OAQYLSRUSA-N 347.462 5.138 30 20 EKED CC(=NNc1nccc2sccc12)c1ccc(C(F)(F)F)cc1 915980517 YPXOOTIGFSQNFL-UHFFFAOYSA-N 335.354 5.151 30 20 EKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1c[nH]c2ccccc12 921269944 PWISJDOCGZBMQM-YFHOEESVSA-N 345.320 5.005 30 20 EKED C[C@H](Nc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1 173961486 XYOGCBBGKXWQAL-INIZCTEOSA-N 332.403 5.041 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCc1cccs1 301753078 ZGVMIQWSSCYNAT-UHFFFAOYSA-N 339.913 5.001 30 20 EKED COc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)c(Cl)c1 424302405 MCSRTAALNBOIEO-LIRRHRJNSA-N 328.843 5.044 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1F 435883907 NBVPRTYTOCLQGO-GFCCVEGCSA-N 334.847 5.485 30 20 EKED CC(C)[C@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 460341492 BSRHMRXIGYNHNG-HNNXBMFYSA-N 340.854 5.037 30 20 EKED Cc1ccc(SCC(F)(F)F)c(N[C@H]2CCC[C@H](C#N)C2)c1 463290271 RKOBYBMMFNEGMH-STQMWFEESA-N 328.403 5.144 30 20 EKED Cc1cncc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 467636212 PCJYZEYTEGOKCG-ROUUACIJSA-N 341.458 5.341 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(Cl)ccc1F 468819609 CSRZPARWTBRKNM-LBPRGKRZSA-N 334.847 5.485 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCCOc1ccccc1Cl 487398966 WZHGTULAPLKQTO-AWEZNQCLSA-N 346.883 5.083 30 20 EKED N#CC1(CCCSCc2ccc3ccccc3c2)CCOCC1 507521052 VHSAPLGXOMTWLZ-UHFFFAOYSA-N 325.477 5.174 30 20 EKED C=C[C@@H](CC(=O)N1CC(C)(C)[C@H]1c1cccs1)c1ccccc1 564003805 NSDJLDQRFWKUOO-HNAYVOBHSA-N 325.477 5.018 30 20 EKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)CCCCCC#N)c2)C1 588154672 AYPAJJLVTRINDY-YLJYHZDGSA-N 342.483 5.194 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc2ccncc2s1 595025662 JIJOGBNBHCTETI-AWEZNQCLSA-N 337.448 5.152 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(OC2CCCC2)cc1 611394069 CPGFHAAKOWLPBJ-QHCPKHFHSA-N 346.474 5.047 30 20 EKED C[C@H](Nc1nc(C(C)(C)C)ccc1C#N)c1ncc(-c2ccccc2)o1 613425802 LKQQJECUYACJTK-AWEZNQCLSA-N 346.434 5.079 30 20 EKED C#Cc1cccc(NC(=S)N[C@H](c2cccs2)C(CC)CC)c1 726480287 HWUQGNZHZMQGJM-SFHVURJKSA-N 342.533 5.193 30 20 EKED N#Cc1c(F)cccc1N1CCC[C@@H]1c1ccccc1C(F)(F)F 728053019 ZKWBGIZKTWAMLI-MRXNPFEDSA-N 334.316 5.058 30 20 EKED Cc1cccc(-c2n[nH]cc2/C=C/C(=O)c2cc3ccccc3o2)c1 728785566 LBAKARIYOGSHQB-MDZDMXLPSA-N 328.371 5.027 30 20 EKED CC(/C=C/C(=O)c1ccc(-c2ccncc2)cc1)=C\c1ccccc1 745990259 PSXCROZZIQNTEF-OSCRGHHXSA-N 325.411 5.591 30 20 EKED Clc1ccc(-c2ccc(C=NOCc3cccnc3)o2)cc1Cl 746587488 DDNFAYWXJZEKAZ-UHFFFAOYSA-N 347.201 5.199 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccsc1 749104406 JZURNSJXWLVQIM-FNORWQNLSA-N 341.413 5.281 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cc(F)cc(F)c1 755707133 XLBOJJGIPSFDOT-ARJAWSKDSA-N 333.384 5.046 30 20 EKED C=CCCC[C@@H](C)NC(=O)c1ccc(C2SCCCS2)cc1 775924708 CMJXDJGDNBOOQL-CQSZACIVSA-N 335.538 5.030 30 20 EKED FCCC[C@@H]1CCCC1=NNc1ncc(C(F)(F)F)cc1Cl 800805015 HVCGQHCIRNWQDC-VIFPVBQESA-N 337.748 5.072 30 20 EKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1O 815636620 XZAGJJNQYDNDCS-RBUKOAKNSA-N 342.870 5.521 30 20 EKED FC(F)(F)c1ccc(CNN=Cc2cccc(Cl)c2Cl)cc1 915972814 VSVYHFYBYMZWLM-UHFFFAOYSA-N 347.167 5.136 30 20 EKED N#Cc1cccc(NC(=S)Nc2ccccc2Oc2ccccc2)c1 917570201 MRPGWBFAJMSRMK-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Cl)cc1Cl 1776784071 IZOUOLOKPXBLQA-HNNXBMFYSA-N 346.298 5.287 30 20 EKED COc1cc2c(cc1NCc1ccccc1C#N)oc1ccccc12 11619483 DERWSKFHUKQUJB-UHFFFAOYSA-N 328.371 5.078 30 20 EKED Cc1cscc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 120785837 QFCKNNRZTUHPNR-LBPRGKRZSA-N 331.466 5.095 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccc2nc1C 189898990 ZEFQFCSELKYXPV-UHFFFAOYSA-N 344.458 5.647 30 20 EKED Cc1cn2c(/C=C\C(=O)c3ccc4ccccc4c3)c(C)nc2s1 206381621 DUKAXSJMAUBNLK-KTKRTIGZSA-N 332.428 5.062 30 20 EKED COc1ccc2cc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)ccc2c1 327312112 VRSSVNCPFMYRTR-HZPDHXFCSA-N 330.431 5.132 30 20 EKED CC(C)Sc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 433027839 NAJPSBWPBZXLHK-NRFANRHFSA-N 338.520 5.712 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 437657772 MOCJPBSVFRYHLB-RTWAWAEBSA-N 347.462 5.114 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C)(CC)CC1 475572758 ZDIYUKMKFBUIKP-UHFFFAOYSA-N 328.500 5.583 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)c1ccccc1 476089201 IPECDWDWYULSBZ-UHFFFAOYSA-N 335.491 5.845 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@]1(CCC)C(F)(F)F)c1ccccc1 499521600 SBGKBGOVVZFFCD-YJBOKZPZSA-N 339.401 5.070 30 20 EKED N#Cc1ccc(CSCCCCC(F)(F)F)c(OC(F)F)c1 507638453 WWRGOTHELIWHJT-UHFFFAOYSA-N 339.329 5.125 30 20 EKED CCCC(C)(C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 522622642 CTIPUSZLBJHMBZ-UHFFFAOYSA-N 337.423 5.051 30 20 EKED Cc1ccc([C@H](NCc2ccc(C#N)s2)c2ccccc2)c(C)c1 561437629 MMFGVTRHPRHOKS-OAQYLSRUSA-N 332.472 5.116 30 20 EKED N#CCCCCCC(=O)NC1(c2ccc(Cl)cc2)CCCCC1 588905795 KSAOILIWVAQXLV-UHFFFAOYSA-N 332.875 5.090 30 20 EKED O=C(CCCC(F)(F)F)Nc1ccc(C(F)(F)C(F)(F)F)cc1 678359382 LPVQJSAPOQXOJC-UHFFFAOYSA-N 349.221 5.012 30 20 EKED Cc1nc(/C=C\c2cccs2)sc1C(=O)/C=C\c1cccs1 726847480 BARTVXASIDYNPL-VRHVFUOLSA-N 343.498 5.641 30 20 EKED COc1cc(C)c(C(C)=NNc2cccc3ccccc23)cc1OC 731313736 ILXMHWLZQRLJFO-UHFFFAOYSA-N 334.419 5.002 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1cccc(-c2ccncc2)c1 741467876 AVZLTOSTRLRYAH-GQCTYLIASA-N 325.820 5.360 30 20 EKED CCCC(CCC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 753541309 JYFNLQYJMPFYER-CYBMUJFWSA-N 334.872 5.342 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)s1 758428123 AAYISSOMGIZZTA-BQYQJAHWSA-N 325.355 5.181 30 20 EKED CC(C)[C@@H]1/C(=C\c2cnc(-c3ccccn3)s2)C(=O)c2ccccc21 766501468 GPUPDSQIHBAGID-OXRZLYTFSA-N 346.455 5.225 30 20 EKED CC(=NNc1nc(-c2ccccc2)cs1)c1csc(C(C)C)n1 768773718 OSKCGKBLRWKMQZ-UHFFFAOYSA-N 342.493 5.226 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCc1ccsc1 783470721 VTIOKUVRZXIHOT-AWEZNQCLSA-N 344.505 5.104 30 20 EKED CC[C@@H](C(=O)OCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 784067452 YXMSFEVNIJSCJB-OAHLLOKOSA-N 341.373 5.072 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(OC)cc1 789719382 ORUAYUPOCCYCOO-NTCAYCPXSA-N 335.447 5.199 30 20 EKED C=CCC[C@@H](Nc1ccc(OCC2CCOCC2)cc1)c1ccco1 796879485 KMNYVUWYBCGQMX-HXUWFJFHSA-N 341.451 5.204 30 20 EKED C[C@@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2c(O)ccc(F)c21 815636489 WDHXYACIYDWCIZ-JLSDUUJJSA-N 338.426 5.104 30 20 EKED CCCOc1ccc(NCCCC2(C#N)CCOCC2)cc1C(C)C 902130710 MUJFIOFFMGHFHQ-UHFFFAOYSA-N 344.499 5.111 30 20 EKED CCCCCCCCC(=O)N(c1ccccc1)c1nc(C)cs1 918552205 XHWBFPHVCHDPNC-UHFFFAOYSA-N 330.497 5.867 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(COC(C)(C)CC)c1C 78795708 QUEOODTTZCVQHP-UHFFFAOYSA-N 332.488 5.130 30 20 EKED CCCC[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 289628313 PFGAQNOTHSDJGE-HUUCEWRRSA-N 333.501 5.123 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 352173674 DVGUFHGATGTAAQ-KRWDZBQOSA-N 347.245 5.158 30 20 EKED CC[C@@H](NCc1ccc(C#N)s1)c1ccc(Cl)c(Cl)c1 421867399 BYSOXZBKAFGUFY-OAHLLOKOSA-N 325.264 5.167 30 20 EKED N#CCCC[C@@H](NC(=O)NCCC1=CCCCCC1)c1ccccc1 431470558 KGFZQVYJQARRCR-HXUWFJFHSA-N 339.483 5.001 30 20 EKED CCc1cccc(C)c1NC(=O)c1cn(CCCC#N)c2ccccc12 443980019 LUNHSIOPVQQGKT-UHFFFAOYSA-N 345.446 5.068 30 20 EKED N#CCC[C@H](NCc1cc(Cl)sc1Cl)c1ccccc1 449205561 NROSJWZGZPGYSU-ZDUSSCGKSA-N 325.264 5.190 30 20 EKED CC(C)N(CCCC(C)(C)C#N)Cc1cccc(C(F)(F)F)c1 472431182 LXTQHLJBICRBQZ-UHFFFAOYSA-N 326.406 5.246 30 20 EKED C[C@H](F)CCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510765668 OIBDSHHNIMVRJN-CABZTGNLSA-N 331.275 5.037 30 20 EKED C[C@H](SCc1ncc(-c2ccc(F)cc2)o1)c1cccc(C#N)c1 527197235 HIESTFHCGSOIGU-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED N#CCCC[C@@H](NC/C=C\c1ccc(F)c(F)c1)c1ccccc1 560561527 JJRPXPWXZKICMX-PXDRNWIDSA-N 326.390 5.003 30 20 EKED C=CCOc1ccc(CN[C@H](CC)c2ccc(Cl)cc2)cc1OC 642339602 JCAQCLWUJQZUMW-GOSISDBHSA-N 345.870 5.154 30 20 EKED C=CCC[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)C1CC1 676637743 QTRMZQNRMMLEQI-OBJOEFQTSA-N 343.355 5.230 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(C)cc1 739144469 ZHFHCMRWMMQAPV-DOTOQJQBSA-N 348.471 5.365 30 20 EKED CCC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 745948054 UPIKWIJVWLSDGY-AWEZNQCLSA-N 346.883 5.466 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc(Cl)s1 751511918 DKCDPHCQVBFQRB-ONEGZZNKSA-N 337.878 5.483 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)cn1 753718313 WRINJIHETSKTDC-ZZXKWVIFSA-N 342.748 5.032 30 20 EKED O=C(/C=C/c1cnc(C2CCC2)s1)c1cccc(Br)c1 760264692 NJXXNPLDYUMZKQ-BQYQJAHWSA-N 348.265 5.069 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1csc2ccccc12 776157067 PEXPVKQOLVHWAK-CABCVRRESA-N 336.460 5.215 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc2ccccc2c1 794995145 LVZKFAQADXDDJN-UHFFFAOYSA-N 346.499 5.615 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(C)oc2ccc(OC)cc12 800153877 DLFLYXIQZLYGNA-UHFFFAOYSA-N 335.403 5.121 30 20 EKED O=C(/C=C/c1sccc1Br)c1c(F)cccc1Cl 809158925 FSOVGBHTJPWNDY-SNAWJCMRSA-N 345.620 5.199 30 20 EKED CC(=NNc1ccccc1)c1sc(-c2ccc(F)cc2)nc1C 814684431 TZWQTMQGIIRCEX-UHFFFAOYSA-N 325.412 5.094 30 20 EKED CCCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 845456223 VKMYCTCKMJUMBQ-LLVKDONJSA-N 348.418 5.091 30 20 EKED C[C@@H](NN=Cc1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 920381884 BERYREHSQNHCMG-CQSZACIVSA-N 347.443 5.241 30 20 EKED COc1cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)ccc1SC 90665790 ZLFGUKZXGVYQKY-QAPCUYQASA-N 340.492 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCO[C@H](CCC)C1 189879583 PZZVRCZRIYOJSI-QZTJIDSGSA-N 329.484 5.072 30 20 EKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1 286924853 HLMXBVXZSAUNKZ-OXQOHEQNSA-N 347.462 5.103 30 20 EKED CC[C@H](C)c1ccc([C@H](Nc2ccc(C#N)nn2)c2cccs2)cc1 301931044 OORPVSAIARSOKE-XOBRGWDASA-N 348.475 5.125 30 20 EKED OC(=Nc1cccc2ccccc12)C1CCC(/N=C(/O)C2CC2)CC1 329952906 JBQUTNRCIFTWEI-UHFFFAOYSA-N 336.435 5.353 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(C)cccc1SC 468008752 DJWRAMJGDLHHRC-UHFFFAOYSA-N 340.492 5.327 30 20 EKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Cl)s1 475039443 OYSKGMAMWTVESQ-UHFFFAOYSA-N 341.823 5.073 30 20 EKED C=C[C@@H](CC(=O)N(CCC)[C@H]1CCCc2cccnc21)c1ccccc1 475953220 HPDUMYQRQXUZLJ-RXVVDRJESA-N 348.490 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(CCCC)c1C 476076299 AYIQBIUJJYLHAN-UHFFFAOYSA-N 339.483 5.096 30 20 EKED Cc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cccc1C(F)(F)F 476357913 XVACOBFZGMCZHB-HNNXBMFYSA-N 346.352 5.040 30 20 EKED CCOc1cccc([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481927507 YDCFBTUKLHJXNT-OPAMFIHVSA-N 334.463 5.075 30 20 EKED Cc1cccc2cc(C(=O)N[C@H](CCCC#N)c3ccccc3)sc12 487487964 UFZQHXFZWKVQHF-GOSISDBHSA-N 348.471 5.375 30 20 EKED Cc1nc(C)c(C#N)c(S[C@@H](Cc2ccccc2)c2ccccc2)n1 496521727 XVPJZLNCUZZCSK-FQEVSTJZSA-N 345.471 5.041 30 20 EKED C=CCCc1ccccc1NC(=O)Nc1cnn(CCC(C)C)c1C 505046691 XMMLOOJWWHGLKQ-UHFFFAOYSA-N 340.471 5.000 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(C#N)c(Cl)c1 521191545 WFKDXVGKYHDQCK-SFHVURJKSA-N 341.842 5.217 30 20 EKED CCc1c([C@H](C)N[C@@H](CCC#N)c2ccccc2)oc2ccccc12 539506986 IRFSLSLUAODJSL-JXFKEZNVSA-N 332.447 5.691 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc(F)c(Cl)cc1Cl 556608260 KJNQZZZQJSQIIH-LLVKDONJSA-N 349.236 5.344 30 20 EKED C[C@H](Nc1ccccc1NC(=O)c1cc(C#N)cs1)c1ccccc1 559252263 XMRWYQCBASICRJ-AWEZNQCLSA-N 347.443 5.045 30 20 EKED COc1cccc2cc([C@H](C)N[C@H]3CCCc4cc(C#N)ccc43)oc12 561140597 OCOLMWZHUMXCDZ-LIRRHRJNSA-N 346.430 5.041 30 20 EKED CC[C@@](C)(C#N)C(=O)N[C@@H](C)c1ccc(-c2ccc(Cl)cc2)s1 567376046 UCSNQFRIWHCJGL-SGTLLEGYSA-N 346.883 5.186 30 20 EKED COc1cccc(CNc2ccccc2SC[C@@H](C)C#N)c1Cl 594704750 GCUITYAJSDLZJR-ZDUSSCGKSA-N 346.883 5.212 30 20 EKED C=CCCCCCN(C)C(=O)c1csc(-c2ccc(C)cc2C)n1 606814458 KVKNAMDHHBCRKL-UHFFFAOYSA-N 342.508 5.245 30 20 EKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)C1(C)C 609428699 UXZITXCLZGWVFN-IIDMSEBBSA-N 342.508 5.258 30 20 EKED N#Cc1cc(Cl)ccc1SCc1coc(-c2ccccc2)n1 610655217 VHOCUAWAPJAFJN-UHFFFAOYSA-N 326.808 5.159 30 20 EKED C=C[C@H](CC(=O)N[C@H]1C[C@H](c2ccccc2Cl)C1)c1ccccc1 647544300 LUJWIOGBBHFYNH-KBAYOESNSA-N 339.866 5.062 30 20 EKED C=CCn1c(S[C@H](C)c2ccccc2Cl)nnc1-c1ccco1 670477200 TYWKTPYETUIARL-GFCCVEGCSA-N 345.855 5.231 30 20 EKED FC(F)Oc1ccc(NN=Cc2ccc(Cl)cc2Cl)cc1 726429683 PUFTZRKOYBBGPI-UHFFFAOYSA-N 331.149 5.041 30 20 EKED CCCCCCCCCNC(=O)N(C)[C@@H](C)c1sc(C)nc1C 730113406 QVRRGSOLNBNMEK-HNNXBMFYSA-N 339.549 5.213 30 20 EKED N#Cc1ccccc1COc1cccc(/C=C\C(=O)c2ccccc2)c1 731317764 BPIOLDQEFVWEDC-YPKPFQOOSA-N 339.394 5.033 30 20 EKED CC[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 734078919 FIOQAKOAIKASFP-JKSUJKDBSA-N 340.492 5.469 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cc2cc(Cl)ccc2o1 740765424 ZEUDCWCNDNALTP-SREVYHEPSA-N 333.774 5.531 30 20 EKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(C#N)cc2)cc1 741460409 PKQMAYRXADRSNB-UHFFFAOYSA-N 341.414 5.070 30 20 EKED O=C(/C=C\c1ccsc1)c1ccc(SCC(F)(F)F)cc1 741843775 PZLIZLAKAJGZJQ-BHQIHCQQSA-N 328.380 5.299 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 744115393 JRTYRDHIWBRRAE-TZMCWYRMSA-N 332.444 5.218 30 20 EKED CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@H](C)C#N 780147414 GYVUPBGFOAWLPO-SJLPKXTDSA-N 342.483 5.159 30 20 EKED CC(C)Sc1cccc(Cl)c1C=NNc1cccc(C#N)c1 786039578 UROAZPWZHKTUHJ-UHFFFAOYSA-N 329.856 5.158 30 20 EKED CC[C@@](C)(NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 838354870 CNBHBXFRNNNXIU-RBBKRZOGSA-N 349.478 5.046 30 20 EKED CC(C)(C)c1csc(-c2cccc(OC(=O)CCCCC#N)c2)n1 846889159 ZCHVLPNFEXRRFQ-UHFFFAOYSA-N 342.464 5.097 30 20 EKED CCc1cc(C#N)c(NC(=O)c2ccc3c(c2)-c2ccccc2C3)s1 917878223 MTLMHDYUDGXRFY-UHFFFAOYSA-N 344.439 5.006 30 20 EKED C=CCCCCCCCCNc1ncnc2sc(C(=O)O)c(C)c12 1776208045 ZZIXAPRECZKIFP-UHFFFAOYSA-N 347.484 5.027 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccsc3)cc2)cc1 1777671202 SHIJUCDSQKMXRD-KMKOMSMNSA-N 334.396 5.009 30 20 EKED CCCCCCCCCCCOC(=O)CCCCCBr 140811091 PSMKUXWNSBWYBS-UHFFFAOYSA-N 349.353 6.016 30 20 EKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1Cl 177760747 WOPFCWUEKMUGGB-CEFACKQISA-N 344.867 5.200 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1O 186150831 CUQGPFFAXWMUHG-IERDGZPVSA-N 330.431 5.241 30 20 EKED CC(C)c1nc2ccc(NCc3ccc(C#N)cc3F)cc2s1 195712494 JSKBPPIHTASWQL-UHFFFAOYSA-N 325.412 5.043 30 20 EKED CCCCCCCC(=O)Nc1ccccc1NC(=O)C[C@H]1C=CCC1 303282425 IZDJZDCWZXDDMI-KRWDZBQOSA-N 342.483 5.280 30 20 EKED CC(O)=Nc1ccc(F)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 328984024 FYAJGHRRWUKLLC-FVQBIDKESA-N 332.419 5.628 30 20 EKED Cc1c(-c2nc([C@H]3CCC(F)(F)C3)no2)sc2ccc(C#N)cc12 426602702 ITNUGJVGERUKQJ-NSHDSACASA-N 345.374 5.034 30 20 EKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(C#N)c1 442775267 FMTDFPYGMGWPTJ-INIZCTEOSA-N 339.398 5.395 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N[C@H]2CCC[C@H](C#N)C2)cc1 447525977 AJOKCUYDCVBXDY-ZWOKBUDYSA-N 334.463 5.095 30 20 EKED Cc1cc(C)cc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 503224834 HNSZFZOBGOTMBL-OAHLLOKOSA-N 339.464 5.199 30 20 EKED CCC(CC)N(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CC1 523150965 IGQPNQFZNMYVEV-UHFFFAOYSA-N 347.462 5.095 30 20 EKED C=CCN(C(=O)c1ccccc1CCC(F)(F)F)c1ccccc1 535471904 COTQRBSIHSCDNM-UHFFFAOYSA-N 333.353 5.014 30 20 EKED C[C@H](Nc1ccc(CN2CCCC[C@@H]2C)cc1)c1cccc(C#N)c1 538500313 WTYJXIOPNJSMIC-ROUUACIJSA-N 333.479 5.106 30 20 EKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1ccc(C2(C#N)CC2)cc1 538522672 IMGVAGWPYYVOGC-OAQYLSRUSA-N 346.474 5.020 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCc4c(Cl)cc(Cl)cc43)CC2)c1 551812499 FNADYZXTUZNVSA-SFHVURJKSA-N 343.257 5.131 30 20 EKED CCc1c(C)sc(NC(=O)c2cc3sccc3s2)c1C#N 560001473 BZEGWEVDEWBZIG-UHFFFAOYSA-N 332.475 5.019 30 20 EKED N#CCCCOc1cccc(CN2CC3(CCC3)[C@H]2c2ccccc2)c1 560569571 GWKCXMQXDFDSHE-JOCHJYFZSA-N 346.474 5.096 30 20 EKED COc1ccc(C2(NCc3ccc(C(C)(C)C#N)cc3)CCCC2)cc1 614179548 RPAHMZGHNHACCL-UHFFFAOYSA-N 348.490 5.055 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2ccccc2C(F)(F)F)cc1 619775737 PQDDXLOBXKGPMA-CQSZACIVSA-N 335.369 5.121 30 20 EKED C=CCn1c(S[C@H](C)c2c(C)cc(C)cc2C)nnc1C1CC1 620258992 MQBTYLKKEMREMZ-OAHLLOKOSA-N 327.497 5.120 30 20 EKED Cc1ccc(-c2csc(/C=C\c3cccc(OCC#N)c3)n2)cc1 727744881 VYHKCEQGHXFVAL-YFHOEESVSA-N 332.428 5.191 30 20 EKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 728764604 SZBBXVLYIOJKMT-DLBZAZTESA-N 348.471 5.302 30 20 EKED C/C(=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 731332020 ASTMPXIQKHJCBQ-IYOXOMEYSA-N 336.460 5.123 30 20 EKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc2ccccc2c1 744744130 PANWYFGZECEQTJ-UHFFFAOYSA-N 330.431 5.102 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(F)c1 749324957 WLBPFQHJYKBONJ-HXUWFJFHSA-N 344.389 5.042 30 20 EKED C[C@@H]1CC/C(=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 753578140 CCJGGZOCEZQYBP-YAWVOZISSA-N 330.431 5.027 30 20 EKED CC(C)(C#N)CCCCOC(=O)C(c1ccccc1)c1ccccc1 768372138 RZBBDQGUSYMBGN-UHFFFAOYSA-N 335.447 5.082 30 20 EKED C=CC[C@H](N[C@@H](C)c1oc2ccc(C)cc2c1CC)c1ccncc1 776155183 CZISIXOYRKVTIM-JXFKEZNVSA-N 334.463 5.667 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc2cccc(OCC)c2o1)c1ccncc1 776155828 IWLHGRUZCVJCKK-YJBOKZPZSA-N 336.435 5.195 30 20 EKED C#CCCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 776305348 BIRWLQJVDYXOHV-UHFFFAOYSA-N 334.444 5.155 30 20 EKED CCCCCCCCCCC(=O)N1CCCCC[C@H]1c1noc(C)n1 779701544 VNOQXZSMJZQBRU-SFHVURJKSA-N 349.519 5.353 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 799724429 MFEDGLNHFOBRIG-JHJVBQTASA-N 341.307 5.077 30 20 EKED CC[C@@](C)(NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 838354862 CNBHBXFRNNNXIU-IFMALSPDSA-N 349.478 5.046 30 20 EKED C[C@@H](N[C@@H]1CCc2cccc3cccc1c23)c1ccc(OCC#N)cc1 866294645 KVZXGUSVHOWHID-OPAMFIHVSA-N 342.442 5.080 30 20 EKED C=CCCC[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccccc1 883209098 VOSFELLKQWTHFP-JBUDQFAYSA-N 341.520 5.172 30 20 EKED Cc1ccc(C(=O)/C=C\c2cn(C)nc2-c2cc3ccccc3o2)s1 920063923 LNUPRTLWULIJBM-HJWRWDBZSA-N 348.427 5.099 30 20 EKED O=C(/C=C\c1cn2cc(Cl)ccc2n1)c1ccc2ccccc2c1 920755663 OMOMZBVHXLZGBR-HJWRWDBZSA-N 332.790 5.037 30 20 EKED CC1(C)CCC/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C1=O 1776550749 FIFRRMGQMGTQGS-RGEXLXHISA-N 334.415 5.214 30 20 EKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1cccc(C(F)(F)F)c1 72054456 FNGJWDPCKCOIPL-VIFPVBQESA-N 326.268 5.028 30 20 EKED CCO[C@@H](C)c1nc(CS[C@H](C)c2ccc(C#N)cc2)cs1 76861218 KNAAIVCBDHFLQW-QWHCGFSZSA-N 332.494 5.107 30 20 EKED CCc1ccc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)s1 208115297 GDELPNANMQRKHO-UITAMQMPSA-N 349.455 5.181 30 20 EKED Cc1cccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)C(C)(C)C)c1 237706253 OVSABUCBEDJQAN-LAUBAEHRSA-N 336.479 5.163 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C)o1 302937824 AUFAEAALEWLGQQ-UHFFFAOYSA-N 346.386 5.121 30 20 EKED Cc1ccc(C)c2c1CCC[C@H]2N[C@@H](CCCC#N)c1ccccc1 340431016 BMGFKVVMCLCUJG-FCHUYYIVSA-N 332.491 5.706 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 437657774 MOCJPBSVFRYHLB-SFTDATJTSA-N 347.462 5.114 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1cccs1)c1ccc(F)cc1F 464441715 ZXZIUXVMKAYGLN-CYBMUJFWSA-N 335.419 5.162 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 466837086 JGVAEKVWOAVYKT-LRDDRELGSA-N 326.267 5.259 30 20 EKED N#Cc1ccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 471433635 RBLUKPSRXPXTOT-UHFFFAOYSA-N 332.790 5.131 30 20 EKED CCN(CCCC(C)(C)C#N)[C@H](C)c1cccc(C(F)(F)F)c1 472256016 JKLOTPXXJURVNX-CQSZACIVSA-N 326.406 5.418 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(F)ccc1C 479700018 MVYIZDXBIAIFHL-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C/C=C/c1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 497385938 HIVAWTYFSXYEHQ-NBMKTQCDSA-N 345.446 5.023 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)CC1(c2ccccc2)CC1 505035015 JPUHCBCLILFUHI-UHFFFAOYSA-N 334.463 5.001 30 20 EKED C=CCNC(=O)Nc1ccc(N[C@@H](C)c2cccc3ccccc23)cc1 522157400 XVAXKPLIXKCEIX-INIZCTEOSA-N 345.446 5.320 30 20 EKED Cc1nc(S[C@@H](C#N)C2CCCCC2)c2c(C)c(C)sc2n1 524535828 VOSCIJAXJKGYDD-AWEZNQCLSA-N 331.510 5.181 30 20 EKED C[C@@H](NCc1cccc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 542014323 GGFLAPRJCJSLGA-MRXNPFEDSA-N 330.406 5.215 30 20 EKED C[C@H]1CC[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@H]1C 543594578 SUQYMSAVIWCKRP-ZJIFWQFVSA-N 345.512 5.027 30 20 EKED Cc1cccc2sc(C(=O)N[C@]3(C#N)CCC[C@H](C)C3)c(Cl)c12 609736981 VMCBAMDENYGRFP-BBATYDOGSA-N 346.883 5.065 30 20 EKED C=CCCc1ccccc1NC(=O)c1nc2ccccc2cc1Cl 685844854 SKEUCOALTXOOIP-UHFFFAOYSA-N 336.822 5.259 30 20 EKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1cc(C)sc1C 727261596 GFZABQCERLEJLU-UHFFFAOYSA-N 342.386 5.142 30 20 EKED Cc1ccc(-c2csc(/C=C/c3cccc(OCC#N)c3)n2)cc1 727744880 VYHKCEQGHXFVAL-JXMROGBWSA-N 332.428 5.191 30 20 EKED O=C(/C=C/c1ccc(F)c(F)c1)c1ccc(SC(F)F)cc1 734982189 YSZNSHMPCUMYJV-KRXBUXKQSA-N 326.314 5.176 30 20 EKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)s1 745990306 QMDQOTKBUZZKHH-HJWRWDBZSA-N 348.471 5.399 30 20 EKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 753412118 IGHJLMSKTARNKU-ZDUSSCGKSA-N 332.444 5.218 30 20 EKED C=CC[C@@H](N[C@H](C)c1cccc(-c2ccncc2)c1)c1ccncc1 766023011 ZEEOVUQTJZNYEX-VGOFRKELSA-N 329.447 5.112 30 20 EKED CCCOc1ccc(Cl)cc1NCc1ccc(O[C@H](C)C#N)cc1 770527846 AXJRKDZTPASFHS-CQSZACIVSA-N 344.842 5.032 30 20 EKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Cl)cc1 792093051 HAAIKFIZDHDZJO-SFHVURJKSA-N 348.833 5.042 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc(OC(C)C)cc1 799901336 YYMDWYWJUVICDF-UHFFFAOYSA-N 340.492 5.401 30 20 EKED CC[C@H](C#N)[C@@H](OC(=O)c1cscc1C(F)F)c1cccs1 893272139 JGYFWFXJRRVYRO-NOZJJQNGSA-N 341.404 5.195 30 20 EKED Oc1nc2ccccc2cc1C=Nc1ccc(Nc2ccccc2)cc1 912774610 NXIQXGOUTKEIOL-UHFFFAOYSA-N 339.398 5.435 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2cccc(Cl)c2)n1 80453353 HQXAPEABBAKIHA-CQSZACIVSA-N 346.883 5.074 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccccc1[N+](=O)[O-] 80468085 GUNFOFQPPFBFDH-KBPBESRZSA-N 341.436 5.020 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc3ccccc23)c1 113952566 IAUALLHGPYMQJR-PXNSSMCTSA-N 344.458 5.372 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1c(F)cccc1F 189913298 ATGPNCPRTGHSMZ-CQSZACIVSA-N 343.417 5.559 30 20 EKED CCCCCCCC[S@@](=O)Cc1csc(-c2ccoc2)n1 190794524 HXDRLICJQDTWBE-OAQYLSRUSA-N 325.499 5.012 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccccc1F)c1ccccc1 435095605 IOSRSFUJTCJEPO-OXJNMPFZSA-N 340.442 5.236 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(C)(C)C)cc1 438382871 YQHMFRDFEGFTJU-UHFFFAOYSA-N 338.451 5.084 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 464418663 HQRFLQQTWWCXNF-INIZCTEOSA-N 334.463 5.376 30 20 EKED C[C@@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C(C)(C)C1 472742998 AFWUWPTVWOESLL-HNNXBMFYSA-N 349.434 5.003 30 20 EKED C=C(C)[C@H](N[C@H]1CCSc2ccccc21)c1ccc(F)c(F)c1 480670021 VXUJMPMIVYVUBM-HKUYNNGSSA-N 331.431 5.409 30 20 EKED N#Cc1ccc(CSCc2coc(-c3cccc(Cl)c3)n2)cc1 515723355 XXNPEZXQXYZFNH-UHFFFAOYSA-N 340.835 5.300 30 20 EKED CCCC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(OC)cc1 539610286 TYFPSBJAIBKHLC-YCRPNKLZSA-N 340.442 5.288 30 20 EKED CC1(C#N)CCC(N[C@H](c2ccc(F)cc2)c2cccs2)CC1 573195473 MYUDQBSLZTYZKX-CUYAVPTFSA-N 328.456 5.039 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@H]1/C=C\c1cccs1 588757998 RDQAJSIVRYAGOQ-QOHRORDFSA-N 330.497 5.007 30 20 EKED CCc1cc(C#N)c(NC(=O)CSc2ccc(C(C)C)cc2)s1 604029321 PBUAXOCZUMOCAH-UHFFFAOYSA-N 344.505 5.036 30 20 EKED N#Cc1ccccc1/C=C\c1nc(-c2c(Cl)cccc2Cl)no1 609474216 RUXAUQWUZMXJOX-HJWRWDBZSA-N 342.185 5.085 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(F)c(Cl)cc1Cl 618801422 AUUZEYDVTVLJOU-XTZNXHDOSA-N 349.236 5.342 30 20 EKED C[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1cccc(C#N)c1 780527775 DADNYGNNLGDWJC-NSHDSACASA-N 338.760 5.081 30 20 EKED C#CCCCCCC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 783474370 DXRJKEZPFFLPLW-KGUUONHRSA-N 329.509 5.116 30 20 EKED CCC[C@@H](NCc1cccc(O[C@H](C#N)CC)c1)c1ccsc1 785566555 GJKKCTWTHMTUCO-PKOBYXMFSA-N 328.481 5.060 30 20 EKED N#CCCCCCC(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 805195894 FVQWOTLIJKFOIC-UHFFFAOYSA-N 345.462 5.009 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)c1ccc2ccccc2c1 915051443 ULVBLKMEIRYCAU-UHFFFAOYSA-N 329.325 5.090 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776697581 ISSJYMFRSMQEKE-PXTDYPQFSA-N 348.398 5.541 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776805975 MAVPGSPVAHXXKY-KTKRTIGZSA-N 348.851 5.338 30 20 EKED CCc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)s1 108967883 FWAHZNIPDKDUTL-HWKANZROSA-N 331.487 5.392 30 20 EKED COc1ccc(Br)cc1S[C@H](C)c1ccc(C#N)cc1 303856718 LACGKWITXPSNBB-LLVKDONJSA-N 348.265 5.183 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)[nH]1 328797905 WESITVSBTPABHJ-YESZJQIVSA-N 337.467 5.580 30 20 EKED Cc1cc(C)cc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c1 330037845 ZNFITWVVDMYEET-DMKPSLHHSA-N 342.483 5.246 30 20 EKED C=CCn1c(SCCCCC(C)(C)C#N)nnc1-c1cccs1 436196665 WHAYDCVTIPHKPY-UHFFFAOYSA-N 346.525 5.005 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 447561364 HZPDSSZQWCCGIJ-UZUQRXQVSA-N 341.458 5.422 30 20 EKED Cc1cc(Cl)cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 477116081 YUKWMCIUMVHKLO-ZDUSSCGKSA-N 344.867 5.153 30 20 EKED CC[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 487519366 ZIMNTFRGTUTFHZ-WIYYLYMNSA-N 334.463 5.122 30 20 EKED CCS[C@@H]1CCC[C@H](NC2CCC(C#N)(c3ccccc3)CC2)C1 507612574 FHSMPUQYGQDXEQ-RKDVLTNBSA-N 342.552 5.044 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCc3c(Cl)cccc32)c1 507827151 QMVJTERSEYWYJX-IBGZPJMESA-N 326.827 5.122 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@@H](C)c2ccc(C#N)cc2)o1 523740093 WLXOANAIGODQIS-HNNXBMFYSA-N 334.394 5.117 30 20 EKED C=CCN(CC=C)C(=O)Nc1cccc(CSC2CCCC2)c1 524629873 PBBUMBDLILJCEJ-UHFFFAOYSA-N 330.497 5.068 30 20 EKED C[C@@H](N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccc(C#N)c(F)c1 537407154 IYJCPKVHPFHDGQ-QRQCRPRQSA-N 348.396 5.277 30 20 EKED COCc1ccccc1/C=C(/C)CN[C@H](CCCC#N)c1ccccc1 556908327 MACVMUASRCJUED-SSZMPNMXSA-N 348.490 5.261 30 20 EKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2CC(C)(C)C)c1 589739240 LTVZYOOYPRSTKW-QGZVFWFLSA-N 330.472 5.074 30 20 EKED CCc1c(C(=O)/C=C\c2cccc(OCC#N)c2)oc2ccc(C)cc12 730150579 BLWXRHGIZDWLNE-HJWRWDBZSA-N 345.398 5.102 30 20 EKED CCC[C@H](CC1CCCCC1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780156049 COFHZUOTWOVGFK-FUHWJXTLSA-N 342.483 5.303 30 20 EKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccsc2)c1 790315328 WKPWVMJVBZEDRN-UHFFFAOYSA-N 348.496 5.133 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)=O)c(C)c1 907677491 QKOWPSWAQVCLTB-UHFFFAOYSA-N 335.447 5.302 30 20 EKED CCCCCCC[C@H](C)CNC(=O)Nc1cccc(NC(C)=O)c1C 918031000 MNSZWEKBWNQKEY-HNNXBMFYSA-N 347.503 5.072 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cc2ccccc2s1 1776782955 SBQQQTUOFHXBBO-INIZCTEOSA-N 333.497 5.195 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1c(Cl)ccc(C)c1C 434480770 NXJCSONZQVWEFY-UHFFFAOYSA-N 334.872 5.238 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)c(F)c1Cl 447472170 OFKPPGVOGWZTIM-UHFFFAOYSA-N 348.830 5.046 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C2CC2)[C@H]1C1CC1 455242727 HPHQDOKOCKDIGY-PZJWPPBQSA-N 338.495 5.191 30 20 EKED C=CCCCC(=O)Nc1ccccc1NCc1ccc(Cl)cc1 462833000 NGBNMYODVLNDKI-UHFFFAOYSA-N 328.843 5.247 30 20 EKED N#CCc1ccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)cc1 468286520 FYUXBWLYCJTCNO-UHFFFAOYSA-N 346.817 5.325 30 20 EKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc4ccccc4s3)csc2c1 483442439 QETNXQLGKDLENK-CYBMUJFWSA-N 348.452 5.310 30 20 EKED Cc1ccc(CCCCC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487504866 SQTLVWPOSJOODC-JOCHJYFZSA-N 348.490 5.259 30 20 EKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)cc1 500781074 XFQMMRFDDFYHIJ-SFHVURJKSA-N 341.842 5.073 30 20 EKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 520637620 WLLYUUAKZRUKKB-AWEZNQCLSA-N 345.826 5.052 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1Cl)c1ccccc1 534624814 VBNIYAHRBWPJKO-OXJNMPFZSA-N 339.866 5.363 30 20 EKED C[C@@H](NCc1ccc(C#N)o1)c1ccccc1-c1ccc(Cl)cc1 540613579 GAHYVEPBSOAGLW-CQSZACIVSA-N 336.822 5.322 30 20 EKED N#CCCCOc1cccc(N[C@@H]2CCc3ccc(Cl)cc32)c1 542234794 JHLHQHOJJLATHV-LJQANCHMSA-N 326.827 5.122 30 20 EKED Cc1c(CNCc2cccc(C#N)c2)sc2c(Cl)cccc12 559244762 WSAIXWXGBBJNAH-UHFFFAOYSA-N 326.852 5.025 30 20 EKED C=CCN(CC=C)C(=O)c1sc2cccc(Cl)c2c1Cl 641951393 WUQBFCGTADSHKO-UHFFFAOYSA-N 326.248 5.022 30 20 EKED CCCCCCn1c(SC[C@H](C#N)CCC#N)nc2ccccc21 726797185 XNHRUNHOHUDXAX-INIZCTEOSA-N 340.496 5.152 30 20 EKED COc1ccc(C)cc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 727264817 WZAAWPWKVDDITQ-MDZDMXLPSA-N 335.428 5.023 30 20 EKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1cc(F)ccc1F 751525582 XKEWRCVQQTVPOP-ZZXKWVIFSA-N 339.316 5.062 30 20 EKED Cc1ccc(F)c(C(=O)/C=C/c2csc(-c3cccs3)n2)c1 763291605 BQJCLFGJYIFKFL-FNORWQNLSA-N 329.421 5.215 30 20 EKED O=C(/C=C/c1cscc1Cl)c1ccc(-c2ccncc2)cc1 771857368 DJBKHCMEXXLYRK-AATRIKPKSA-N 325.820 5.360 30 20 EKED N#Cc1cccc([C@@H](NCc2ccc3ccccc3c2)C(F)(F)F)c1 783670549 MKYMIWBXBIOAFY-LJQANCHMSA-N 340.348 5.105 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1cccc(OC)c1 789719536 SAJSMWFUWZXQOG-VKAVYKQESA-N 349.474 5.589 30 20 EKED CC(=NNc1ccc(F)cc1)c1sc(Cc2ccccc2)nc1C 814693260 FSBUUXNBIWTLCP-UHFFFAOYSA-N 339.439 5.018 30 20 EKED C=CCN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)C(C)C 914683531 ROGASPFFCDXTMY-UHFFFAOYSA-N 348.421 5.078 30 20 EKED O=C(/C=C/c1cccs1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605625 YKPAGHQUDLSJLQ-BQYQJAHWSA-N 341.413 5.281 30 20 EKED Cc1cc(C)c(/C=C/C=NNc2ccc(Cl)c(C(=O)O)c2)c(C)c1 1776034400 FEJNTYIDVVCZDP-KHHAUUPUSA-N 342.826 5.075 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C(F)F)c(F)c1 1776784191 MUYABTCKCFLKKC-AWEZNQCLSA-N 345.405 5.057 30 20 EKED C[C@H](NCCCCC#N)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 174056904 HNEBOWLDOCGHOP-JTQLQIEISA-N 338.295 5.069 30 20 EKED OC1=Nc2ccc(/C(O)=N/[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)cc2SC1 329816162 FJLCACAWQPXGJF-GZBFAFLISA-N 344.480 5.044 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1F 340449809 XBIITHAWBZESPN-MOPGFXCFSA-N 344.861 5.955 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(-c2cccc(C#N)c2)cc1 363718467 LCEFELDCVLMGNS-OAHLLOKOSA-N 343.455 5.009 30 20 EKED CCCCCCCCC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 377441170 DYSMHEDFCVNYLM-KRWDZBQOSA-N 347.503 5.141 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1 455240532 FDPOKUMZZBYLFO-ZULIPRJHSA-N 338.495 5.048 30 20 EKED C=C[C@](C)(CC)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 467997479 BWDSDCQPCULZMQ-ORAYPTAESA-N 346.471 5.037 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccccc1F 476119232 PRNJWGVZNHYZQV-INIZCTEOSA-N 339.454 5.810 30 20 EKED N#CCCC[C@@H](NC(=O)CCCC1CCCCC1)c1ccccc1 487245412 XWVRDVKWQXDCGW-HXUWFJFHSA-N 326.484 5.288 30 20 EKED CC(C)(C)c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)s1 487503314 QJNBPAWPEIVSQF-MRXNPFEDSA-N 340.492 5.211 30 20 EKED N#CCCN(Cc1ccco1)Cc1ccc(-c2ccccc2Cl)o1 505775689 DGHOVESARXVZJY-UHFFFAOYSA-N 340.810 5.109 30 20 EKED C=CCN(Cc1cccs1)Cc1cnc(-c2ccsc2)s1 506016199 GCFCMLBANSTXOM-UHFFFAOYSA-N 332.519 5.121 30 20 EKED C[C@@H](F)CCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 510765670 OIBDSHHNIMVRJN-SKDRFNHKSA-N 331.275 5.037 30 20 EKED CC(C)Sc1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551802973 AVRCPVQDFRQDJN-MRXNPFEDSA-N 336.504 5.399 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC[C@H](C#N)CCC#N)cc1 575741504 ZAISAANKWDJACF-IRXDYDNUSA-N 335.476 5.395 30 20 EKED C=CCOc1cccc(NC(=O)N2CCCC[C@H]2c2ccccc2)c1 584026888 OVHYJGGJKWDNBM-FQEVSTJZSA-N 336.435 5.011 30 20 EKED Cc1c(C(=O)N(C2CCCCC2)C2CC2)sc2ccc(C#N)cc12 590107551 MYOWWSNCXRMXQG-UHFFFAOYSA-N 338.476 5.019 30 20 EKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)cc(Cl)c1 618801382 ASLKPFRAFKAOBJ-VOJFVSQTSA-N 331.246 5.203 30 20 EKED CCc1c([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)oc2ccccc12 618802800 FUXWBVGQOUJUFU-JLTOFOAXSA-N 330.431 5.205 30 20 EKED C=CC[C@@H]1CC[C@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C1 651672560 DUFQNKGQZKNEQY-DGTMBMJNSA-N 343.355 5.230 30 20 EKED COc1cccc(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)c1 732713586 HTMKDGFBSGROEC-NTMALXAHSA-N 345.398 5.087 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C/C1CCCCC1 735440105 DFYVHKAJYBMQRW-AYJWMTRPSA-N 328.481 5.013 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nc2ccccc2o1 744039201 KKFWBUMBZNFTEQ-QRWLVFNGSA-N 326.440 5.391 30 20 EKED FC(F)(F)c1csc(NN=C2CC(c3cccc(Cl)c3)C2)n1 753933245 WGDINMZIEGUMIY-UHFFFAOYSA-N 345.777 5.161 30 20 EKED COc1cc(C(=O)/C=C\c2cnc(C3CCC3)s2)ccc1SC 760263246 FNWRKEKOQZTLLF-FPLPWBNLSA-N 345.489 5.037 30 20 EKED C=CCC[C@H](N[C@H](C)C[C@H]1CCOC1)c1ccc(C(F)(F)F)cc1 773091684 JTPNGKQXVRLNNW-RKVPGOIHSA-N 341.417 5.117 30 20 EKED O=C1/C(=C/c2cscc2Cl)CCc2ncc(C(F)(F)F)cc21 777468790 ZREVQMLPKGDTCB-FPYGCLRLSA-N 343.757 5.028 30 20 EKED C/C(=C\C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(Cl)c1 792096842 SJZBYVBEILXFPD-VUVZNRFTSA-N 346.817 5.168 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@@]3(C#N)CC3(C)C)sc2c1 813304140 XDRMVRCPHXHQLP-GOSISDBHSA-N 346.883 5.100 30 20 EKED CC(=NNc1cccc2ncccc12)c1nc(-c2ccccc2)cs1 814804482 RBCFXTCXDXVBHQ-UHFFFAOYSA-N 344.443 5.194 30 20 EKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc2ccccc2c1O 841763360 VWZHPUBDMJHYPU-QRQCRPRQSA-N 342.442 5.145 30 20 EKED CC[C@H](C#N)[C@H](OC(=O)c1sccc1C(F)F)c1cccs1 873550520 CGNJZNXZFJGJCN-SKDRFNHKSA-N 341.404 5.195 30 20 EKED CC1(C)CCC/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C1=O 1776550719 BFSUQVJIQPWESA-VKAVYKQESA-N 334.415 5.214 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)C(C)(C)CC)cc1 1776787892 CZLLXSWUOOGOGM-IBGZPJMESA-N 349.515 5.015 30 20 EKED N#C[C@@H](C(=O)c1sccc1-c1ccccc1)c1nc2ccccc2o1 41548093 QHLSXPHXGDNNMW-HNNXBMFYSA-N 344.395 5.046 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1cc2cc(Cl)ccc2o1 60132677 ZCJVBTLIPXZNCM-GORDUTHDSA-N 333.170 5.341 30 20 EKED N#CC1(CCCSc2nc(-c3ccccc3)cs2)CCOCC1 281008158 OIDFSDVCTJGOJX-UHFFFAOYSA-N 344.505 5.003 30 20 EKED N#Cc1ccccc1NCc1ccc(-c2nc3ccccc3s2)o1 324917615 YSHVPADLFHPPOH-UHFFFAOYSA-N 331.400 5.040 30 20 EKED COc1cc(N=C(C)O)ccc1N=C(O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 328780252 FHIKKGJNQSBNJO-HRCADAONSA-N 344.455 5.498 30 20 EKED Cc1csc(C(=O)Nc2scc(C(C)(C)C)c2C#N)c1Cl 410932253 XMJFYGOMUFBWBI-UHFFFAOYSA-N 338.885 5.193 30 20 EKED CC/C=C\CCSCC(=O)Nc1ccccc1S[C@H](C)CC#N 467304489 FSMIEOJUMQJJLA-FOSCPCJNSA-N 348.537 5.109 30 20 EKED N#Cc1ccc(CSCc2csc(-c3ccsc3)n2)cc1F 479512454 LFEMSCFELCJTBW-UHFFFAOYSA-N 346.477 5.316 30 20 EKED CC(C)[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 497798870 IWCOSKGVKGTYOP-RDTXWAMCSA-N 340.854 5.226 30 20 EKED CC(C)C[C@](C)(C#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl 534596820 SYZKDMRQLPKMGN-HXUWFJFHSA-N 340.854 5.065 30 20 EKED CCN(C(=O)c1cccc(-c2ccoc2)c1)[C@@H](C)c1ccc(C#N)cc1 535528574 ISPKGYUXRUHYKE-INIZCTEOSA-N 344.414 5.042 30 20 EKED N#Cc1ccc2c(c1)[C@H](N[C@H](c1ccccc1)c1ccc(F)cc1)CC2 563287257 UBYYMBMSFSLTMZ-DHIUTWEWSA-N 342.417 5.064 30 20 EKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)CCCCCC#N 588327682 KDRBORMOWNOAHP-LJQANCHMSA-N 334.463 5.250 30 20 EKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccc(-c2ccccc2)cc1 591702236 WCIYFXUJDWISGS-MRXNPFEDSA-N 330.406 5.215 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)CC1(C#N)CCCCC1 596880160 FJHABQLLFLEHMR-UHFFFAOYSA-N 326.484 5.736 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccsc1 609969148 STZZZXISVWDBBK-CQSZACIVSA-N 348.427 5.154 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC(C)C)c1cccs1 615915663 JYUCKQQQGVBSBU-INIZCTEOSA-N 348.537 5.295 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(OC(C)(C)C)cc1 619754499 BFPIFHYPLBMKMU-CQSZACIVSA-N 342.870 5.240 30 20 EKED COc1ccccc1/C=C/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745989806 AJDGZGLQNZFHKX-JHMJBTLWSA-N 341.410 5.210 30 20 EKED C=CC[C@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccncc1 766018776 IUTNWAAQLPOLAT-IRXDYDNUSA-N 333.262 5.283 30 20 EKED C=CC[C@@H](N[C@H](CC)c1cccc(Br)c1)c1ccncc1 766022582 XGVJHQDQEGAARV-QZTJIDSGSA-N 345.284 5.202 30 20 EKED CCc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919713991 OVIWHXAGNXEICS-LJQANCHMSA-N 346.455 5.218 30 20 EKED C=CC[C@@]1(C(=O)O)CCCN(CCCCCCCCCC2CC2)C1 1776156433 KFQJQOKUPKVCEP-OAQYLSRUSA-N 335.532 5.260 30 20 EKED CC1(C)CCC/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C1=O 1776551020 YSERMAYSAKZSGL-QINSGFPZSA-N 340.444 5.276 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCC[C@@H](C)C1 109029118 LGIWSUXQDMOQDS-OWCLPIDISA-N 345.512 5.123 30 20 EKED CCc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)s1 110752848 FMMHXJCVNMOCQQ-PKNBQFBNSA-N 325.458 5.330 30 20 EKED Cc1ccc(-c2ncc(CN[C@@H](CCC#N)c3ccccc3)s2)cc1 130455056 KYVDPGBPVWZZBY-FQEVSTJZSA-N 347.487 5.253 30 20 EKED Cc1ccc(-c2nnc([C@H](C)Sc3cccc(C#N)c3)o2)cc1C 158762766 IOZDRJWDJUZQKG-AWEZNQCLSA-N 335.432 5.078 30 20 EKED C=C(C)[C@@H](NC(=O)Nc1c(C)cccc1C)c1ccc(F)c(F)c1 185726303 JUHKZTUJAPKQCB-QGZVFWFLSA-N 330.378 5.021 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cn1 214917673 SZFVZNIYCWNSBB-CLFYSBASSA-N 340.810 5.274 30 20 EKED CC1(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 428175766 JPSFDNCGLJSRAR-QGZVFWFLSA-N 338.838 5.124 30 20 EKED N#C[C@H]1CC[C@H](Nc2ccc(SCc3ccccc3Cl)cn2)C1 442833350 HLRXSFGQXIKLIX-ZFWWWQNUSA-N 343.883 5.131 30 20 EKED CC[C@@H](N[C@@H](C)c1ccc(Br)cc1)c1ccc(C#N)cc1 447541258 FYLXMAFKSDVPOY-SCLBCKFNSA-N 343.268 5.123 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)c(F)c1 447573643 SPMXFIDNLQRJHN-QWRGUYRKSA-N 337.225 5.416 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C(C)C)C1 475542835 ADXBJZAGPHOTRW-SFHVURJKSA-N 328.500 5.438 30 20 EKED C[C@H](CCCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 480169702 XCCPZBSJPIOAOA-MFKMUULPSA-N 345.302 5.530 30 20 EKED N#CCC[C@H](C#N)CNc1cccc(Sc2ccc(Cl)cc2)c1 581046418 LDSPLPSVODURAW-CQSZACIVSA-N 341.867 5.347 30 20 EKED CCC(C#N)(CC)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 599251647 HYMGXNYHKPPXLE-INIZCTEOSA-N 335.451 5.128 30 20 EKED C[C@@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1cccc(C#N)c1 600850208 QRLWKBNACSTSQF-MRXNPFEDSA-N 346.405 5.449 30 20 EKED C=C(C)COc1cc(CN[C@@H](C)c2cccc(C)c2C)ccc1OC 604418236 NKBJONZOTRZBJB-SFHVURJKSA-N 339.479 5.118 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1ccc2ccccc2c1 610078289 AAYYUPWRGHRXLR-MRXNPFEDSA-N 332.472 5.846 30 20 EKED CCCCc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 613289575 RBEQJMRKCUDICR-INIZCTEOSA-N 334.444 5.129 30 20 EKED C=CCN(C(=O)CC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891487 RTGLATDNFCHABC-UHFFFAOYSA-N 348.471 5.406 30 20 EKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)csc2c1 647379579 WQKQSUJAICLVFH-ZDUSSCGKSA-N 338.457 5.034 30 20 EKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(F)c(F)c1 728439547 MOAHDGRLXWIANT-GQCTYLIASA-N 333.384 5.046 30 20 EKED CCCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2s1 735204193 RCPHCIZQHSENNC-LSDHHAIUSA-N 328.481 5.469 30 20 EKED COc1cc(/C=C\C(=O)c2cc(C)c(F)c(C)c2)ccc1SC 741467021 JFSIROCFTISMSC-ALCCZGGFSA-N 330.424 5.069 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 766018394 HHSFNUWJRQNWEA-MBSDFSHPSA-N 328.459 5.717 30 20 EKED COc1ccc(C(=O)/C=C/c2scnc2C2CC2)c2ccccc12 782312885 LUQJVWRHTWXSEE-PKNBQFBNSA-N 335.428 5.078 30 20 EKED Fc1cccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)c1 853293979 YMAAPTZPNWQXQT-UHFFFAOYSA-N 330.247 5.279 30 20 EKED C[C@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1cc(C#N)ccn1 902993867 XRXBGAWREGSIRG-VOJFVSQTSA-N 346.261 5.062 30 20 EKED O=C(/C=C/c1cccc(OC2CCCC2)c1)c1ccc(F)cc1F 917517901 TYQIYMYJKIWDMI-DHZHZOJOSA-N 328.358 5.182 30 20 EKED N#C[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1 38844128 YHITWOLMQMDJKP-FQEVSTJZSA-N 332.834 5.284 30 20 EKED C=C(C)CN(CC)[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 152529955 PDCPRFDHADWSCL-LLVKDONJSA-N 340.254 5.002 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 175994272 BPYZNWSJUQJFJX-UHFFFAOYSA-N 333.218 5.047 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 186454760 BHTSBLDGJHTERO-SJCJKPOMSA-N 336.451 5.260 30 20 EKED N#CCCC[C@@H](N[C@@H]1CCSc2ccc(F)cc21)c1ccccc1 340453907 RTALYRDIPMJSDX-RTBURBONSA-N 340.467 5.387 30 20 EKED CC[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 447509977 OBJJPSKMBZDGBZ-QFIPXVFZSA-N 326.443 5.389 30 20 EKED N#Cc1ccc(C(=O)CSC(c2ccccc2)c2ccccc2)cc1 504590074 ATTNXHKZZGEZSR-UHFFFAOYSA-N 343.451 5.264 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1F 512631796 SWQDSMJJRUECER-MRXNPFEDSA-N 330.406 5.215 30 20 EKED Cc1ccc2cccc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)c2n1 539354311 POFMTWZTYVCYBH-UHFFFAOYSA-N 349.459 5.026 30 20 EKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccccc1Cl 539787589 AQQCSLCBESIFAY-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C[C@@H]1C[C@@H]1[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 564426565 CPQQNVSKNCQWLH-QRDAFUTHSA-N 336.866 5.186 30 20 EKED Cc1cc(C)c(-c2csc(NC(=O)CCCCCC#N)n2)c(C)c1 588264581 IYPVMLPTXCUPQL-UHFFFAOYSA-N 341.480 5.148 30 20 EKED CCCOc1ccc([C@@H](C)Nc2cccc(Cl)c2C#N)cc1OC 603862428 SNZVLEYYTUYXCQ-CYBMUJFWSA-N 344.842 5.182 30 20 EKED C[C@@H](S[C@H](C)c1nc(-c2cccs2)no1)c1ccc(C#N)cc1 609825206 LEAMLZAJPMYWBB-VXGBXAGGSA-N 341.461 5.225 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccc(F)c(F)c1 657980322 AZNVVYGXKQDLPT-PIGZYNQJSA-N 338.348 5.265 30 20 EKED CCC[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 733680927 JKWUUBJWZIFQLS-IRXDYDNUSA-N 338.451 5.391 30 20 EKED CSc1ccc2cc(CON=Cc3cccs3)c(Cl)nc2c1 760417788 UJYJUGBONFHVPK-UHFFFAOYSA-N 348.880 5.222 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccccc1OC(F)F)c1ccncc1 766021913 VMGVOCBJEZKTQD-DLBZAZTESA-N 332.394 5.041 30 20 EKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792103608 LJLIZOQKWKNMPZ-RTWAWAEBSA-N 342.442 5.241 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1ccc2ccccc2n1 796744946 CPPREINIBKFZKN-AITUJVMLSA-N 332.447 5.018 30 20 EKED C[C@H]1/C(=C/c2ccc(OCc3ccncc3)cc2)C(=O)c2ccccc21 809159847 XWSABSOKNLARIB-LRSOKBAUSA-N 341.410 5.044 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1ccncc1 858365921 VBWWMQYGBBXGAE-PXAZEXFGSA-N 338.348 5.208 30 20 EKED CC(=NNc1cccc2ncccc12)c1cc(Cl)sc1Cl 915964857 RKFLLAKRYSCLNN-UHFFFAOYSA-N 336.247 5.439 30 20 EKED CCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 58989280 OCORCUSQTAGRPV-KRWDZBQOSA-N 326.827 5.124 30 20 EKED CCN(CCC#N)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 78542020 NADZWBWJLGBWQL-UHFFFAOYSA-N 341.842 5.083 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(-c2ccncc2)c1 90665483 XQCUSJLZYNRKKD-MBSDFSHPSA-N 341.458 5.444 30 20 EKED C[C@@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(OCC#N)cc1 193013868 RUVSBALTDVWLKH-FOIQADDNSA-N 340.442 5.166 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(C3CCC3)cc2)s1 430592804 HYNWOJMEQZFXSG-MRXNPFEDSA-N 338.476 5.198 30 20 EKED COc1ccc(CN(CCCCC(C)(C)C#N)[C@@H](C)C2CC2)cc1 444600826 USXRJSMVPLFIKW-KRWDZBQOSA-N 328.500 5.016 30 20 EKED C[C@@H](NC(=O)c1cccc(CC#N)c1)c1ccc(Cl)c2ccccc12 462720418 JDHCPLBXJXPGOU-CQSZACIVSA-N 348.833 5.050 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCCOc1ccccc1Cl 487374123 ILTLYXBKYROLLO-CQSZACIVSA-N 346.883 5.225 30 20 EKED Cc1cc(CN[C@@H](Cc2ccccc2)c2cccs2)ccc1C#N 488331631 RVFLISHNQOFVDR-FQEVSTJZSA-N 332.472 5.002 30 20 EKED COc1ccc2cc([C@H](C)N[C@H]3CCc4cc(C#N)ccc43)ccc2c1 618801823 BDDGLSVELKVGCQ-WNSKOXEYSA-N 342.442 5.058 30 20 EKED CC(C)c1cccc(N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)c1 726478345 FJYSRKOYRONACQ-UHFFFAOYSA-N 343.883 5.168 30 20 EKED N#CCOc1ccc(CSc2nc(-c3ccccc3)cs2)cc1 729241204 QYJHJDFTHVTLLJ-UHFFFAOYSA-N 338.457 5.005 30 20 EKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2ccc(C)s2)ccc1OC 749450988 DGOLRXTZZQKYEG-XOVSCCBYSA-N 330.449 5.139 30 20 EKED Cc1ccc2cc(C(=O)/C=C\c3csc(-c4ccccn4)n3)oc2c1 754826734 WTAZJKUXHUEHPE-FPLPWBNLSA-N 346.411 5.156 30 20 EKED FC(F)(F)C1CCC(C=NNc2ccc(Br)cc2)CC1 767355858 KVOKWBAEJCNTOP-UHFFFAOYSA-N 349.194 5.216 30 20 EKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 772161267 GSJFYNZPDQPWGB-JTSKRJEESA-N 340.426 5.084 30 20 EKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1csc(Cl)c1 787185549 CZUHADMTXNUDKH-UPHRSURJSA-N 337.878 5.483 30 20 EKED N#CC[C@H](CC(=O)OCc1csc2ccccc12)c1ccccc1 795981771 DRZKBEUFDWXDOE-MRXNPFEDSA-N 335.428 5.032 30 20 EKED Cc1c(NCC2CCC(C#N)CC2)cccc1NC(=O)OC(C)(C)C 902102358 CFQFVZVYWCYKFT-UHFFFAOYSA-N 343.471 5.084 30 20 EKED C=CCC[C@H](N[C@@H]1CCC[C@H](CCCC(=O)O)C1)c1ccccc1 902325842 MTMCTYNHMNBMNP-RLLQIKCJSA-N 329.484 5.097 30 20 EKED CCCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917025881 RXKCZRMKWSHJKH-MRXNPFEDSA-N 326.465 5.347 30 20 EKED CCCCC/C(C=NNc1ccccc1C(=O)O)=C\c1ccccc1 1776029970 WDRFCLXWBVQQPI-ZDKUDODDSA-N 336.435 5.446 30 20 EKED COc1ccc(/C=C/c2ccc3ccccc3n2)cc1OCCCC#N 64367200 XXBJAORKQDNIKS-DHZHZOJOSA-N 344.414 5.096 30 20 EKED COc1ccc2oc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)c(C)c2c1 154335956 CRWFXPVPSVJCTL-HUUCEWRRSA-N 334.419 5.033 30 20 EKED CCO[C@@H](C)c1nc(CS[C@@H](C)c2cccc(C#N)c2)cs1 190801781 FKQRJFZLPFDYQL-STQMWFEESA-N 332.494 5.107 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccncc1 191415962 YIAFLYMLRRMQES-FQEVSTJZSA-N 349.478 5.303 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccccc1OCC#N 194071731 AVWMFRPSGAUNKI-UHFFFAOYSA-N 336.435 5.088 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccs3)s2)cc1 303153316 GJZBNPVXJHNTBE-MDZDMXLPSA-N 341.457 5.085 30 20 EKED O/C(=N/Cc1ncoc1-c1ccccc1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 328776071 COHIRIPJBJEMKJ-RYQLBKOJSA-N 338.451 5.405 30 20 EKED OC(=Nc1ncc(-c2cccnc2)s1)C12CC3CC(CC(C3)C1)C2 329262161 FBRBJJOPNIRZLG-UHFFFAOYSA-N 339.464 5.010 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2n1 340457879 WMMKOCJRSUFGGO-DYESRHJHSA-N 329.447 5.321 30 20 EKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1F 359386844 CYBOZSAVXITIJG-QZTJIDSGSA-N 330.834 5.565 30 20 EKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1F 359386845 CYBOZSAVXITIJG-ROUUACIJSA-N 330.834 5.565 30 20 EKED C=CCOc1ccc(CN[C@@H]2CCCc3ccccc32)cc1Cl 409469247 HBKKQTBPCXNVMZ-LJQANCHMSA-N 327.855 5.072 30 20 EKED C=CCCc1ccccc1NC(=O)CCSc1ccccc1F 410350823 UORPOMBVIDROQT-UHFFFAOYSA-N 329.440 5.065 30 20 EKED C=CC[C@@H](C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccccc1 427529441 WIFXGZFFDRFGNZ-MAUKXSAKSA-N 337.467 5.030 30 20 EKED CC(C)CCN(C(=O)N[C@@H](CCC#N)c1ccccc1)C1CCCC1 440239990 KKACGQCFDZLYSP-FQEVSTJZSA-N 341.499 5.032 30 20 EKED N#CCCCOc1cccc(NC(=O)Nc2cccc(C3CCC3)c2)c1 463856827 RJORKVLHCVQRKT-UHFFFAOYSA-N 349.434 5.281 30 20 EKED C=CCCCNc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 464067701 GYKXLDSVWCIITF-UHFFFAOYSA-N 332.806 5.110 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(C)c(O)c(C)c1 475564455 BDHSAGXYAUOHPZ-UHFFFAOYSA-N 338.451 5.505 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](CC(C)C)C1 475579093 SXCKANOIBFSAOQ-KRWDZBQOSA-N 328.500 5.438 30 20 EKED C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 503132415 CRWNXSSMDNSDHK-RTWAWAEBSA-N 347.483 5.220 30 20 EKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1Cl 517634873 PUOCZULUTJJKOK-LLVKDONJSA-N 338.760 5.081 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 537408066 UKAPZCXLCACXST-HUUCEWRRSA-N 342.483 5.610 30 20 EKED CC(C)(CCC#N)CNCC(c1ccc(F)cc1)c1ccc(F)cc1 571438750 BDBNRSULXODLIB-UHFFFAOYSA-N 342.433 5.016 30 20 EKED N#CCCC1CCN(C(=O)Nc2ccccc2Oc2ccccc2)CC1 574516489 FIPYHPYMPXYDPK-UHFFFAOYSA-N 349.434 5.027 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H](c1cccnc1)C1CCCCC1 611391846 BKPNYWAQCAJMAA-XZOQPEGZSA-N 345.490 5.242 30 20 EKED O=C1/C(=C/c2cnc(-c3ccccc3)s2)CSc2ccccc21 727264258 PJOUCVHMAHGHEM-GXDHUFHOSA-N 335.453 5.182 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1CCCCCCC1 741560721 GRMPSIKDZZKCBE-OAHLLOKOSA-N 330.497 5.380 30 20 EKED CSc1ccc(C(=O)/C=C\c2ccccc2OC(F)F)cc1F 741847531 OZHPIPRCDWUMSI-VURMDHGXSA-N 338.350 5.045 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 742429317 LRSNSMMLFPOPJQ-SNAWJCMRSA-N 332.639 5.308 30 20 EKED O=C(/C=C/c1cc(F)c(F)c(F)c1)c1ccc(-c2ccncc2)cc1 745990129 KZEHGVOOJMRPQZ-LZCJLJQNSA-N 339.316 5.062 30 20 EKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c(Cl)c1 745990145 LRMSMVCZGABVIZ-CLFYSBASSA-N 349.817 5.307 30 20 EKED Cc1cc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)cnc1Cl 760261447 CCMDENQCAFITKX-SREVYHEPSA-N 334.872 5.002 30 20 EKED CC/C(C)=C(/C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 779857628 WMBUBFOSRRCIHS-MSUUIHNZSA-N 348.446 5.017 30 20 EKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1csc(Cl)c1 787185613 GOTHUJGOQSQTDE-ONEGZZNKSA-N 337.878 5.483 30 20 EKED C[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1nc2ccccc2s1 795796870 UZURJDPTJWUPCB-KDOFPFPSSA-N 347.487 5.286 30 20 EKED FC(F)Oc1ccc(NN=C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 853299097 JHUDJUDKAVBERM-QWRGUYRKSA-N 336.304 5.054 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc2cc(C)oc12 1776783701 FNLHRMFWMXBEOV-SFHVURJKSA-N 331.456 5.035 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1Cl 66907448 FBGKDWGQMRFHOK-LBPRGKRZSA-N 345.855 5.378 30 20 EKED CC[C@H]1CC[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 433123374 YYICSFDWYCYUHQ-BZUAXINKSA-N 345.512 5.029 30 20 EKED C=CCC[C@H](NC(=O)Nc1cccc([C@H](C)OC)c1)c1ccccc1 435605048 CGJMSRHVHBFACZ-JXFKEZNVSA-N 338.451 5.223 30 20 EKED C=CCC[C@@H](NC(=O)Nc1cccc([C@H](C)OC)c1)c1ccccc1 435605050 CGJMSRHVHBFACZ-OXJNMPFZSA-N 338.451 5.223 30 20 EKED CC(C)(C#N)CCCCN1CCC(=Cc2ccc(F)c(F)c2)CC1 444689361 NDHZYUWXLZVZNU-UHFFFAOYSA-N 332.438 5.164 30 20 EKED Cc1oc2ccccc2c1C(=O)Nc1cc(C(C)(C)C)sc1C#N 466257471 RYCYDBJPYDCDGM-UHFFFAOYSA-N 338.432 5.224 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(C(F)F)c1 471273119 MWEFZKHPHSYSPF-UHFFFAOYSA-N 330.378 5.234 30 20 EKED CCc1cccnc1[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 507490799 AIHHHIOZYAODAX-KRWDZBQOSA-N 341.458 5.033 30 20 EKED CCC(CC)[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccs1 512662418 XCKIRJBGDAVTQL-DJJJIMSYSA-N 330.472 5.587 30 20 EKED C[C@H]1CC(NC(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@H](C)C1 524832553 ZAVRVFOJCQQKHB-RBSFLKMASA-N 345.512 5.027 30 20 EKED C=C[C@H](CC(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 535452636 XYNFBKCECHPDEM-BEFAXECRSA-N 347.380 5.108 30 20 EKED C=C[C@H](CC(=O)Nc1c(F)cc(Cl)c(C)c1F)c1ccccc1 536443471 AIKHWXUFSDESRC-GFCCVEGCSA-N 335.781 5.225 30 20 EKED C[C@@H](NCc1ccc(C#N)o1)c1ccc(-c2ccc(Cl)cc2)s1 537343699 MUSXHFMBJLETGQ-GFCCVEGCSA-N 342.851 5.384 30 20 EKED N#Cc1cccc(C2(N[C@H]3CCc4cc(Cl)cc(Cl)c43)CC2)c1 611475963 CVNHJHJWZANRBV-KRWDZBQOSA-N 343.257 5.131 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccccc1 618302224 FQXHWYKMSXKFSM-HXUWFJFHSA-N 332.472 5.550 30 20 EKED N#CC1(CCCOc2ccc3oc4ccccc4c3c2)CCOCC1 619622481 DQQAQRWOQRBYKB-UHFFFAOYSA-N 335.403 5.065 30 20 EKED N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc(C2CC2)cs1 647379650 ATQQSTZCCYMXNG-QGZVFWFLSA-N 334.444 5.078 30 20 EKED Cc1nc(/C=C\c2ccsc2)sc1C(=O)/C=C/c1ccsc1 726849136 XDIHEBKCCFAFMV-HZDAAVBUSA-N 343.498 5.641 30 20 EKED CCOc1cccc(C(=O)/C=C\c2csc(-c3cccs3)n2)c1 728440353 NMSCQSIGIQPGKQ-HJWRWDBZSA-N 341.457 5.166 30 20 EKED CC(=NNc1cc(F)c(F)cc1F)c1cc(Cl)sc1Cl 734302696 KJQBREJCMKNTBM-UHFFFAOYSA-N 339.169 5.308 30 20 EKED CCc1ccc(C(=O)/C=C\c2ccc(Br)s2)s1 747200785 JSBFONZESHGFFB-UTCJRWHESA-N 327.268 5.031 30 20 EKED CCCCCCCC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 753735448 XAHOMSQGFVLMNO-KRWDZBQOSA-N 347.890 5.240 30 20 EKED C[C@@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 755612805 XIAPDAXYMQFTRT-GOEBONIOSA-N 340.492 5.449 30 20 EKED COc1ccccc1C=NOCc1sc2ccccc2c1Cl 763479242 GPHALVMHJQYLSR-UHFFFAOYSA-N 331.824 5.114 30 20 EKED C[C@H](C#N)Oc1ccc(CNc2ccccc2Cc2ccccc2)cc1 770511263 TVRFSXVRJHFYBA-GOSISDBHSA-N 342.442 5.180 30 20 EKED Cc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1C#N 799331103 AAXRVMLIRFFMOW-UHFFFAOYSA-N 348.352 5.064 30 20 EKED Cc1cc(Cl)ccc1CNc1ccccc1S[C@H](C)CC#N 864006577 VWQIJPVKCZYKOO-CQSZACIVSA-N 330.884 5.655 30 20 EKED CCCCCCCCCC(=O)N1CCC([C@@H](O)c2ccccc2)CC1 914536080 HMRJYOKKEGPOFH-QFIPXVFZSA-N 345.527 5.099 30 20 EKED O=C(/C=C/c1cccnc1)c1ccc(-c2ccccc2Cl)s1 915113905 XYWBDZLCUKNPHN-BQYQJAHWSA-N 325.820 5.360 30 20 EKED COc1cccc(O)c1C=Nc1cccc(COC2CCCCC2)c1 921138510 ORTHXGGITPAUCM-UHFFFAOYSA-N 339.435 5.001 30 20 EKED Cc1cccc(C)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 75467846 LHEZOJCBJANBKD-UHFFFAOYSA-N 342.398 5.220 30 20 EKED COc1ccc(-c2csc(CN[C@@H](C)c3cccc(C#N)c3)c2)cc1 181850228 DDHVRDRGDYNASY-HNNXBMFYSA-N 348.471 5.146 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(O)nc2ccccc12 189892146 AQCXUULZPDOEKZ-UHFFFAOYSA-N 346.430 5.045 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CCC)c1ccccc1 195548126 ZROLZXFEZCLPPQ-FQEVSTJZSA-N 340.442 5.065 30 20 EKED CCCCOc1ccc(NCc2ccc(O[C@@H](C)C#N)cc2)c(C)c1 236704115 WLRLTMLDNAANHN-KRWDZBQOSA-N 338.451 5.077 30 20 EKED C[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 246207072 AEGXNIRHAVQKHB-ZMSDIMECSA-N 345.512 5.123 30 20 EKED COc1ccc(N=C(C)O)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 328992157 IRCNNMVOBJSPRS-DJIMGWMZSA-N 344.455 5.498 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CC(C)(C)c3ccccc32)cc1 431526401 TUTYTWLTIRLWJZ-IBGZPJMESA-N 347.462 5.032 30 20 EKED N#CCCC[C@H](NC(=O)Nc1cccc2c1CCCC2)c1ccccc1 432740950 CTTQCJHUPZKZBY-FQEVSTJZSA-N 347.462 5.122 30 20 EKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)NCCCCC#N)c1 435182855 UANBCOYAVRDACI-UHFFFAOYSA-N 341.842 5.131 30 20 EKED N#CC1(c2ccccc2)CCC(N[C@H]2C[C@H](c3ccccc3F)C2)CC1 436302275 SNASYJYCOBFHAW-SLWLFXMRSA-N 348.465 5.065 30 20 EKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccc(C#N)cc1 437671916 INNFDEQQQDIYNA-UHFFFAOYSA-N 339.464 5.152 30 20 EKED C=CC[C@@H]1N(C(=O)Nc2ccc(CC#N)cc2Cl)CCCC1(C)C 455737752 UPXAUJXVISSKJY-KRWDZBQOSA-N 345.874 5.005 30 20 EKED CC#CCCCC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1 466417644 PTVCXAOAQLUYJQ-SFHVURJKSA-N 349.474 5.075 30 20 EKED COc1ccc(C)cc1CNc1ccccc1S[C@H](C)CC#N 531391288 KIMAPXYOQQQHAF-OAHLLOKOSA-N 326.465 5.010 30 20 EKED C=CCCC[C@H](C)NC(=O)N(Cc1ccco1)Cc1ccc(C)s1 537184776 DEEIOCJCBNKNCA-HNNXBMFYSA-N 346.496 5.106 30 20 EKED CC[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609438598 MFFANHVHYMOKHM-ARFHVFGLSA-N 345.512 5.171 30 20 EKED CCO[C@@H](C)c1nc(CSc2ccc(Cl)cc2C#N)cs1 610654674 PZUWPTZBJVNTLQ-JTQLQIEISA-N 338.885 5.058 30 20 EKED COc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)c2ccccc12 610830032 YRIJLTLQRYHCMG-HOTGVXAUSA-N 330.431 5.132 30 20 EKED N#C[C@@H](C(=O)c1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 613403126 MKPPAYCYGNJRIL-LBPRGKRZSA-N 347.226 5.093 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)CC(C)(C)C 730421780 PKGQLNZTZCPYAX-YPMHNXCESA-N 332.444 5.074 30 20 EKED CCC(C)(CC)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 767960556 SVTMAFDUYMOGFB-HNNXBMFYSA-N 326.465 5.121 30 20 EKED CSc1cc(C(=O)OCCCC(C)(C)C#N)c(Cl)cc1Cl 784140545 CVOOMHVDUQKHNV-UHFFFAOYSA-N 346.279 5.202 30 20 EKED Cc1cc(NC2CCC(C)(C#N)CC2)ccc1NC(=O)OC(C)(C)C 827817404 BDBHJTURNSODMY-UHFFFAOYSA-N 343.471 5.226 30 20 EKED C=CCCC[C@H](Nc1cccc([C@H]2CCC(=O)N2)c1)c1ccccc1 883229531 LMPMHYQAESQRMN-LEWJYISDSA-N 334.463 5.147 30 20 EKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccccc1F 916319541 YNHRADUBKXTIRZ-UHFFFAOYSA-N 332.593 5.017 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2c(F)ccc(C(=O)O)c2F)cc1 1776699996 MMGARCAAZLPOIC-UCQJPZFISA-N 344.357 5.073 30 20 EKED COc1cccc2cc([C@H](C)N[C@@H](CCC#N)c3ccccc3)oc12 182052926 HJRNUBPXUOIRBF-YJBOKZPZSA-N 334.419 5.137 30 20 EKED CC(C)(CCC#N)CNC[C@H]1CC2c3ccccc3C1c1ccccc12 236818530 XJSRCPQHMKQMBH-UIFUMHDPSA-N 344.502 5.203 30 20 EKED CC(C)Cc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 261427510 HBRXNRJFAUQRLK-UHFFFAOYSA-N 338.476 5.143 30 20 EKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(Cl)c2ccccc12 421811497 IRNYKYKHPGJTDO-QHCPKHFHSA-N 347.911 5.462 30 20 EKED CC(C)(C#N)CCCCSCc1nc(-c2ccc(Cl)cc2)no1 435886871 CKPCKDDDMHSYQI-UHFFFAOYSA-N 349.887 5.343 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C#N)cs2)c(C)c1 437571752 XGHRTVVWTPCSJQ-LBPRGKRZSA-N 330.478 5.071 30 20 EKED C[C@@H](N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1(C)CC1 438662304 WTJHIKZCHCIJJN-OAHLLOKOSA-N 349.434 5.003 30 20 EKED C[C@@H](C(=O)Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 462018021 VNGAUVQPVXBGFN-CQSZACIVSA-N 332.428 5.029 30 20 EKED C[C@@H](NCc1ccc(F)c(C#N)c1)c1ccc(Cl)c2ccccc12 462471018 GPRBHYYHXVAPIY-CYBMUJFWSA-N 338.813 5.355 30 20 EKED C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 467823244 DZGJDKPOEGLXBP-CQSZACIVSA-N 340.492 5.064 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCC[C@@H](C)C1 475581108 DVBYGQURHPXXCQ-AEFFLSMTSA-N 328.500 5.581 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1[C@H](C)CCC[C@H]1C 477777235 ZBINYUGGDXUBKH-RBSFLKMASA-N 345.512 5.027 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc2occ(C)c2c1 482553418 UHWCGSPVAJDXRW-UHFFFAOYSA-N 338.382 5.100 30 20 EKED C[C@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1C 510049206 KCLLVEPINCNVRN-HOTGVXAUSA-N 349.434 5.003 30 20 EKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 537928501 UTKUFJYJKWVVJF-YJBOKZPZSA-N 349.434 5.145 30 20 EKED Cc1ccncc1[C@@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543961585 XXUKMEURCXVTPO-QZTJIDSGSA-N 341.458 5.341 30 20 EKED C[C@@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1cccc(C#N)c1 547395456 GCEHMYAGFKNMAN-GFCCVEGCSA-N 331.246 5.205 30 20 EKED Cc1cc(C)c(C#N)c(S[C@@H](C)c2ncc(-c3ccccc3)o2)n1 564684950 OCYCMTILJPVJJB-AWEZNQCLSA-N 335.432 5.078 30 20 EKED CC[C@H](C)c1ccc([C@@H](NCc2nc(C#N)cs2)C(C)C)cc1 571845045 NGWZQDUVRFDTRM-LIRRHRJNSA-N 327.497 5.015 30 20 EKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)c2ccccc12 588976338 PZDYYMXSKBKHCM-INIZCTEOSA-N 346.449 5.631 30 20 EKED N#C[C@H](C(=O)c1ccc(C2CCCC2)cc1)c1ccc2ccccc2n1 685782617 VHLVKRQNRPJLFY-FQEVSTJZSA-N 340.426 5.382 30 20 EKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1ccc(SC(F)F)cc1 734979942 GCOSAEZEXSTZCB-LREOWRDNSA-N 340.778 5.256 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccccc1SCc1ccccc1 735171234 YSEHKWDPFGWELO-OAHLLOKOSA-N 326.465 5.065 30 20 EKED CC(C)(C)c1csc(CON=Cc2ccccc2C(F)(F)F)n1 755941187 VAPNYOCCPQXOQP-UHFFFAOYSA-N 342.386 5.010 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 766018392 HHSFNUWJRQNWEA-FDDCHVKYSA-N 328.459 5.717 30 20 EKED C=CCC[C@H](N[C@@H](C)C[C@@H]1CCOC1)c1ccc(C(F)(F)F)cc1 773091682 JTPNGKQXVRLNNW-MPGHIAIKSA-N 341.417 5.117 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1cccc(F)c1F 776267446 AJJKSLOQNNPCQG-HJWRWDBZSA-N 345.345 5.124 30 20 EKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Cl)c1 797568985 ZEZYNVBQLMCIJN-SMDDNHRTSA-N 346.883 5.074 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)s1 802833576 OOMMFVDNYKFMFS-QKPAOTATSA-N 344.524 5.223 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C(F)=C\C2CCCCC2)s1 816068315 PLEFWPMFPDVUKY-OZYJXZHSSA-N 334.460 5.051 30 20 EKED N#CCCCCCC(=O)N1CC2(CCCCCC2)[C@@H]1c1ccccc1 828002276 SCHGAJXAKCXQGB-NRFANRHFSA-N 338.495 5.385 30 20 EKED CC(=NNc1ccccc1C(F)(F)F)c1nc2ccccc2s1 917563402 QCVGISCXIBISJW-UHFFFAOYSA-N 335.354 5.151 30 20 EKED C=CCCCCCN(C)C(=O)c1ccc(C2SCCCS2)cc1 156832934 GFTLAZBNFFMWRH-UHFFFAOYSA-N 349.565 5.374 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3c[nH]c4ccccc34)cs2)cc1 302935786 ACQBWUTUUVGSFD-ZHACJKMWSA-N 344.439 5.496 30 20 EKED N#CCCC[C@@H](NC(=O)c1cccc2ccccc12)c1ccccc1 352206580 NZBJHDSOFHOMKF-OAQYLSRUSA-N 328.415 5.005 30 20 EKED C=C(C)[C@H](NCc1ccc2nc(C)ccc2c1)c1ccc(F)c(F)c1 437982509 CREJHFRJSJKHIQ-NRFANRHFSA-N 338.401 5.228 30 20 EKED CC(C)(C#N)CCCCN(CCC(F)(F)F)Cc1ccccc1 444712023 XVNKARUCOLDBIG-UHFFFAOYSA-N 326.406 5.161 30 20 EKED C=C[C@H](CC(=O)Nc1cc(C(=O)CC)ccc1Cl)c1ccccc1 471433074 WUDFRFBXTFNOKG-CQSZACIVSA-N 341.838 5.231 30 20 EKED CC(C)(C)CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 484106479 DBJKMJZRUJUIET-UHFFFAOYSA-N 334.463 5.181 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 540597231 NSJQKAMWUFVISQ-CABCVRRESA-N 347.487 5.402 30 20 EKED Cc1ccccc1C(NCc1cccc(C#N)c1F)c1ccccc1C 546886144 GOIDZVBBUZVQFC-UHFFFAOYSA-N 344.433 5.193 30 20 EKED CCc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 550826416 DZNXLEVCDJCRMW-UTKZUKDTSA-N 346.474 6.081 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(-c2ccccc2)o1 559862961 FWOHLLWTQDPULN-NQIIRXRSSA-N 344.458 6.032 30 20 EKED C=CCC[C@H](NC(=O)Nc1ncsc1C(C)C)c1ccccc1 572351140 IWYFNQKSXSKWIY-HNNXBMFYSA-N 329.469 5.096 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(C(C)C)c1 596669241 COZSUJMFOQYYCF-MRXNPFEDSA-N 327.472 5.091 30 20 EKED C=CCOc1ccc(CNc2ccc(COC3CCCC3)cc2)cc1 606915120 YDNPBSWIAIFWPM-UHFFFAOYSA-N 337.463 5.323 30 20 EKED N#CCCCOc1cccc(-c2nc3cccc(Cl)c3s2)c1 608858620 AVVUCFXDLGQZNJ-UHFFFAOYSA-N 328.824 5.299 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C)C(C)(C)C#N)cs2)cc1 753628566 JHCLVDUHBWOFNL-ZDUSSCGKSA-N 342.464 5.029 30 20 EKED CCCCCCC[C@H](N[C@H]1CCO[C@]2(CCOC2)C1)c1ccccc1 773153662 WDNGSXKCEJWSTP-FDFHNCONSA-N 345.527 5.016 30 20 EKED CCCOc1ccc(/C=C/C(=O)c2ccccc2Cl)cc1OC 916135165 CBRQEOSDHFPVGK-CSKARUKUSA-N 330.811 5.034 30 20 EKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2cccnc2)cc1 916136491 PYQUTKKLAVLZOJ-NTCAYCPXSA-N 342.442 5.004 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)cc1 55870587 IDGXYQOJYJKHOA-OAQYLSRUSA-N 332.834 5.091 30 20 EKED CC(C)Oc1ccc([C@H](C)NCc2ccccc2C(C)(C)C#N)cc1 179532706 HVBBVCXGFMPKHY-KRWDZBQOSA-N 336.479 5.126 30 20 EKED CCC[C@H](NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 237034538 XDGSGOIUZUCZKI-SFHVURJKSA-N 332.369 5.208 30 20 EKED CC(O)=Nc1ccc(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1Cl 328806722 IAABDAWTMAJVGW-SOUVJXGZSA-N 348.874 6.142 30 20 EKED Cc1csc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c1Cl 411005171 FJXDLXADNSFQLZ-UHFFFAOYSA-N 338.885 5.193 30 20 EKED CCc1nc(C(C)C)ccc1CSCCCC1(C#N)CCOCC1 419493882 OOLRQJYGUFVEBP-UHFFFAOYSA-N 346.540 5.101 30 20 EKED CC(C)c1ccc2ncc(C#N)c(N3CC[C@H](CC(F)(F)F)C3)c2c1 447684274 AAHRBSKVYFYMMD-CYBMUJFWSA-N 347.384 5.009 30 20 EKED CC(C)c1ccc(NC(=O)c2ncc(C#N)cc2Cl)c(C(C)C)c1 459989161 WFZSDRYPIDPPSP-UHFFFAOYSA-N 341.842 5.106 30 20 EKED N#CCCCOc1cccnc1NCc1cc(-c2ccccc2)cs1 466626162 HUIGCDRCNINDIU-UHFFFAOYSA-N 349.459 5.105 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21 475552849 JCFASMGRSKEXOZ-YVWKXTFCSA-N 340.511 5.723 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1cccc(F)c1 475564819 BRUPMWMFNOCDMD-UHFFFAOYSA-N 340.442 5.042 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCc2ccccc21 476128336 BJYVHIBYBIRBCD-OAQYLSRUSA-N 333.475 5.597 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@]12CCc1ccccc12 476151371 NZXDFDZHQUAIKV-URXFXBBRSA-N 345.486 5.381 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1csc(-c2ccccc2)n1 482820281 CTJFGSHFDBIHPL-UHFFFAOYSA-N 340.492 5.019 30 20 EKED CC(C)CN(C(=O)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1 499318246 HBOACKPDVAZTNB-UHFFFAOYSA-N 347.245 5.168 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 537928499 UTKUFJYJKWVVJF-MAUKXSAKSA-N 349.434 5.145 30 20 EKED C=CCC[C@H](N[C@H](CC)[C@@H]1CCOC1)c1ccc(C(F)(F)F)cc1 540150003 CMCQVJSOJMOGAU-NXHRZFHOSA-N 341.417 5.117 30 20 EKED CCOc1cccc(Cl)c1CN[C@@H](CCCC#N)c1ccccc1 566863861 KHSOLHJJTFDCCI-IBGZPJMESA-N 342.870 5.263 30 20 EKED CCc1ccc(C=NOCc2ncc(-c3cccc(Cl)c3)o2)cc1 727465932 UDIUOIIYZNRTST-UHFFFAOYSA-N 340.810 5.108 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2ccc(SC(C)(C)C)cc2)cc1 770557823 KAPCFSPOOJFBTD-HNNXBMFYSA-N 340.492 5.480 30 20 EKED Cc1c(N[C@H](C)c2ccc(OCC#N)cc2)cccc1C(F)(F)F 777626336 CWUMDABJFRBKOO-CYBMUJFWSA-N 334.341 5.089 30 20 EKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1ccc(Cl)s1 818245909 TVMFINAFVLEQHG-KDVDBFTISA-N 345.807 5.140 30 20 EKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1F 916135842 WOEGTHQTFBKQHY-PKNBQFBNSA-N 349.386 5.592 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccccc1C 1776785217 IJAPDNBIYNSPJH-HXUWFJFHSA-N 333.516 5.583 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C#N)cc1 43171131 YNOUILNHGJIFDE-UHFFFAOYSA-N 349.478 5.469 30 20 EKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2ccc(Cl)cc2)n1 80455691 LXLWUQCSKSAEEP-CQSZACIVSA-N 346.883 5.074 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)s1 90664487 MIXGBDJZJJBIOY-JSGCOSHPSA-N 349.297 5.206 30 20 EKED CC1CCC(=CC(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 303598979 URXYJIVKYMJMTO-LOACHALJSA-N 328.481 5.013 30 20 EKED CSc1c(F)cccc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 439080563 RVUUVJUSNKNKCJ-UHFFFAOYSA-N 348.468 5.031 30 20 EKED N#Cc1ccc(NC(=O)Nc2cccc3ccsc23)c(Cl)c1 443921318 SLAGWZMKWAORFT-UHFFFAOYSA-N 327.796 5.070 30 20 EKED N#Cc1cccc(CNC2(c3c(Cl)cccc3Cl)CCC2)c1 447059238 KDMGTPCCMYUXRK-UHFFFAOYSA-N 331.246 5.034 30 20 EKED CC[C@H](NCc1cc(C)cc2c(C)c(C)[nH]c12)c1ccc(C#N)cc1 447540859 KNVDVINWKQZDOU-NRFANRHFSA-N 331.463 5.206 30 20 EKED C[C@@H](C(=O)N(CC1CCC1)[C@H](C)c1ccccc1)c1cccc(C#N)c1 462152223 ARMUCCJGCRFXTC-QZTJIDSGSA-N 346.474 5.052 30 20 EKED N#Cc1cccc(SCc2coc(-c3ccc(Cl)cc3)n2)c1 468648838 NBCGFWFQOCJWPF-UHFFFAOYSA-N 326.808 5.159 30 20 EKED Cc1cc2occ(C(=O)[C@H](C#N)c3nccc4ccccc34)c2cc1C 483205302 SKFMGGGLSABCKA-GOSISDBHSA-N 340.382 5.088 30 20 EKED Cc1csc(-c2ccc(N[C@H](C)c3ccc(C#N)cc3F)cc2)n1 512283603 RFOMDWKJWFDRAG-CYBMUJFWSA-N 337.423 5.302 30 20 EKED Cc1ccccc1-c1cccc(CN[C@@H](C)c2ccc(C#N)cc2)c1 517549798 PGYLWQVAFCNYIJ-SFHVURJKSA-N 326.443 5.385 30 20 EKED N#CCCCOc1cccc(CN2CCCCC[C@@H]2c2ccco2)c1 536671437 OGPDQVSWBWWBTP-HXUWFJFHSA-N 338.451 5.079 30 20 EKED N#CCCCCCC(=O)N[C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 588166426 WATPWBOZPUCAEP-MOPGFXCFSA-N 346.902 5.347 30 20 EKED CC1(C#N)CCC(Nc2ccccc2SCC(F)(F)F)CC1 590641732 KWAATRWXUQPVSX-UHFFFAOYSA-N 328.403 5.225 30 20 EKED Cc1cc(C)c(N[C@@H](C)c2cccc(C#N)c2)cc1Br 600849394 MEPDSSCQAGPNPS-ZDUSSCGKSA-N 329.241 5.111 30 20 EKED Cc1cccc(-c2nnc(SCc3ccccc3C(C)(C)C#N)o2)c1 610859391 UNTUGEFKQDIMNH-UHFFFAOYSA-N 349.459 5.139 30 20 EKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)C2CCCCC2)c1 726470326 UUNPUPOXLVNQHZ-UHFFFAOYSA-N 348.515 5.200 30 20 EKED C[C@@H](Nc1ccc(F)cc1OCC#N)c1ccc(Cl)c(Cl)c1 760218810 HDJRKHYDZBYECV-SNVBAGLBSA-N 339.197 5.208 30 20 EKED CC[C@H](N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccc(C#N)cc1 774224237 NVYSNUWNHJGQTE-PMACEKPBSA-N 332.447 5.045 30 20 EKED C=C(C)[C@H](NCc1cc2cccc(OC)c2o1)c1ccc(F)c(F)c1 775317975 BPUGFHVEAJZRJM-IBGZPJMESA-N 343.373 5.127 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1cc(Cl)ccc1Cl 779713401 SHSCLHDJOYNVTA-RYUDHWBXSA-N 335.234 5.457 30 20 EKED Cc1noc(C)c1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 916138317 DTEDLSZCOOKCSI-GQCTYLIASA-N 330.598 5.148 30 20 EKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C=C2CCCCC2)cc1 919841938 NFULVOJYGHITLD-OAQYLSRUSA-N 330.431 5.171 30 20 EKED CSc1ccc(Cl)cc1N=Cc1cc2ccccc2nc1O 920754845 FHROZLYHCDENQY-UHFFFAOYSA-N 328.824 5.066 30 20 EKED Cc1ccc(-c2nc(CSCc3ccc(C#N)cc3)cs2)o1 30529374 FNYHWMKEFJZJBV-UHFFFAOYSA-N 326.446 5.017 30 20 EKED C[C@@H](N[C@H](C)c1nc(-c2ccccc2)cs1)c1cccc(C#N)c1 153736209 UEEVSRMFAPCUKI-HUUCEWRRSA-N 333.460 5.094 30 20 EKED CCOc1ccc(-c2nc(CSCCCCC#N)cs2)cc1 161215174 FHNMFEWASBNZPI-UHFFFAOYSA-N 332.494 5.136 30 20 EKED C[C@@H](N[C@H](C)c1ccc2ccccc2c1)c1ccc(OCC#N)cc1 171982323 AXAUIYMVDKTZBG-IAGOWNOFSA-N 330.431 5.154 30 20 EKED Cc1cc(Cl)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1C 425675660 BFMQZNUNIUOREM-CQSZACIVSA-N 341.842 5.053 30 20 EKED N#Cc1csc(CNc2ccc(-c3ccc(Cl)s3)cn2)c1 432732127 SNTFTFNBJYRKOZ-UHFFFAOYSA-N 331.853 5.009 30 20 EKED C=CCC[C@@H](NC(=O)N1CCc2sccc2[C@@H]1C)c1ccccc1 435106028 ZFUKEPZHUHURMT-MAUKXSAKSA-N 340.492 5.084 30 20 EKED N#Cc1ccc(NC(=O)CC/C=C/c2ccccc2)cc1C(F)(F)F 443880537 FWIQFSBBVXEVQX-XBXARRHUSA-N 344.336 5.009 30 20 EKED Cc1nc(-c2ccc([C@@H](C)NCCCCC(C)(C)C#N)cc2)cs1 444673231 HFILUPONURHSQU-OAHLLOKOSA-N 341.524 5.489 30 20 EKED CCC[C@@]1(C)CCCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458797813 GWWRYTAPQNOLTR-FPOVZHCZSA-N 341.499 5.033 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(C)(C)C)cc1 463013503 SHZPZEMZFJQTNH-UWJYYQICSA-N 336.479 5.560 30 20 EKED Cc1ccc([C@H](Nc2ccc(C#N)c(Cl)c2)c2ccccn2)cc1 480578532 NLFZXIVTUDYFMU-FQEVSTJZSA-N 333.822 5.117 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C1CC1)C1CC1 510621212 FGEBCZPQBITCMX-UHFFFAOYSA-N 346.430 5.034 30 20 EKED C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1F 512278839 LADMPFWXWCNVNV-GFCCVEGCSA-N 336.332 5.365 30 20 EKED CCSc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512624068 HOVQVYCIXAJENO-UONOGXRCSA-N 328.456 5.221 30 20 EKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1F 512664583 AIPUHSIEWPAWSI-HXPMCKFVSA-N 328.818 5.153 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(F)c1 539216534 FGBGGFOIRPRNEK-MRXNPFEDSA-N 330.406 5.215 30 20 EKED Cc1oc(-c2ccccc2)nc1CSc1cccc(Cl)c1C#N 540042860 WIGYPLORCQNCJF-UHFFFAOYSA-N 340.835 5.467 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C)c(OC)cc1Cl 567100000 LVXKBRYQCSDOOG-UHFFFAOYSA-N 347.867 5.187 30 20 EKED Cc1ccc2oc(-c3noc(C[C@@H](CC#N)c4ccccc4)n3)cc2c1 570855274 LHYSMKJPMBYQCM-MRXNPFEDSA-N 343.386 5.031 30 20 EKED N#Cc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c(F)c1 572207976 WZNFLGPPSMGLIE-SFHVURJKSA-N 349.236 5.245 30 20 EKED CC(C)c1ccc([C@H](NCc2ccnc(C#N)c2)c2cccs2)cc1 610956682 PXPJCCPZIYTTAV-NRFANRHFSA-N 347.487 5.017 30 20 EKED CC(=NNc1ncnc2sccc12)c1ccc(SC(C)C)cc1 728425412 GFHPNYHNMGLPDD-UHFFFAOYSA-N 342.493 5.028 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(F)cc1F 728439644 NLQXMHQIMATKFN-XQRVVYSFSA-N 333.384 5.046 30 20 EKED O=C(/C=C\c1ncc[nH]1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 731156700 JJEXNBUINACUQX-YVMONPNESA-N 348.349 5.053 30 20 EKED Cc1cc(/C=C2/Cc3cc(F)ccc3C2=O)ccc1Oc1cccnc1 734305097 HXJQGHLBFBBSOM-YVLHZVERSA-N 345.373 5.144 30 20 EKED C[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 734643263 AIHZMNYDHMCKCW-OXJNMPFZSA-N 349.478 5.146 30 20 EKED CCOc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1 741473177 NRGBFKDMWVKVOV-FLIBITNWSA-N 329.399 5.043 30 20 EKED CCN(C(=O)c1sc2ccccc2c1Cl)c1ccc(C#N)cc1 742223061 JNVWYPNYVTUCFY-UHFFFAOYSA-N 340.835 5.093 30 20 EKED N#CCCC[C@H](NCc1ccc(C(F)F)c(F)c1)c1ccccc1 894606628 IUMVNRLXHCYLAT-SFHVURJKSA-N 332.369 5.288 30 20 EKED C[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 915350535 XTCRLDAMGQEQSD-CZAAIQMYSA-N 347.462 5.042 30 20 EKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccccc1Cl 915980934 DLEQXKNCDOHCCF-YFHOEESVSA-N 349.817 5.210 30 20 EKED CCCCc1oc2ccccc2c1C=NNc1nncc2ccccc12 917207922 PTBXKCWSVQQYAG-UHFFFAOYSA-N 344.418 5.165 30 20 EKED CCCc1nc(CNc2ccccc2S[C@@H](C)CC#N)cs1 86207519 UZGRBNDUUZRSEA-ZDUSSCGKSA-N 331.510 5.102 30 20 EKED C[C@@H](Nc1ccc(CC#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 154523885 VDBMJGWZEMXGGH-CYBMUJFWSA-N 337.810 5.234 30 20 EKED C=C(C)COc1cc(CN[C@H](C)c2cc(C)sc2C)ccc1OC 237166649 XGCCFITXBQQTJP-OAHLLOKOSA-N 345.508 5.179 30 20 EKED CCSc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 430642507 OSZACZJGSVNHKN-CQSZACIVSA-N 344.505 5.043 30 20 EKED C=CCC[C@H](NC(=O)C[C@@H](C)c1ccccc1OC)c1ccccc1 435300149 FRSYZPBAIUVUMG-XLIONFOSSA-N 337.463 5.013 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)C(c1ccccc1)c1ccccc1 442874644 UMSLIZJAPHOZFH-XEVCZEQESA-N 332.491 5.127 30 20 EKED CC[C@@H](NCc1cccc(COC(C)(C)C)c1)c1ccc(C#N)cc1 447564298 WNUUDOQESYQMIM-OAQYLSRUSA-N 336.479 5.114 30 20 EKED COc1cccc2c(CN[C@H](CCCC#N)c3ccccc3)cccc12 449338069 DVFFRWWNDDOGOE-JOCHJYFZSA-N 344.458 5.373 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(CCC(F)(F)F)cc1 486588805 XTZRDOOXRUEPDC-UHFFFAOYSA-N 346.396 5.595 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(F)F)cc1 506046314 UNNCKWFHKQZURS-UHFFFAOYSA-N 343.417 5.903 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2Cl)cc1 507920967 VXPQDWLDJWFHBK-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1F 512626101 RYNNZIVRJQGFJV-QWRGUYRKSA-N 337.225 5.416 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCCC(C)(C)C 518169319 RBHISMFGZQRSDU-HNNXBMFYSA-N 347.528 5.276 30 20 EKED N#CCc1ccc(NC(=O)Nc2ccc(OC3CCCCC3)cc2)cc1 523935454 ZYJHTSJIMDQMMK-UHFFFAOYSA-N 349.434 5.108 30 20 EKED CCCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)c1ccccc1 538566138 LWJYDPQSAXQKFO-GOSISDBHSA-N 346.474 5.245 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)o1 540807164 XCBYLWHALGTTMJ-HSZRJFAPSA-N 338.410 5.184 30 20 EKED CCCC[C@H](C)N(CCCC)C(=O)c1ccc(C2(C#N)CC2)cc1 563982061 WCXPHCFLEVEHKK-KRWDZBQOSA-N 326.484 5.063 30 20 EKED N#C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(Cl)cc1 585718051 XHWGPSBEMWCIIT-MOPGFXCFSA-N 328.818 5.175 30 20 EKED Cc1ccc(C(F)(F)F)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1 598869321 FMBBZRJUZFTMPW-HNNXBMFYSA-N 346.352 5.040 30 20 EKED CC(C)c1ccc(C[S@](=O)Cc2ccc(C#N)cc2)c(C(C)C)c1 610482204 IKMJVSKXRCGWCH-XMMPIXPASA-N 339.504 5.254 30 20 EKED CCCCc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 613289578 RBEQJMRKCUDICR-MRXNPFEDSA-N 334.444 5.129 30 20 EKED C=CCC[C@H](NCc1ccc(O)cc1)c1ccc(C(F)(F)F)cc1 682407534 UVXTZLWGXMJFPZ-SFHVURJKSA-N 335.369 5.208 30 20 EKED O=C(/C=C\c1c(Cl)ccc(Cl)c1Cl)c1cncc(F)c1 737445050 VKRZFNGAHIOHDN-RJRFIUFISA-N 330.573 5.077 30 20 EKED C=CCOc1ccccc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745990294 QGGLOLGICBSJRA-QXMHVHEDSA-N 341.410 5.210 30 20 EKED O=C1/C(=C\c2coc(-c3ccccc3)n2)[C@@H]2CCCc3cccc1c32 763290643 RROBSYBSGFBJDD-LSPINASFSA-N 327.383 5.041 30 20 EKED C[C@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 765330325 JROLNVFLMIEGCK-ZBEGNZNMSA-N 347.245 5.039 30 20 EKED CC(C)(C#N)CCCOC(=O)CC(c1ccccc1)c1ccccc1 782052253 KDGURTXFNQONGH-UHFFFAOYSA-N 335.447 5.082 30 20 EKED CC(CCCCCCC(=O)O)=NN=C1c2ccccc2-c2ccccc21 1776027572 QHSLLRPFVLAVOX-UHFFFAOYSA-N 348.446 5.306 30 20 EKED CCCCCCCC(=O)Nc1c(F)cc(Br)cc1F 115096792 ABGRAHFMSRHHLD-UHFFFAOYSA-N 334.204 5.026 30 20 EKED N#CCCC[C@@H](NCc1cccc(-c2cccnc2)c1)c1ccccc1 353916356 QDNSHWIZDPITCY-HSZRJFAPSA-N 341.458 5.273 30 20 EKED Cc1sc([C@@H](C)N[C@@H](C)CCC#N)nc1-c1ccc(Cl)cc1 411545346 WYOHAXMXRSAKPB-NWDGAFQWSA-N 333.888 5.115 30 20 EKED CC(C)(C#N)c1ccccc1COc1cccc(-c2nccs2)c1 447775061 BXECSBGFLZBLDP-UHFFFAOYSA-N 334.444 5.190 30 20 EKED CC(=O)c1cccc(C(F)(F)F)c1OCCCCC(C)(C)C#N 450933169 UCDAWCOKBQXFQG-UHFFFAOYSA-N 327.346 5.007 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](c1ncccc1C)C(C)C 505030285 URRDRLWENHHZCD-IBGZPJMESA-N 337.467 5.027 30 20 EKED C=CCC[C@H](N[C@H](C)[C@H]1CCCOC1)c1ccc(C(F)(F)F)cc1 507511409 OCYJIGNHJLWSRY-HFTRVMKXSA-N 341.417 5.117 30 20 EKED C=CCc1ccc(OCc2nc(-c3ccsc3)oc2C)c(OC)c1 524161725 OUZONWPPJHDXTL-UHFFFAOYSA-N 341.432 5.028 30 20 EKED CC(C)[C@H](NCc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 533360061 BYYCTBYFWFEADY-SFHVURJKSA-N 332.369 5.064 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(CC(F)(F)F)cc1)c1ccccc1 535387714 JHLXYCHEXFAHON-OAHLLOKOSA-N 333.353 5.090 30 20 EKED CCC[C@@H](NCCCSCC#N)c1ccc(Cl)c(Cl)c1 538158991 JTVXQZXNNRCUAC-OAHLLOKOSA-N 331.312 5.071 30 20 EKED C[C@@H](NC[C@@H](C)C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 542012183 PJXWGLQRPFEMJU-ZIAGYGMSSA-N 332.369 5.074 30 20 EKED Cc1ccccc1-c1noc([C@H](C)SCc2ccc(CC#N)cc2)n1 543149814 JKEWIEKDOZLMTO-HNNXBMFYSA-N 349.459 5.106 30 20 EKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)c3nc4ccccc4o3)c2c1 554320414 YQXCPTBTYJHRRO-HNNXBMFYSA-N 344.370 5.187 30 20 EKED Cc1nc(C(C)C)sc1C(=O)Nc1scc(C(C)(C)C)c1C#N 566548132 HUOGADGQTORTRW-UHFFFAOYSA-N 347.509 5.058 30 20 EKED N#CCCC[C@@H](NCc1ccsc1C(F)(F)F)c1ccccc1 600171461 VMSXAVSROFHMGA-OAHLLOKOSA-N 338.398 5.292 30 20 EKED Cc1c(Cl)cc(NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1Cl 610325297 ZQJOYTWPYILMQM-LLVKDONJSA-N 348.233 5.056 30 20 EKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccccc3)c2)cc1 729160514 UJZOCWFLKCDQMC-UHFFFAOYSA-N 345.427 5.159 30 20 EKED CCOc1ccc(C=Nc2ccc3nc(C(F)F)sc3c2)c(O)c1 794675398 AGBUJYRJGKZXTE-UHFFFAOYSA-N 348.374 5.089 30 20 EKED CC(=NNc1nccnc1C1CCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 807992402 ISFAAFAFBYMUGN-QWHCGFSZSA-N 346.887 5.051 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CC2(CCOCC2)[C@H]1C1CC1 818796553 WVCPFXCOBBOMCH-WIYYLYMNSA-N 349.559 5.181 30 20 EKED C=CCC1(C(=O)N2CCC(c3ccnc4ccccc34)CC2)CCCC1 854756675 IIZYIMCGXBPYIZ-UHFFFAOYSA-N 348.490 5.077 30 20 EKED CC1(C)OB(CC/C=C/[C@H](c2ccccc2)C(F)(F)F)OC1(C)C 2332239996 KRFMEQARNHAICD-INDWDQIESA-N 340.194 5.371 30 20 EKED Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 71951666 MXACSBWJBAKDRL-AWEZNQCLSA-N 340.835 5.057 30 20 EKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Cl)cc1C#N 184446618 GMSWXOKYBGRMHI-ZDUSSCGKSA-N 341.867 5.076 30 20 EKED C[C@H](N[C@H](C)c1cccc2ccccc12)c1ccc(OCC#N)cc1 192943517 LOWUYDQBXUGKPK-DLBZAZTESA-N 330.431 5.154 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccs1 367805489 XFBYVZFXGNXIIH-CABCVRRESA-N 333.460 5.094 30 20 EKED CC(C)Sc1ccc([C@H](C)NCc2cccc(F)c2C#N)cc1 428312275 FBKSLWHDGHIYQY-AWEZNQCLSA-N 328.456 5.049 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1cccc(C#N)c1 435041297 IPWVUQZMNRCEDP-CABCVRRESA-N 338.476 5.191 30 20 EKED C=CCCCCCN(C)C(=O)Nc1cccc(CCC(F)(F)F)c1 441092350 GOFSFKAMUFVWQG-UHFFFAOYSA-N 342.405 5.392 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Cl)c(F)c1 468381003 WISUDSSHBZOBRV-UHFFFAOYSA-N 345.845 5.512 30 20 EKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccsc2)cc1 479635919 LSCXTFCYWJVWAN-UHFFFAOYSA-N 336.441 5.023 30 20 EKED C[C@@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1F 512620988 UMJVSDMFAZXYBW-YJYMSZOUSA-N 328.406 5.274 30 20 EKED C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 520137825 UJDAVBSDGKRBRV-MRXNPFEDSA-N 349.434 5.004 30 20 EKED N#Cc1cccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 538059683 FLTBPKVWSBHVTO-SFHVURJKSA-N 331.246 5.106 30 20 EKED C=CCCC[C@H](C)NC(=O)c1ccccc1SCc1cccs1 540537944 JJMLRIKWEDGKPM-HNNXBMFYSA-N 345.533 5.515 30 20 EKED N#CC[C@@H](Cc1nc(-c2ccc3sccc3c2)no1)c1ccccc1 589128348 CVBATPFVIKNPDQ-HNNXBMFYSA-N 345.427 5.191 30 20 EKED CC(C)[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 603657783 LKJSZYPCQUDBPJ-LJQANCHMSA-N 335.451 5.007 30 20 EKED COc1ccc2[nH]cc(C(=O)/C=C\c3cccc(C(F)(F)F)c3)c2c1 734306938 JGMVHWIGTXDGAM-YVMONPNESA-N 345.320 5.091 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(SC(F)F)cc1 734980279 JEBPOWFKHUNUIL-WMZJFQQLSA-N 341.382 5.446 30 20 EKED CC(C)c1cccc(NC(=S)N[C@@H](CCC#N)c2ccccc2)c1 747707716 AYDPIUIMNKBMFL-IBGZPJMESA-N 337.492 5.141 30 20 EKED Cc1cc2cc(C(=O)/C=C\c3ccc(O[C@@H](C)C#N)cc3)oc2cc1C 749132652 PUIXFUFOPWAGRK-HWYHOQROSA-N 345.398 5.237 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc(F)c(F)c1 751514302 XVEHRBRHDNPSHB-XQRVVYSFSA-N 333.384 5.046 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(SCC(F)F)cc1)c1ccncc1 766024057 YYVCIMCLUWGMLF-RDTXWAMCSA-N 348.462 5.407 30 20 EKED CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccc2ccccc2c1 777609174 JORNWGTUCBDLEP-UHFFFAOYSA-N 334.806 5.032 30 20 EKED CCCCCCCC[S@@](=O)[C@H](C)c1nc(-c2ccccc2C)no1 790139756 MMOBLQHHQAFAJK-VOIUYBSRSA-N 348.512 5.215 30 20 EKED Cc1ccc(CCCCC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792094791 QWNCBHIURLBRHE-NRFANRHFSA-N 342.442 5.133 30 20 EKED CC(C)n1nccc1/C=C1/CCc2c(Cl)sc(Cl)c2C1=O 794941491 PJXFBPVXHXCULK-CLFYSBASSA-N 341.263 5.045 30 20 EKED CC(=NNc1cccc2ncccc12)c1ccc(Cl)cc1Cl 915964637 HGJCQDCUPUGEFD-UHFFFAOYSA-N 330.218 5.378 30 20 EKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(N2CCCCC2)cc1 916154221 CQYZUABALJACDQ-NTUHNPAUSA-N 342.442 5.121 30 20 EKED CC[C@@H](Nc1ccc(CC#N)cc1)c1ccc(Br)cc1 37071247 NPQNINPFSCPLEA-QGZVFWFLSA-N 329.241 5.078 30 20 EKED C=CCN(C(=O)c1csc(-c2ccc(C)cc2C)n1)c1ccccc1 63919531 UOWWEDVOYJPVMR-UHFFFAOYSA-N 348.471 5.260 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 296560765 UNNFQLCXULXAFI-GJZGRUSLSA-N 345.512 5.090 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@@H]3CCC(=O)[C@@H](C)C3)n2)s1 328920604 LWNAGNCERXASIV-WDEREUQCSA-N 348.493 5.027 30 20 EKED CC(O)=Nc1ccccc1-c1noc([C@@H]2CCC[C@@H]3CCCC[C@@H]32)n1 329720887 BTAHJNFKIWISRK-HRCADAONSA-N 339.439 5.418 30 20 EKED N#CCC[C@@H](NC1CCC(c2ccc(O)cc2)CC1)c1ccccc1 344851231 JMPAYFZVQWACKH-INXVGGANSA-N 334.463 5.053 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cc(Cl)ccc1Cl 427881462 IQEUSFHHEWFAJC-MNOVXSKESA-N 337.225 5.416 30 20 EKED C=CCOc1cccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c1 432757944 LRPWZMUGHPOXQO-FQEVSTJZSA-N 348.446 5.011 30 20 EKED C[C@@H](SCc1ccc(C#N)cc1Cl)c1nc2ccccc2o1 438874645 LCWCEMPWMHULGC-LLVKDONJSA-N 328.824 5.347 30 20 EKED N#Cc1cccc(S[C@H](C(=O)Nc2ccccc2)c2ccccc2)c1 468651732 CYYIJEBLWANCPM-FQEVSTJZSA-N 344.439 5.030 30 20 EKED N#CC[C@H](CC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 476688098 LDJCVMDAFWJHPK-CYBMUJFWSA-N 348.780 5.304 30 20 EKED Cc1ccc(C)c(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 524392376 FKMXXUPHSZDFLO-UHFFFAOYSA-N 346.455 5.085 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2sccc2s1 530507981 VXZGRLFAYIADEV-UHFFFAOYSA-N 341.501 6.067 30 20 EKED COc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)c2ccccc12 531696467 BIQRQIIRUPCYKV-HZPDHXFCSA-N 330.431 5.132 30 20 EKED CSc1ccc(NCc2cccc(OCCCC#N)c2)cc1Cl 532727816 FBWLXUOQJXWFSE-UHFFFAOYSA-N 346.883 5.357 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 588757992 RDQAJSIVRYAGOQ-GZKZCVOOSA-N 330.497 5.007 30 20 EKED N#Cc1cccc(-c2nnc(CSc3ccc4ccccc4c3)o2)c1 610216961 SLDOZZHAYZOSIP-UHFFFAOYSA-N 343.411 5.054 30 20 EKED Cc1cccc2sc(C(=O)Nc3ccc(F)cc3C#N)c(Cl)c12 610577670 HZJLJRBUJNUYEH-UHFFFAOYSA-N 344.798 5.126 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CCF)C1 666866079 HHUZUQLKSQFWQH-INIZCTEOSA-N 332.463 5.142 30 20 EKED CCCCCCCC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 731013767 CCIUNAOAVBOZQJ-FQEVSTJZSA-N 326.484 5.582 30 20 EKED CC(=NNc1ccc2ccccc2n1)c1cc(Cl)sc1Cl 744595728 AWWKWOZYHHLECO-UHFFFAOYSA-N 336.247 5.439 30 20 EKED C=CC[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccncc1 766018774 IUTNWAAQLPOLAT-IAGOWNOFSA-N 333.262 5.283 30 20 EKED CC(C)(C#N)CCCCSc1nn(-c2ccccc2)c(=S)s1 767033439 NYOGCENFWBCPTA-UHFFFAOYSA-N 349.550 5.475 30 20 EKED C[C@@H](C#N)Oc1ccccc1NC(=O)C=C1CCC(C(C)(C)C)CC1 780167427 XBMQUUXXVMBUJQ-MYJWUSKBSA-N 340.467 5.079 30 20 EKED Cc1ccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 917028013 LKZPCBQQZZPSAQ-OAQYLSRUSA-N 341.414 5.295 30 20 EKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1ccc(O)cc1 7718061 TVUGDRNIPMTSMO-JXMROGBWSA-N 341.819 5.065 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccccc1Br 90665368 RDZYVNYNWQHKDL-KDOFPFPSSA-N 343.268 5.145 30 20 EKED CCCOc1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 110400002 YCKVSDSFIQFRRA-MDWZMJQESA-N 349.430 5.054 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cc1 110653154 YJMLIGJRCLNGIU-KFRNIWOLSA-N 346.213 5.180 30 20 EKED C[C@@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccc(C#N)cc1 154329018 FIXQWFJCQONYPC-NXEZZACHSA-N 325.264 5.338 30 20 EKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1cc(C#N)cs1 237163331 DOVRFEZQPMVEQB-QGZVFWFLSA-N 348.899 5.159 30 20 EKED CC(C)c1ccoc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 283900174 JYDQZIVBDKOEMX-ZDUSSCGKSA-N 328.437 5.050 30 20 EKED C[C@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 315389163 FHYCOWMVRWEGCL-WDEREUQCSA-N 337.225 5.416 30 20 EKED N#CCCC[C@@H](N[C@H]1CCCc2c(Cl)cccc21)c1ccccc1 340431031 BOCZPGWNIVJUQE-RTWAWAEBSA-N 338.882 5.742 30 20 EKED N#CCCC[C@@H](NCc1csc(-c2ccccc2)n1)c1ccccc1 353915924 OOECXCXDHSMJPU-HXUWFJFHSA-N 347.487 5.335 30 20 EKED COc1ccc(CN(CCCCC(C)(C)C#N)C(C)(C)C)c(OC)c1 444651113 FUCOUZGIOUZNOL-UHFFFAOYSA-N 346.515 5.024 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c(C)c1 454643685 TWBDNRRXNHDBJF-JYJNAYRXSA-N 345.512 5.090 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1ccc(F)cc1C#N 462386622 GHYJSSPITAMQBL-GFCCVEGCSA-N 337.423 5.302 30 20 EKED C=C[C@@](C)(CC)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 467997480 BWDSDCQPCULZMQ-YJYMSZOUSA-N 346.471 5.037 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CCCCC1(C)C 469198287 IYCMOWZAESMWLU-GJZGRUSLSA-N 330.497 5.093 30 20 EKED CCC1CCC(N(C(=O)c2ccc(C(C)(C)C#N)cc2)C2CC2)CC1 475114676 XRWJXJVNKDAOTA-UHFFFAOYSA-N 338.495 5.061 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc2ccccc12 476135368 GKJCFCPBEPLFLG-UHFFFAOYSA-N 335.472 6.006 30 20 EKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2c1 513733181 OSDDGYATBWXTAD-CQSZACIVSA-N 346.411 5.095 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)Cc1cccc(C#N)c1 520169765 HQJLIFXSHGFPIK-QGZVFWFLSA-N 332.472 5.383 30 20 EKED C=C[C@@H](CC(=O)N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 536124505 FZUSYXBMAAYKFI-MAUKXSAKSA-N 347.380 5.156 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 538152142 ZJMOQPICTQVRHW-LSDHHAIUSA-N 347.487 5.402 30 20 EKED Cc1cccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1C 579622561 URXPEDCFQJFJAS-UHFFFAOYSA-N 332.428 5.156 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)s1 732713701 GAWIJIWIVPQICU-SOFGYWHQSA-N 335.428 5.448 30 20 EKED C=C(Cl)CNC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 736972128 NMDGOEFTMIZRMC-HNNXBMFYSA-N 344.842 5.009 30 20 EKED Cc1cccc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744364109 ZVCRVAQZEJCHGN-OAQYLSRUSA-N 340.426 5.211 30 20 EKED C=CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745990240 PCWZTVHJGDLFGT-IZZDOVSWSA-N 341.410 5.210 30 20 EKED CC[C@@H](C)CN(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748942383 PBAOKHPJMUKVJC-DYESRHJHSA-N 349.478 5.242 30 20 EKED C[C@H](ON=Cc1ccc(C(C)(C)C)cc1)c1nc(-c2ccccc2)no1 749255978 KQFHVAFFBDAJOO-HNNXBMFYSA-N 349.434 5.146 30 20 EKED CC(=NNc1nccc2sccc12)c1sc(C(C)C)nc1C 751131900 ZZJVEJSUFSEPIJ-UHFFFAOYSA-N 330.482 5.021 30 20 EKED CC[C@@H](NCc1ccc(OC)c(C#N)c1)c1ccc(Cl)c(Cl)c1 773079195 XBJBFDRQPMMYID-QGZVFWFLSA-N 349.261 5.115 30 20 EKED CCCCCCCCC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1 779702071 RYZFODYJFRTVID-KRWDZBQOSA-N 349.519 5.387 30 20 EKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2)cc1 1776061724 LICTZFUWNWVKIE-UHFFFAOYSA-N 348.377 5.027 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccccc1Br 90665370 RDZYVNYNWQHKDL-RDTXWAMCSA-N 343.268 5.145 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(F)c1 322410385 WRXDUYCREQNDHF-CYBMUJFWSA-N 332.806 5.335 30 20 EKED CC[C@H](C)c1ccc([C@@H](/N=C(/O)N2CCC(C#N)CC2)C(C)C)cc1 330536400 PVGMOFOHHFPOGU-JXFKEZNVSA-N 341.499 5.047 30 20 EKED C=CCC1(C(=O)Nc2ccccc2CCC(F)(F)F)CCCC1 410566693 ZNIHIQRJKVYRHA-UHFFFAOYSA-N 325.374 5.257 30 20 EKED Cc1cc(Cl)ccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432462829 LHTROFQCTKKMBF-GOSISDBHSA-N 341.842 5.205 30 20 EKED C=CCC[C@H](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 435290887 SOYZKMRUVJYHOD-IKGGRYGDSA-N 339.401 5.179 30 20 EKED N#Cc1cccc(Cl)c1N[C@H]1CCCc2cn(C3CCCC3)nc21 445601205 POXFJUDQSQITKY-KRWDZBQOSA-N 340.858 5.013 30 20 EKED CC[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 487449976 SIYWYMRIILDIJZ-UGKGYDQZSA-N 348.490 5.430 30 20 EKED C=C[C@H](CC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2)c1ccccc1 500629224 IMTPAKYVVASOPN-SXSPYAJSSA-N 343.470 5.193 30 20 EKED C=CCn1c(S[C@@H](C)c2ccccc2)nnc1-c1ccc(F)cc1 501629342 QNRSBULBFRMORO-AWEZNQCLSA-N 339.439 5.124 30 20 EKED C=C(C)CCSc1nnc(COc2ccc(Cl)cc2Cl)o1 505488387 ULHCFJWTVSQJNL-UHFFFAOYSA-N 345.251 5.014 30 20 EKED Cc1oc(-c2ccsc2)nc1CSCc1ccccc1C#N 524262264 YRNCOTBIBDELHT-UHFFFAOYSA-N 326.446 5.017 30 20 EKED CCc1c([C@@H](C)N[C@H](CCC#N)c2ccccc2)oc2ccccc12 539506988 IRFSLSLUAODJSL-OXQOHEQNSA-N 332.447 5.691 30 20 EKED C=CCC[C@@H](NCc1ccc2c(c1)nc(CC)n2C1CC1)c1ccco1 552257569 MDCSQYQSJVTMEB-GOSISDBHSA-N 349.478 5.324 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc3sccc3s2)s1 570624984 KVCIBMSQWCZECE-VIFPVBQESA-N 346.502 5.207 30 20 EKED Cc1cc([C@@H](N[C@@H]2CCCc3cc(C#N)ccc32)C2CC2)ccc1F 584177092 JLYRPEYTVLUUPP-YADHBBJMSA-N 334.438 5.124 30 20 EKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc1 590675850 CJZVYEWIGGWKGL-AUSJPIAWSA-N 336.460 5.028 30 20 EKED C[C@H](Sc1ccc(C#N)cc1)c1nnc(-c2cccc(Cl)c2)o1 609782733 LBKHRPAUZVZYFE-NSHDSACASA-N 341.823 5.115 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CCC(C)(C)C 609929968 QVJSNLGKEZZVRK-LSDHHAIUSA-N 347.528 5.275 30 20 EKED CC(C)c1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(C(C)C)c1 612297079 SKVDQJSELLKNJB-FQEVSTJZSA-N 327.472 5.091 30 20 EKED CC(C)C[C@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 727953791 GNLUVHLRFHNILX-WCQYABFASA-N 334.872 5.198 30 20 EKED C#Cc1cccc(N(C(=S)Nc2ccc3ccccc3c2)C(C)C)c1 728227054 UPATTYMCDLHAHI-UHFFFAOYSA-N 344.483 5.433 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1cccs1 728441644 NRYGINUWMIYBIL-HJWRWDBZSA-N 329.421 5.215 30 20 EKED N#Cc1c(Cl)cccc1SCc1nc(Cl)ccc1Cl 762478109 RYBLTXKGFOQVAR-UHFFFAOYSA-N 329.639 5.206 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2CCCc3occc32)cc1 764881064 QSLSZZOXCDEWAI-RDTXWAMCSA-N 331.843 5.139 30 20 EKED C#CCCCCCC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C 779981513 RUOMUXZJFJRUDA-ZDUSSCGKSA-N 338.278 5.023 30 20 EKED COc1ccc(NN=C(C)c2sc(C(C)C)nc2C)cc1Cl 782229786 KCLYTFWASIVBJR-UHFFFAOYSA-N 337.876 5.073 30 20 EKED O=C(/C=C\c1scnc1C1CC1)c1cc2cc(Cl)ccc2o1 782306652 OTMLYMCPYAMIFW-XQRVVYSFSA-N 329.808 5.316 30 20 EKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(SC(F)F)cc1 787026653 NFOVLBYFOFRPFE-KPZWWZAWSA-N 344.430 5.211 30 20 EKED CC(C)(C#N)CCOc1ccc(NC(=O)OC(C)(C)C)cc1Cl 799964125 SDPMBDFLHDAWAG-UHFFFAOYSA-N 338.835 5.006 30 20 EKED CC[C@@H](c1ccc(F)cc1F)[S@@](=O)CCCCC1(C#N)CCC1 899392019 ODFOEOWQRZPKJK-SBUREZEXSA-N 339.451 5.029 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 915087671 WLVSQLIEUPBPBG-QFIPXVFZSA-N 340.426 5.211 30 20 EKED CC1(C)C/C(=C/c2ccc3oc(C(=O)O)cc3c2)C(=O)c2ccccc21 1776526538 NZMBWVQDQHPTRY-GDNBJRDFSA-N 346.382 5.079 30 20 EKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1ccc(Cl)s1 23609229 TVMFINAFVLEQHG-SDCOAONHSA-N 345.807 5.140 30 20 EKED C=CCn1c(SC(c2ccccc2)c2ccccc2)nnc1C1CC1 255929629 JEBWALMEXOOAJX-UHFFFAOYSA-N 347.487 5.223 30 20 EKED C[C@@H](Cc1nc(C2CCC(C)(C)CC2)no1)/N=C(/O)C1CCCCC1 329680582 RLOCYXQNZXVSFL-AWEZNQCLSA-N 347.503 5.221 30 20 EKED Cc1ccc(-c2ncc[nH]2)cc1N=C(O)[C@H](C)OC1CCCCCC1 330045626 GMADEJYDVLGOLZ-HNNXBMFYSA-N 341.455 5.101 30 20 EKED CCCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](CC)c1ccccc1 455917528 JVGUFROFVFGGBW-FQEVSTJZSA-N 335.451 5.148 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(Cl)c1 530402076 OPOFZNSUMUHRBC-UHFFFAOYSA-N 341.882 5.763 30 20 EKED CC(C)[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(F)c1 542846372 JYCMWZGVVFNJNF-FQEVSTJZSA-N 344.405 5.457 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 559859149 BNVMHPDBYLDIAF-KSSFIOAISA-N 347.289 6.079 30 20 EKED CC(C)CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccoc1 561315727 RROMFDRFQXEPOQ-FQEVSTJZSA-N 326.440 5.552 30 20 EKED Cc1cccc(COc2ccc([C@H](C)Nc3cccc(C#N)n3)cc2)c1 570723894 DRGJDKPRBRMLCA-KRWDZBQOSA-N 343.430 5.014 30 20 EKED N#C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(Cl)cc1 585718056 XHWGPSBEMWCIIT-RTBURBONSA-N 328.818 5.175 30 20 EKED CCn1c2ccccc2c2cc(NC(=O)CCCCCC#N)ccc21 588147428 HTTKMUOGFOKNSN-UHFFFAOYSA-N 333.435 5.227 30 20 EKED C=C(C)COc1cccc(NC(=O)c2occc2-c2ccccc2)c1 589552952 QQSICFDHCMOELI-UHFFFAOYSA-N 333.387 5.154 30 20 EKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)CC1 590353830 BIPFUTXGBQDKLT-UHFFFAOYSA-N 345.229 5.293 30 20 EKED Cc1cc(C)cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603967925 CIUGZLNFNLGKHK-UHFFFAOYSA-N 332.428 5.156 30 20 EKED Cc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(CC#N)cc1 611149782 TXYJLBOIAJVTEX-UHFFFAOYSA-N 342.398 5.106 30 20 EKED O=C(/C=C\c1csc2ccccc12)c1c(Cl)nc2ccccn12 737445579 AZTAASRZGXRWCN-HJWRWDBZSA-N 338.819 5.099 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCc3c(C)ccc(C)c32)c1 769962467 IKNQPYPOGLEDNZ-KNQAVFIVSA-N 348.490 5.152 30 20 EKED Fc1ccc(C=NOCc2nc(-c3ccccc3Cl)cs2)cc1 774726352 OYIHEDYAGHISOV-UHFFFAOYSA-N 346.814 5.153 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(C)s1 789448997 AWMVKECDFLPMOU-OAHLLOKOSA-N 342.508 5.791 30 20 EKED N#Cc1sc(N[C@@H](Cc2ccccc2)c2cccs2)nc1Cl 804462072 DCOLNSWLTLXRKA-LBPRGKRZSA-N 345.880 5.126 30 20 EKED CC(C)(C)c1cc(NC(=O)c2ccsc2C(F)F)c(C#N)s1 904052393 PAVIRICTFCRTDM-UHFFFAOYSA-N 340.420 5.169 30 20 EKED Clc1ccc(C=NOCc2coc(-c3cccc(Cl)c3)n2)cc1 914571804 IIJWSFFIRJKJKS-UHFFFAOYSA-N 347.201 5.199 30 20 EKED CCCCCCCCSc1nnc(-c2cccnc2)n1C1CC1 915793286 OXDJGHXUHIIJCI-UHFFFAOYSA-N 330.501 5.128 30 20 EKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(N2CCCCC2)cc1 916154222 CQYZUABALJACDQ-QPEQYQDCSA-N 342.442 5.121 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc(CCC#N)cc1 932579176 KWWJAQGMPSKGRL-HXUWFJFHSA-N 335.451 5.148 30 20 EKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2ccc3ccccc3c2)CC1 1776168024 PJTSZTVITVBHIV-KRWDZBQOSA-N 337.463 5.034 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(F)c(C(=O)O)c(F)c2)cc1 1776700020 PBTPUBUMCOTWBB-KFRNIWOLSA-N 344.357 5.073 30 20 EKED CSc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 108981203 DCAREOBSRLPISH-ZDUSSCGKSA-N 342.489 5.055 30 20 EKED Cc1ccc(-c2nnc(SCc3ccccc3C(C)(C)C#N)o2)cc1 133539368 PECBZHHEQHLZGG-UHFFFAOYSA-N 349.459 5.139 30 20 EKED C[C@H](S[C@H](C)c1nc(Cc2ccccc2)no1)c1ccc(C#N)cc1 173829731 JBUALKHNTDVZJW-LSDHHAIUSA-N 349.459 5.087 30 20 EKED Cc1ccccc1[C@@H](NCc1cccc(OCCCC#N)c1)C(C)C 236791715 IUIJUPIRXINWQP-QFIPXVFZSA-N 336.479 5.165 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 410369784 BPSNJNKRJKULQE-UHFFFAOYSA-N 344.414 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)C[C@H]1C 433111776 WUJGKFKYVIXDFJ-MRXNPFEDSA-N 326.484 5.335 30 20 EKED Cc1cccc(Cl)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455160852 PAYMGVDSNUSIEL-KRWDZBQOSA-N 341.842 5.205 30 20 EKED CC(C)CC1(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CCC1 465457276 DFFVLNMYDUTOHK-HNNXBMFYSA-N 330.497 5.093 30 20 EKED CCC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCCC1 473828234 XASDCTNUWLFUKE-HNNXBMFYSA-N 345.512 5.173 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(F)c(C)c1 476093531 YIZLHPYDAFCCCE-UHFFFAOYSA-N 325.427 5.547 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(OCc2cccc(C)c2)c1 523031407 JVZJMELRXSSCBV-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C=CCC[C@H](N[C@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 540149467 PNVCWXVCIJXNKT-BEFAXECRSA-N 348.412 5.767 30 20 EKED CC(C)(CCC#N)CNC(=O)c1ccc(-c2ccc(Cl)cc2)s1 553752097 HFWBQMVFAQQXQZ-UHFFFAOYSA-N 346.883 5.128 30 20 EKED CSc1cc(NCc2cccc(OCCCC#N)c2)ccc1C 593691886 SZYTWIURBBKNPZ-UHFFFAOYSA-N 326.465 5.012 30 20 EKED Cc1ccc(NC(=O)c2cccc(Oc3cccc(F)c3C#N)c2)cc1 608974248 MQZPYPULTTXGBV-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC(F)(F)CC1 626534522 PASRGKIWMAOHEI-UHFFFAOYSA-N 336.426 5.192 30 20 EKED CC[C@H](C)Oc1cc(/C=C2/CCc3sccc3C2=O)ccc1OC 726892084 LCXNRRWBMAELKN-WZMONFQBSA-N 342.460 5.147 30 20 EKED O=C(/C=C\C1=Cc2ccccc2OC1)c1nc(-c2ccccc2)cs1 730086307 ZQFHOENUSFAHGA-KHPPLWFESA-N 345.423 5.025 30 20 EKED CSc1ccc2c(c1)CC/C(=C\c1ccc3ncccc3c1)C2=O 748146264 HAZYUSHJAVXKRL-SFQUDFHCSA-N 331.440 5.169 30 20 EKED CSc1ccc(C(=O)/C=C/c2coc(-c3ccccc3)n2)cc1F 749893316 GGOVPJBTMBEZHR-CMDGGOBGSA-N 339.391 5.099 30 20 EKED C=CC[C@H](N[C@H](CC)c1cccc(Br)c1)c1ccncc1 766022581 XGVJHQDQEGAARV-MSOLQXFVSA-N 345.284 5.202 30 20 EKED CCSc1cccc(/C=C/C(=O)c2c(C)nn(C(C)C)c2C)c1 769742783 PXAQVRLIRMKFMK-ZHACJKMWSA-N 328.481 5.089 30 20 EKED C=CC[C@@H](N[C@H](C)c1oc2ccc(C)cc2c1CC)c1ccncc1 776155185 CZISIXOYRKVTIM-OXQOHEQNSA-N 334.463 5.667 30 20 EKED C[C@@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1cc(C#N)ccn1 902993868 XRXBGAWREGSIRG-ZMZPIMSZSA-N 346.261 5.062 30 20 EKED CC[C@H](c1ccccc1)c1nnc(SCC2CCC(C#N)CC2)o1 916908975 WKMQKTSKZPTKIR-VMBOVVBDSA-N 341.480 5.034 30 20 EKED O=C(O)c1cccc(NN=C2CCC[C@H](c3cccc(Cl)c3)C2)c1 1776037334 AXKABDZJPGFZSQ-AWEZNQCLSA-N 342.826 5.164 30 20 EKED Cc1ccc(-c2ccsc2C(=O)Nc2ccc(CC#N)cc2)cc1 15818079 ZYMZVAOYJMSUKS-UHFFFAOYSA-N 332.428 5.042 30 20 EKED CC(=C/c1ccccc1)/C=C1/S/C(=N/c2c(C)cccc2C)NC1=O 58602364 YCOIRFLWZUWTIH-FGFUYGETSA-N 348.471 5.141 30 20 EKED C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 118172202 BCSABCRVGOHYHV-LLVKDONJSA-N 341.823 5.115 30 20 EKED Cc1cc(C)c(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)c(C)c1 118177009 UXMNKGHKMIGYQN-HNNXBMFYSA-N 349.459 5.387 30 20 EKED Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(Cl)c1 191607534 YGDXKWYEGPINAS-ZDUSSCGKSA-N 344.867 5.295 30 20 EKED N#CCN(C(=O)c1cc2sc3ccccc3c2s1)c1ccccc1 215739439 KFRKLIJARIBOFY-UHFFFAOYSA-N 348.452 5.286 30 20 EKED C[C@H]1C[C@@H](C(O)=Nc2cccc(COC3CCCCC3)c2)CCC1=O 328954130 MTEJYRCVEUKXIC-RDJZCZTQSA-N 343.467 5.129 30 20 EKED CCc1nc2c(s1)[C@@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340448366 RSTARFZBMXNRDX-IRXDYDNUSA-N 339.508 5.108 30 20 EKED CC(C)c1cccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431467875 AWHBETHSPWROSU-OAQYLSRUSA-N 349.478 5.044 30 20 EKED CCc1cccc(CC)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 432740368 AMQALIRRELDOMV-HXUWFJFHSA-N 349.478 5.368 30 20 EKED N#Cc1ccc(Cl)cc1N[C@@H]1CCCc2cn(C3CCCC3)nc21 445602456 UXCQZNGHVFRZBH-QGZVFWFLSA-N 340.858 5.013 30 20 EKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 461922641 NOXQIKSWIIEKBX-JKSUJKDBSA-N 346.430 5.018 30 20 EKED CCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 486754929 NRQSBOZNPKTOPP-KRWDZBQOSA-N 338.838 5.124 30 20 EKED N#CCc1ccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 546781749 YQHSYSXLNXJFGQ-UHFFFAOYSA-N 349.415 5.001 30 20 EKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nccc4ccccc34)cc2c1 562177209 KSMGMTACCNAOSY-QGZVFWFLSA-N 342.423 5.248 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2o1 614439795 KHUWCQGDJWVHJO-SFHVURJKSA-N 344.414 5.366 30 20 EKED C[C@@H](c1ccccc1)c1ccc(OCCCC2(C#N)CCOCC2)cc1 619622556 IEZFBDFZRHSFNH-IBGZPJMESA-N 349.474 5.318 30 20 EKED Cc1ccc(C)c(C(=O)/C=C\c2csc(-c3cccs3)n2)c1 728440020 RLBHCLMVHXPHCO-FPLPWBNLSA-N 325.458 5.385 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C\c2nccc3ccccc23)cc1 740765657 MEWJVYPKQFQCGW-QXMHVHEDSA-N 333.456 5.631 30 20 EKED O=C1/C(=C\c2coc(-c3ccccc3)n2)[C@H]2CCCc3cccc1c32 763290645 RROBSYBSGFBJDD-UEXNTNOUSA-N 327.383 5.041 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCC[Si](C)(C)C 847476484 BQLUNDUGAXQFAV-AWEZNQCLSA-N 334.561 5.138 30 20 EKED CCCCc1oc2ccccc2c1/C=C\C(=O)c1cccc(C(=O)O)c1 1776807941 DNLDSJBRXVAUOI-SEYXRHQNSA-N 348.398 5.370 30 20 EKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Cl)cc1 7276827 SDPNILXKLKNDOZ-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C[C@H](N[C@@H](C)c1ccc2ccccc2c1)c1ccc(OCC#N)cc1 171982317 AXAUIYMVDKTZBG-IRXDYDNUSA-N 330.431 5.154 30 20 EKED CCCCCCCC[S@](=O)Cc1csc(-c2ccoc2)n1 190794538 HXDRLICJQDTWBE-NRFANRHFSA-N 325.499 5.012 30 20 EKED CCc1c(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)oc2ccccc12 208263361 LRZFEOGIQZFJMJ-VSKPTYQZSA-N 345.398 5.182 30 20 EKED C[C@@H]1Sc2ccc(/C(O)=N/[C@@H]3CC[C@@H]4CCC[C@@H]4C3)cc2N=C1O 329536997 BIWKIVRFPKZGCN-RMRHIDDWSA-N 344.480 5.042 30 20 EKED CCc1ccc([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 329993064 KZQNHYUWOOYNAT-YCMKEVRSSA-N 342.483 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(C)c(C)cc2o1 476122353 QXPZFSNBECCBMS-UHFFFAOYSA-N 347.458 6.154 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 513436833 KCLMRXQCEGOFMJ-RDJZCZTQSA-N 344.524 5.626 30 20 EKED C=C[C@H](CC(=O)N(Cc1cscn1)c1ccccc1)c1ccccc1 535472915 YAUQDGJDQYIOPY-QGZVFWFLSA-N 348.471 5.036 30 20 EKED CC(C)Oc1cccc([C@@H](N[C@@H](C)c2cccc(C#N)c2)C(F)F)c1 585725927 FMORWLQLECFYBN-IFXJQAMLSA-N 344.405 5.002 30 20 EKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 619755666 OXRQLJROMCICNU-OAHLLOKOSA-N 347.849 5.124 30 20 EKED CC(C)c1nc(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)cs1 726495899 VXKZCHFBMAKNLQ-UHFFFAOYSA-N 348.427 5.024 30 20 EKED CCCCCCCCC(=O)Nc1cccc(SC(=O)N(C)C)c1 731417521 SCBUUBKSWJUJKY-UHFFFAOYSA-N 336.501 5.149 30 20 EKED CC(C)n1cc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cn1 732714701 XAFFXPUXKYZLAZ-BAQGIRSFSA-N 340.423 5.228 30 20 EKED C[C@@H](C#N)Oc1ccccc1N[C@@H]1CC=C(c2ccc(F)cc2)CC1 780746296 YNHNYBAJKDSCLT-HNAYVOBHSA-N 336.410 5.165 30 20 EKED CC1(C)CC[C@@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 781618738 YYORRPNNVXDZMD-QUCCMNQESA-N 332.447 5.107 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1ccc(-c2ccncc2)cc1 782888987 AUXPHYVIYOYFLQ-HJWRWDBZSA-N 336.394 5.193 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC(n2cncc2C)CC1 793849127 IENYWGTVNQBTFH-SFHVURJKSA-N 347.547 5.132 30 20 EKED CC(C)c1[nH]ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 795205934 SCVGMIHLXXZWHU-FQEVSTJZSA-N 343.430 5.046 30 20 EKED CC(C)(C)c1ccc(C=NOCc2ncc(-c3ccccc3)o2)cc1 849383466 JADBGEATZCOXDV-UHFFFAOYSA-N 334.419 5.190 30 20 EKED Cc1cc(C)cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915087799 XRQXXESWNIBYTQ-QFIPXVFZSA-N 340.426 5.211 30 20 EKED O=C(/C=C\c1cccc(O)c1)c1ccc2ccccc2c1OC(F)F 916140484 WRGNCPXQRMFYRB-FLIBITNWSA-N 340.325 5.043 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(Cl)c1 97465042 ONBVHEBXATXBBB-ZDUSSCGKSA-N 332.806 5.335 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccccc1 188616346 JGCCOPUWTXRASQ-IBGZPJMESA-N 346.430 5.257 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(F)[C@@H](C)C1 290074654 CNEKIACLIPQZIE-AWEZNQCLSA-N 336.426 5.048 30 20 EKED C=CCCC(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 303221568 UZLXMNXMNXWOLG-UHFFFAOYSA-N 336.366 5.071 30 20 EKED CC[C@@H]1C[C@H](/C(O)=N/C2(Cc3ccccc3)CCCCC2)CC(O)=N1 329819137 XQKNTDPFUBTPAH-ZWKOTPCHSA-N 342.483 5.034 30 20 EKED CCC[C@@H](CC)SCC(=O)c1cn(CCC#N)c2ccccc12 477068128 NUVNQFHAFIWTRL-OAHLLOKOSA-N 328.481 5.050 30 20 EKED CC(C)(C#N)CCCN1CC=C(c2ccccc2C(F)(F)F)CC1 477989257 LXHWPHHTADEBSW-UHFFFAOYSA-N 336.401 5.124 30 20 EKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(C)cc1 505030824 ZWEWREXCUWCXIM-OAQYLSRUSA-N 334.463 5.483 30 20 EKED C[C@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1F 512612818 QBJQNSYAODQCHC-BTDLBPIBSA-N 349.236 5.342 30 20 EKED CC(C)(C#N)CCCNc1cccc(Cl)c1SCC(F)F 531648071 QVPORAVHTRAZDV-UHFFFAOYSA-N 332.847 5.439 30 20 EKED CCC(C)(C)[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 596732807 OMBYRHCYUAVOPN-UONOGXRCSA-N 333.501 5.027 30 20 EKED C=CCCCCCN(C)C(=O)c1cnc(-c2ccc(C)cc2C)s1 606816875 UISZSSIAAUGOIV-UHFFFAOYSA-N 342.508 5.245 30 20 EKED N#Cc1ccsc1C(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 609757568 JZBQWGJNBKVXEV-INIZCTEOSA-N 344.867 5.031 30 20 EKED CCOc1ccc([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cc1 619508236 YNQKZYNDWUUTOR-KSFYIVLOSA-N 334.463 5.075 30 20 EKED N#Cc1ccc(CNC(c2ccccc2)c2ccccc2)cc1Cl 619755860 WQHRJFHYWMRYFS-UHFFFAOYSA-N 332.834 5.091 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cccc(C(C)C)c2)c1 727282511 AERCJPANCVPULI-UHFFFAOYSA-N 340.492 5.574 30 20 EKED CCCCCCCC(=O)N(Cc1cccc(C)c1)Cc1ccccn1 732761284 BQUPQFGEKCXIDS-UHFFFAOYSA-N 338.495 5.279 30 20 EKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1csc2ccccc12 734479701 XTSJFKOHKYZAFI-SNVBAGLBSA-N 347.365 5.360 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@@H]1c1cc(C)no1 737801422 CDCZOZBRWSBRRF-GPZRYRNASA-N 332.488 5.343 30 20 EKED CN(C(=S)Nc1ccccc1C#N)c1ccc(-c2ccccc2)cc1 743011336 QQKMWCSNKKKYJQ-UHFFFAOYSA-N 343.455 5.058 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 758417836 XFBAIMYATMLOQF-OAQYLSRUSA-N 330.431 5.049 30 20 EKED C=CC[C@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccncc1 760332251 YILLTESRLIXJFB-IRXDYDNUSA-N 333.262 5.283 30 20 EKED N#Cc1sc(N[C@@H]2CCc3c2ccc(Cl)c3Cl)nc1Cl 804454001 KMOFJFOIAUQZIJ-SECBINFHSA-N 344.654 5.074 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCO2 815636042 NXXHZCZSXUXOAG-RTWAWAEBSA-N 334.463 5.097 30 20 EKED CC1(C)CC[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762981 SCDZCESEWDZHHR-UONOGXRCSA-N 344.867 5.076 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)F)c(F)c1 935606044 GETXPUDHWJAXBD-UHFFFAOYSA-N 347.380 5.868 30 20 EKED CCC(C)(C)C1C/C(=C/c2cccnc2)C(=O)/C(=C/c2cccnc2)C1 16610052 XTMUEPLBFWCBOA-UHWBUFEVSA-N 346.474 5.359 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(N2CCCCC2)cc1 90665262 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20 EKED CC(C)N(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CCCC1 504402110 VWZQDXQIIPWLOO-UHFFFAOYSA-N 348.446 5.144 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(SCC)c1 506876672 QFRSDJNQGRRMQI-UHFFFAOYSA-N 326.465 5.019 30 20 EKED C[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1S[C@H](C)CC#N 510881505 WLFVXBQEMHEULX-JKSUJKDBSA-N 344.524 5.626 30 20 EKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519988469 UAOZRGDYNNKTAG-FQEVSTJZSA-N 349.434 5.003 30 20 EKED C=C(C)[C@@H](CC(=O)Nc1ccc(S[C@H](C)CC)cc1C)OCC 534425412 JHUFJEQXHUMZOO-CRAIPNDOSA-N 335.513 5.195 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(COC(C)(C)C)c1C 539456413 KTFQINKDOAINCK-OAHLLOKOSA-N 332.488 5.176 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C)c(Cl)cc1OC 547607645 MRBUCADTSDZIGG-UHFFFAOYSA-N 347.867 5.187 30 20 EKED C=C(C)[C@@H](N[C@H]1CCc2c1ccc(OC)c2F)c1ccc(F)c(F)c1 575158125 WPUROFXWUJFFAF-FXAWDEMLSA-N 347.380 5.007 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2cc3ccccc3o2)cc1Cl 589636340 ICHZOFMTUNFGQR-CQSZACIVSA-N 341.838 5.502 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1ccc(C#N)cc1 599024434 QFKJHIKULGZNIC-NWDGAFQWSA-N 336.332 5.128 30 20 EKED CC(C)Sc1cccc(Cl)c1CNCc1ccc(C#N)cc1F 619426266 LFNMPDGSXLKSTE-UHFFFAOYSA-N 348.874 5.141 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)cc1Cl 682803597 FOMWCUVJEOSAHN-UHFFFAOYSA-N 343.854 5.453 30 20 EKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 728764517 RYYQEQFJZPTEOR-WOJBJXKFSA-N 342.442 5.241 30 20 EKED Fc1c(Cl)cccc1NN=C(CC1CCCCC1)c1ncccn1 733901080 BDQCVXAHTLRCDP-UHFFFAOYSA-N 346.837 5.056 30 20 EKED CC(C)c1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1 741845598 ZDKNYNCWILRLBN-YVMONPNESA-N 330.840 5.069 30 20 EKED O=C(/C=C\c1ccc(Br)cc1Cl)c1cccs1 742429774 ZKUXUFDAUOQKOU-XQRVVYSFSA-N 327.630 5.060 30 20 EKED O=C(/C=C/c1cc(Cl)ccc1OC1CCCC1)c1cncc(F)c1 742433805 AEJGXBKZEKVLCN-FNORWQNLSA-N 345.801 5.092 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)s1 758432398 AFIOTIOURQKQCO-BQYQJAHWSA-N 334.444 5.225 30 20 EKED Cc1csc([C@@H](C#N)C(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)n1 773942093 ADDUSHUQZLEPRS-WMLOPIRWSA-N 342.508 5.015 30 20 EKED N#Cc1c(F)ccc(/C=C\C(=O)c2c(F)cccc2Cl)c1Cl 809159822 XJWDIDCHVWIBBG-ALCCZGGFSA-N 338.140 5.039 30 20 EKED N#Cc1c(F)ccc(/C=C/C(=O)c2c(F)cccc2Cl)c1Cl 809159823 XJWDIDCHVWIBBG-FNORWQNLSA-N 338.140 5.039 30 20 EKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C(F)=C/C2CCCCC2)s1 816068314 PLEFWPMFPDVUKY-GFAPJHNFSA-N 334.460 5.051 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)c1nc2ccccc2s1 835039982 MKAOETYEDVQSKB-BRWVUGGUSA-N 346.455 5.056 30 20 EKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 915087668 WLVSQLIEUPBPBG-JOCHJYFZSA-N 340.426 5.211 30 20 EKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(C)s3)cs2)c1 917045320 XUMOBNYQOVFHRH-FPLPWBNLSA-N 341.457 5.085 30 20 EKED C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(CCC#N)cc1 932560459 WZCSDQMFTOWSGW-AWEZNQCLSA-N 341.842 5.021 30 20 EKED CCCN(C(=O)c1cccc(SCC#N)c1)c1ccc(Cl)cc1 79474383 CNFBGDNLXXIUMM-UHFFFAOYSA-N 344.867 5.012 30 20 EKED CC[C@]1(C)CCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 173123083 VHDAPHPHXKHJGO-DNVCBOLYSA-N 345.512 5.125 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCCCCC#N 178644878 PTDBOQNEDGYNBF-GFCCVEGCSA-N 333.888 5.116 30 20 EKED Cc1ccc(C)c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 195664154 CGDNWBCOTJWEEE-CQSZACIVSA-N 340.835 5.057 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(SCC(F)(F)F)cc1 299737781 GUKWOHUTIHEIRO-SREVYHEPSA-N 343.395 5.002 30 20 EKED CC(C)c1nnc(C/N=C(/O)C2CCC(c3ccccc3)CC2)s1 329795154 GJNIQBDOJABOPP-UHFFFAOYSA-N 343.496 5.092 30 20 EKED CC(C)C1CCC(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CC1 330086756 MOKCNYHQPNYSOM-UHFFFAOYSA-N 348.531 5.331 30 20 EKED N#CCCC[C@@H](NCc1c(Cl)ccc2cccnc12)c1ccccc1 353918462 YFTVURVHGVWNQR-HXUWFJFHSA-N 349.865 5.413 30 20 EKED CC(C)c1ccccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 367209798 VRMJDKZUBURTDK-UHFFFAOYSA-N 345.446 5.003 30 20 EKED CC(C)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](C)c1ccsc1 421694161 UJPFASSSLZMHNW-FUHWJXTLSA-N 340.492 5.134 30 20 EKED Cc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 426015322 HCSCWPUOSWVXAU-OAHLLOKOSA-N 339.464 5.342 30 20 EKED Cc1ccc([C@H](C)N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1 438855118 ILUYQIPQHKBYJD-RXVVDRJESA-N 349.478 5.051 30 20 EKED C=C(C)[C@H](NCc1cnc(C2CCC2)s1)c1ccc(F)c(F)c1 479417115 SBXKVHSEJIEXKS-KRWDZBQOSA-N 334.435 5.096 30 20 EKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 510667550 PRSMBSBMDJSABN-INIZCTEOSA-N 349.434 5.004 30 20 EKED CCC(=O)c1ccc(Oc2ccc(C#N)c3ccccc23)c([N+](=O)[O-])c1 555271266 ACPXQLIOGNMINI-UHFFFAOYSA-N 346.342 5.005 30 20 EKED CCCOCc1ccccc1CNc1cccc(C(F)F)c1C#N 562128616 WALNOSXTUYSKPS-UHFFFAOYSA-N 330.378 5.035 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCSc3ccc(Cl)cc31)CC2 569413807 XOJPXPDOWKMINF-ZWKOTPCHSA-N 340.879 5.026 30 20 EKED N#Cc1cc(C(=O)Nc2cc(C(F)F)ccc2Cl)ccc1Cl 577678121 HZFHELRGJANIRK-UHFFFAOYSA-N 341.144 5.055 30 20 EKED Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H](C)c1cccc(C#N)c1 610830363 ODDHQIYBJLVTJN-OLZOCXBDSA-N 327.497 5.033 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccccc1COC(C)(C)CC 680491322 CAOJLEOTTCMFBU-INIZCTEOSA-N 332.488 5.258 30 20 EKED CC1CCN(c2ccc(N[C@H](C)c3ccc(C#N)c(F)c3)cc2)CC1 777613456 NSKAHLKSJWBQFT-MRXNPFEDSA-N 337.442 5.107 30 20 EKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1cc(Cl)ccc1Cl 804389873 NXVZCHUTDZCLPL-LURJTMIESA-N 332.643 5.148 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1cc(C(F)(F)F)co1 871825946 CXJYJUFLZRDUDI-LLVKDONJSA-N 340.370 5.305 30 20 EKED Cc1ccc(C)c(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1 920065469 YAYKWMCFJAFBIM-WAYWQWQTSA-N 325.458 5.385 30 20 EKED C[C@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)c1ccc(C#N)cc1 118172847 DORSHPJBJAYQCS-CABCVRRESA-N 349.459 5.141 30 20 EKED CCC(=O)Nc1ccc(C)c(N[C@H]2CCCCc3cc(C#N)ccc32)c1 481674615 VWDAIEVGVJQWMK-FQEVSTJZSA-N 347.462 5.095 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccc2nc(C)sc2c1 485457775 RRAYZAXVEFUQAA-UHFFFAOYSA-N 340.473 5.135 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C2CCC2)cc1 489763248 MMDFGEUHBWQUFU-UHFFFAOYSA-N 347.462 5.268 30 20 EKED C=CCN(C(=O)C[C@@H](C)CCC)c1nc(-c2ccccc2)cs1 499307296 MANOONCNMIHVEW-HNNXBMFYSA-N 328.481 5.155 30 20 EKED C[C@@H](N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1F 512612814 QBJQNSYAODQCHC-BMLIUANNSA-N 349.236 5.342 30 20 EKED Cc1ccc(Nc2ccccc2C(=O)Nc2ccc(CC#N)cc2)cc1 516201157 WZUJLNIYZSEJST-UHFFFAOYSA-N 341.414 5.057 30 20 EKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540127098 BXWZMTVDDVPLON-YJBOKZPZSA-N 349.434 5.145 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)NCc1ccc(CC#N)cc1 592254164 VPOQUNVJGPALPP-UHFFFAOYSA-N 349.478 5.150 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NCc1ccc(N(C)CCC#N)cc1 732820300 HVDNBXIEKMVHOP-QHCPKHFHSA-N 349.522 5.222 30 20 EKED CCCCCCCCC/C=C\C(=O)N1CCCC[C@@H]1c1ncc[nH]1 737821315 AHUPVSZGVBICJW-RXEWJAMOSA-N 331.504 5.160 30 20 EKED C#CCCCCC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1 773396370 JUYKCYQSHDLLGV-SFHVURJKSA-N 349.474 5.075 30 20 EKED N#Cc1cc(Cl)ccc1CSC1=Nc2ccccc2CS1 775172033 DIAAXCLZQWFQAR-UHFFFAOYSA-N 330.865 5.379 30 20 EKED Cc1cccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)C(C)(C)C)c1 776163482 RZTPYDCPSSRVIO-LAUBAEHRSA-N 336.479 5.335 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792101831 HCVNTSQTAFDVTI-UTKZUKDTSA-N 342.442 5.070 30 20 EKED Cc1cc(C#N)ccc1C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 155826128 POQZUGUANYUCDM-UHFFFAOYSA-N 348.352 5.064 30 20 EKED O=C1/C(=C/c2cccnc2Cl)CCC/C1=C\c1cccnc1Cl 171536449 MBFQUDXGLKJACY-DCIPZJNNSA-N 345.229 5.003 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1cccs1 303198863 NRYGINUWMIYBIL-CMDGGOBGSA-N 329.421 5.215 30 20 EKED Cc1cc(-c2noc(CSCCCCC(C)(C)C#N)n2)ccc1F 435880421 IXSQDYTWZKLAJB-UHFFFAOYSA-N 347.459 5.137 30 20 EKED CCc1ccc(N(C(=O)CCCC#N)c2nc3ccccc3s2)cc1 463070349 ZQFINNJRRAYXTN-UHFFFAOYSA-N 349.459 5.217 30 20 EKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccccc2F)cc1 464860816 XCPHCRBPCDSMPC-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CCN(Cc1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 507688320 NNJPSXWVLSPZGP-CQSZACIVSA-N 332.369 5.160 30 20 EKED C=C[C@@H](CC(=O)N(C)c1c(Cl)cccc1Cl)c1ccccc1 536790442 KENFVHRUMQAOEI-ZDUSSCGKSA-N 334.246 5.316 30 20 EKED CC(C)(NCc1cccc(C#N)c1F)c1ccc(Cl)c(Cl)c1 538149108 ZLHUOYBCYLANKG-UHFFFAOYSA-N 337.225 5.029 30 20 EKED CCCC(=CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)CCC 771260657 JJEAYRBVBFNJLS-LJQANCHMSA-N 348.446 5.014 30 20 EKED C#CC[C@@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccccc1 773116357 RIORVXIUZWSBBQ-OXJNMPFZSA-N 333.431 5.165 30 20 EKED CCCCCCCCCCC(C)(C)C(=O)N1CCC2(CCO2)CC1 800654521 WWYUQIDVAJDETJ-UHFFFAOYSA-N 337.548 5.325 30 20 EKED CCCCCCOc1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1 915224866 UVJHBGZLAKNCLX-GOSISDBHSA-N 336.479 5.368 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Br)c1 90664482 VSYSXZGPYQORBP-KDOFPFPSSA-N 343.268 5.145 30 20 EKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1cc2ccccc2o1 98024881 NCIMYKBBWQPCEJ-OAHLLOKOSA-N 347.418 5.114 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]2CCC[C@H]21 191504220 VOZSHBVDAZHLPA-QFBILLFUSA-N 326.484 5.335 30 20 EKED CCCC[C@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 289628315 PFGAQNOTHSDJGE-LSDHHAIUSA-N 333.501 5.123 30 20 EKED C=CCC[C@H](NCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 442902628 WVORNTIHUOVTIC-SFHVURJKSA-N 334.385 5.206 30 20 EKED C=CC[C@@H](C(=O)Nc1cc(C(=O)CC)ccc1Cl)c1ccccc1 471451203 KDLUPDWLKQCZTK-MRXNPFEDSA-N 341.838 5.231 30 20 EKED CC[C@H](C)[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Cl)cc1 498012557 BHERQVXBNDNBOX-YOEHRIQHSA-N 349.906 5.056 30 20 EKED N#C[C@@H](C(=O)c1cc2sccc2s1)c1nc2ccccc2s1 516465218 PPIDHUIKTLDFAA-VIFPVBQESA-N 340.454 5.063 30 20 EKED C=CCNC(=O)Nc1ccc(N[C@H](C)c2cccc3ccccc23)cc1 522157401 XVAXKPLIXKCEIX-MRXNPFEDSA-N 345.446 5.320 30 20 EKED CCC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550836525 RFTYXZOJXMCAJD-RTWAWAEBSA-N 340.898 6.206 30 20 EKED CC(C)Oc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 551530859 YDZRBXYZNSUUEB-GJZGRUSLSA-N 342.870 5.411 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCc4c(Cl)cc(Cl)cc43)CC2)c1 551812498 FNADYZXTUZNVSA-GOSISDBHSA-N 343.257 5.131 30 20 EKED N#CCCC[C@H](NCC1CCC(C(F)(F)F)CC1)c1ccccc1 556907937 HKUGKXJJRFYVRF-VJFUWPCTSA-N 338.417 5.380 30 20 EKED CC[C@@H](C)Oc1cc(/C=C2\CCc3sccc3C2=O)ccc1OC 726892079 LCXNRRWBMAELKN-WDGDVPDHSA-N 342.460 5.147 30 20 EKED CCOc1cccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)c1 727266782 FUIMFQJRFMGMHN-QXMHVHEDSA-N 335.428 5.105 30 20 EKED CCCCCCCCC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 734783353 PAYATUOHSZDXHC-LJQANCHMSA-N 344.543 5.079 30 20 EKED C[C@@H](CCc1ccc(Cl)s1)Nc1ccccc1O[C@H](C)C#N 780744659 LSZJHBRVMTYZJE-QWHCGFSZSA-N 334.872 5.126 30 20 EKED C#CCC1(C(=O)Nc2cccc(C(F)F)c2Cl)CCCCC1 788244421 VMMZQPKSFBEJLY-UHFFFAOYSA-N 325.786 5.190 30 20 EKED C=C(C)[C@@H](N[C@H]1COCc2cccc(Cl)c21)c1ccc(F)c(F)c1 788753029 HIRRJMPEWXNMJU-PKOBYXMFSA-N 349.808 5.097 30 20 EKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792094010 LNXLHBAWHLMNOA-NRFANRHFSA-N 342.442 5.167 30 20 EKED CC(C)c1occc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 794930206 DEADJUVVXARMOI-FQEVSTJZSA-N 344.414 5.311 30 20 EKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccnc(Cl)c1 811693523 KFWNJMGECZGXPL-PBDTWZTKSA-N 349.764 5.179 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(F)=C3CCCC3)n2)cc1 815910853 JTDOUNCREYMURK-HNNXBMFYSA-N 340.423 5.092 30 20 EKED CC[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(Cl)c1O 841760481 FNKDLJLFUMLADJ-RTBURBONSA-N 340.854 5.036 30 20 EKED C[C@@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1cc(C#N)ccn1 902993865 XRXBGAWREGSIRG-ADLMAVQZSA-N 346.261 5.062 30 20 EKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3ccncc3)ccc21 916136176 IRGKXFDNDDWKOY-NTMALXAHSA-N 326.399 5.106 30 20 EKED CCc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776974843 SFSANLTYJKTAGD-IZZDOVSWSA-N 346.382 5.103 30 20 EKED CSc1ccc2cc(COc3ccccc3C#N)c(Cl)nc2c1 4959238 LALARTWZZHJAPJ-UHFFFAOYSA-N 340.835 5.061 30 20 EKED CCC(C)(C)C1CCC2(CC1)C[C@@H]2/C(O)=N/[C@@H]1CCC(O)=N[C@@H]1C 329113121 RSGRIJAMJCIXOL-OKLHXDLCSA-N 334.504 5.083 30 20 EKED Cc1cc(CNc2ccc(-c3ncc(C(C)C)o3)cc2)ccc1C#N 444004358 XJWMRCOKKJQVEE-UHFFFAOYSA-N 331.419 5.257 30 20 EKED COc1ccc2oc([C@@H](C)NCCCCC(C)(C)C#N)c(C)c2c1 444688538 ZPPCSWNWISQXQR-OAHLLOKOSA-N 328.456 5.121 30 20 EKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 464567128 GRMFLOWWQZDPET-IAGOWNOFSA-N 327.493 5.440 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 466656981 XWZVAVTVWYANFG-STQMWFEESA-N 346.471 5.037 30 20 EKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1cc(Cl)cc(Cl)c1 476041330 NSYBJLOBKWBGKD-UHFFFAOYSA-N 347.245 5.071 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(OC)cc1F)c1ccc(F)c(F)c1 480659098 MGLFBYIBXRFEBA-BUXKBTBVSA-N 335.369 5.081 30 20 EKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)cc1Cl 483439878 LKVVAVLJPGMFBG-ZDUSSCGKSA-N 340.835 5.057 30 20 EKED C[C@@H](CC1CCCCC1)C(=O)N[C@H](CCCC#N)c1ccccc1 487156034 LSYDUUKKMHVRJW-FXAWDEMLSA-N 326.484 5.144 30 20 EKED C[C@@H](c1ccccc1Cl)N(Cc1cc(C#N)ccc1F)C1CC1 517901843 VAZVBBCELUCCPI-ZDUSSCGKSA-N 328.818 5.076 30 20 EKED C=C(C)COc1cc(CN[C@H](c2ccccc2)C(C)C)ccc1OC 521821389 OIFWCHKOCMFIJR-QFIPXVFZSA-N 339.479 5.137 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccsc1 523088758 ZUZZUFAQYDBJGV-AWEZNQCLSA-N 348.427 5.154 30 20 EKED C=CCC[C@@H](NCc1ncc(-c2ccc(C)cc2)o1)c1ccccc1 538256577 QZJZJUPRLDXHQI-HXUWFJFHSA-N 332.447 5.447 30 20 EKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1nc(-c2ccccc2)cs1 564428797 YHSSMDFQMYHNSO-KUHUBIRLSA-N 345.471 5.020 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCCCC1(C)C 574873020 RWIQVAWNLSFRCE-HUUCEWRRSA-N 330.497 5.236 30 20 EKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(F)cc2)c1 589740795 ADWSIPWQBARSID-HNNXBMFYSA-N 342.414 5.006 30 20 EKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccsc1 619747810 AQOPPDJRHFTHHS-INIZCTEOSA-N 348.471 5.050 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)c1ccccc1 671298260 LMLNIIMMVASBLU-KSSFIOAISA-N 330.859 5.102 30 20 EKED CCN(CCC#N)C(=O)c1sc2cc(C(C)C)ccc2c1Cl 732678991 RBXPDYLWXVMOLV-UHFFFAOYSA-N 334.872 5.054 30 20 EKED C=CCCC(=O)O[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753365360 UDQPHBQWYNKUFL-JTQLQIEISA-N 340.206 5.219 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792099395 IAUQQQPHVDUKTL-ICSRJNTNSA-N 334.463 5.408 30 20 EKED CCCCCCCC(=O)N[C@H](c1ccccc1)c1ccc2nc[nH]c2c1 887332083 SGCSPRGDYXLPDZ-JOCHJYFZSA-N 349.478 5.129 30 20 EKED N#Cc1ccc(CN(Cc2cccs2)Cc2cccs2)c(F)c1 11469646 DQSQTWGJBSEEFF-UHFFFAOYSA-N 342.464 5.023 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCc2cccc(C#N)c2)cc1 174526181 BSIIOUYCZHCJIN-QGZVFWFLSA-N 342.442 5.085 30 20 EKED C=CCC[C@@H](NCc1csc([C@H](C)OCC)n1)c1ccccc1 180043932 IMRWZQLCYGFCHD-MAUKXSAKSA-N 330.497 5.038 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc([N+](=O)[O-])cc1C 189877598 XUPXOVZTDJQJDF-UHFFFAOYSA-N 338.407 5.007 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2n1 340457892 WMMKOCJRSUFGGO-UWJYYQICSA-N 329.447 5.321 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(C)ccc1Br 410346923 XSOGALOXXXARDT-UHFFFAOYSA-N 344.252 5.128 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)C[C@@H]1C 433111775 WUJGKFKYVIXDFJ-INIZCTEOSA-N 326.484 5.335 30 20 EKED CC(C)c1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 437554600 GTQGTUFNLQODRE-LEWJYISDSA-N 347.462 5.114 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 447593539 SQDYCNGTFDGZAQ-BXUZGUMPSA-N 349.297 5.184 30 20 EKED N#CC1(CCCSc2ccc(Cl)cc2Cl)CCOCC1 451036855 GYOXZBURPNHZRR-UHFFFAOYSA-N 330.280 5.186 30 20 EKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 467611047 QKWJYKUIBZVQGY-CRAIPNDOSA-N 349.434 5.003 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3ccccc3)cc2)n1 474443303 COUXNJCDPGVUBZ-SFHVURJKSA-N 346.455 5.424 30 20 EKED C=CCCCC(=O)N(C1CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 481155572 LJJJFENNDIFAAU-ZDUSSCGKSA-N 325.374 5.114 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1C 509736211 QUPRMHAOPGJARE-JKSUJKDBSA-N 349.434 5.003 30 20 EKED N#Cc1ccc(NCc2nc3cc(Cl)ccc3s2)cc1Cl 518901354 JFMKASQQFAYDJV-UHFFFAOYSA-N 334.231 5.087 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N(CC1CCC1)[C@@H](C)c1ccccc1 531320004 TZXAMUCQDILADE-KRWDZBQOSA-N 347.462 5.262 30 20 EKED C=C(C)[C@H](CC(=O)Nc1ccc(S[C@@H](C)CC)cc1C)OCC 534425415 JHUFJEQXHUMZOO-YJBOKZPZSA-N 335.513 5.195 30 20 EKED C=CCC[C@@H](NCc1csc(Cc2ccccc2)n1)c1ccccc1 538258439 YNNPUASAOKNAKM-OAQYLSRUSA-N 348.515 5.531 30 20 EKED Cc1ccc(CN[C@@H](C)c2ccc(C#N)c(F)c2)c(OC(C)(C)C)c1 538509742 OHMNPZOHABSGDS-HNNXBMFYSA-N 340.442 5.034 30 20 EKED N#CCc1ccc(NCc2csc(-c3ccc(Cl)cc3)n2)cc1 544726540 UIIZDZCLHPVDHH-UHFFFAOYSA-N 339.851 5.142 30 20 EKED N#Cc1ccccc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 576306207 SJOJGGOSDYQSSD-UHFFFAOYSA-N 349.393 5.026 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(C)coc1C 583090471 SNSGIMJGPFXUGH-UHFFFAOYSA-N 346.386 5.121 30 20 EKED N#CCCCCCC(=O)N1CCC(c2cccc3ccccc23)CC1 588154907 FTPJWPXUZZJVPB-UHFFFAOYSA-N 334.463 5.020 30 20 EKED CCN(C(=O)CCCCCC#N)[C@@H](C)c1cccc(C(F)(F)F)c1 588327760 KNVXBRRQGWYRPO-AWEZNQCLSA-N 340.389 5.089 30 20 EKED CC(C)c1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)cc1 589071163 YUHRJRHIAZRHIH-IBGZPJMESA-N 331.419 5.100 30 20 EKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1cccc(C#N)c1 610009964 LGTRINPBFYDVLS-IBGZPJMESA-N 342.870 5.097 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1cnc(C(C)(C)C)s1 742437327 STUPRMVTRHVDDV-SZUMLMDFSA-N 335.519 5.263 30 20 EKED N#Cc1ccc(-c2cccc(CNCc3cscc3Cl)c2)s1 771960051 QIYMUYBACQIMTE-UHFFFAOYSA-N 344.892 5.291 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1ccc2ccccc2n1 796744948 CPPREINIBKFZKN-KANFNMMFSA-N 332.447 5.018 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3CC(C)(C)C3)n2)cc1 796765972 WCDDZUYCIQWGDL-MRXNPFEDSA-N 338.476 5.121 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1CC1(Cl)Cl 834314919 SCTVGSJQIWJSKO-CQSZACIVSA-N 340.294 5.451 30 20 EKED FC(F)(F)c1ccc(CNN=Cc2c(Cl)cccc2Cl)cc1 915971833 BNDRFJVKNMBUHR-UHFFFAOYSA-N 347.167 5.136 30 20 EKED COc1cc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)ccc1O 916141470 BDVZKWYBMQNWLT-NTUHNPAUSA-N 346.382 5.089 30 20 EKED N#Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)c(C2CC2)c1 933844310 SAXIKGRAKHRNMF-LJQANCHMSA-N 349.434 5.178 30 20 EKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(C2CCC2)cc1 1776034715 VKTRDKUKKXLRFF-UHFFFAOYSA-N 342.826 5.142 30 20 EKED O=C(O)c1ccc(F)c(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c1 1776131006 DIFJLOHDVKTTKI-ACCUITESSA-N 346.357 5.087 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCC1CCC(C(C)(C)C)CC1 1776783283 MFCZQWBBSNOSOZ-ACBHZAAOSA-N 339.564 5.632 30 20 EKED CCCCCCn1c(S[C@H](C)C#N)nnc1-c1ccc(Cl)cc1 60382871 ZCSBYIFERXGPTO-CYBMUJFWSA-N 348.903 5.183 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(Cl)c1 97465043 ONBVHEBXATXBBB-CYBMUJFWSA-N 332.806 5.335 30 20 EKED Cc1nnc(-c2cccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)c2)o1 329168469 JCBMPDLEEMCBRZ-ZTFGCOKTSA-N 339.439 5.240 30 20 EKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 474425048 ICCYYYONIWTMJQ-FQEVSTJZSA-N 340.426 5.380 30 20 EKED CC(C)Sc1cccc(Cl)c1CNCc1cccc(C#N)c1 474468000 CZBFBFPTAFRDFW-UHFFFAOYSA-N 330.884 5.002 30 20 EKED C=C(C)[C@@H](N[C@H](CC)c1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480692038 FKNYLEDFKJXSIK-RTBURBONSA-N 346.377 5.231 30 20 EKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(F)ccc1F 539626731 FIAHWFLXKFHOTO-LJQANCHMSA-N 330.378 5.211 30 20 EKED CC(C)[C@H](NCc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)cc1 544120181 ITDYOZFEQSLCRZ-IBGZPJMESA-N 346.396 5.258 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4F)s3)CC2)c1 551227585 MLNMNYKQOWBMJK-UHFFFAOYSA-N 348.446 5.205 30 20 EKED Cc1ccc(C[C@H](C#N)SC2CCC(C(F)(F)F)CC2)cc1 567859656 KATVJAINMGVMRQ-UYSNPLJNSA-N 327.415 5.284 30 20 EKED Cc1c(C(=O)N2CCC(CCC#N)CC2)oc2c1ccc1ccccc12 569976670 TUPDXPVYTWFOQJ-UHFFFAOYSA-N 346.430 5.050 30 20 EKED CCc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)s1 727264882 YYVLBQKPKJEZKW-NTMALXAHSA-N 325.458 5.330 30 20 EKED Cc1cccc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744364108 ZVCRVAQZEJCHGN-NRFANRHFSA-N 340.426 5.211 30 20 EKED C=CCC[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1 778597970 HHULOCSKPXNHOD-DLBZAZTESA-N 346.455 5.223 30 20 EKED CC(C)c1ccc(/C=C/CC(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780166397 XAGHSXJVWMDRMK-DKRLNXSXSA-N 348.446 5.143 30 20 EKED C[C@@H](CC(=O)OCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 783656308 WNJSDVJDBSSEQH-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED C=C(C)[C@H](N[C@H]1COCc2cccc(Cl)c21)c1ccc(F)c(F)c1 788753018 HIRRJMPEWXNMJU-HKUYNNGSSA-N 349.808 5.097 30 20 EKED O=C1/C(=C\c2cocn2)CCCCCCCCC/C1=C/c1cocn1 790212282 SSJBFPMOPJXQQE-APGQMXJTSA-N 340.423 5.223 30 20 EKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)CCCCCC#N 805176975 RBNCGEVTDUCZJQ-UHFFFAOYSA-N 340.854 5.728 30 20 EKED O=C(/C=C\c1cccc(-c2ccccn2)c1)c1c(F)cccc1Cl 809159766 WFXYQXNCUUUBSR-KHPPLWFESA-N 337.781 5.437 30 20 EKED CCCCCCN(C(=O)CCCCC#N)c1nc2ccccc2s1 846768505 MHBAWXRYJNLFDV-UHFFFAOYSA-N 343.496 5.294 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1C 916850002 XSOXAPCRZRIFCF-WAEYIKQSSA-N 340.426 5.050 30 20 EKED CCCCCCCC(=O)N1CCC[C@H]1c1nc2ccccc2s1 104983982 MGTRSGZJVKEBIL-INIZCTEOSA-N 330.497 5.320 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1cccc(-c2cccnc2)c1 128979490 UAHGKHVCTYCPHH-ZHACJKMWSA-N 345.446 5.039 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc2ccccc2c1)c1ccccc1 352216394 HNVSIHBRGMLBGB-NRFANRHFSA-N 328.415 5.005 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 358329205 OVOOUKZDLLJECQ-GCJKJVERSA-N 331.463 5.230 30 20 EKED C[C@H]1CCc2sc(NC(=O)c3ccoc3C3CC3)c(C#N)c2[C@@H]1C 410978388 CVYJWNCUCOROET-WDEREUQCSA-N 340.448 5.028 30 20 EKED C=CC[C@H]1N(C(=O)c2cccc(-c3cscn3)c2)CCCC1(C)C 443870497 SNMQATNQZPOLGQ-GOSISDBHSA-N 340.492 5.017 30 20 EKED C=CCC[C@H](N[C@@H]1C[C@@H](C)n2ccnc21)c1ccc(C(F)(F)F)cc1 453175635 QIGBBUJGSQYYTF-XOKHGSTOSA-N 349.400 5.205 30 20 EKED C=CCOc1ccc(CNCc2ccc(C(F)F)cc2)cc1Cl 462653562 IIKQTMHJPGWKJS-UHFFFAOYSA-N 337.797 5.132 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2ccsc12 476121123 MREAYTDJPZGVNK-UHFFFAOYSA-N 335.472 6.006 30 20 EKED C[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487156035 LSYDUUKKMHVRJW-PXNSSMCTSA-N 326.484 5.144 30 20 EKED Cc1cc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)sc1Br 512106619 OTTOTKQFCXTOOU-NEPJUHHUSA-N 349.297 5.103 30 20 EKED CC(C)COc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512641120 DKHBLPDKGPEODG-CVEARBPZSA-N 340.442 5.144 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(OCc2cccc(C)c2)c1 523622263 WURWYZHISCKQQX-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2c1ccn2C 530458070 ANGCXCPUBWZSBI-UHFFFAOYSA-N 332.447 5.283 30 20 EKED C[C@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2ccccc2)o1 541173243 OFGAOWHXHZJAJI-NSHDSACASA-N 341.823 5.115 30 20 EKED Cc1cccc2sc(C(=O)N[C@H](C#N)C3CCCCC3)c(Cl)c12 610502316 IVZSSMVGLIIXHQ-CYBMUJFWSA-N 346.883 5.065 30 20 EKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 614178893 HLIIXYGJEOGCGW-IBGZPJMESA-N 328.406 5.007 30 20 EKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Cl)cc(Cl)c1 618801383 ASLKPFRAFKAOBJ-ZMZPIMSZSA-N 331.246 5.203 30 20 EKED CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)s1 619755315 WZNQOQDOGQDTJU-CYBMUJFWSA-N 325.264 5.167 30 20 EKED O=C(/C=C/C1=Cc2ccccc2OC1)c1c[nH]c2cc(Cl)ccc12 726743360 FCLYKWYUTFWLEE-VMPITWQZSA-N 335.790 5.036 30 20 EKED Clc1ccc(Cl)c(C=NNCCCc2ccccc2)c1Cl 729146360 UARFARGUXFCXAK-UHFFFAOYSA-N 341.669 5.203 30 20 EKED CC(=NNc1ccc(C)nn1)c1ccc(-c2ccccc2Cl)s1 729935729 MDXWKOLNBSODOL-UHFFFAOYSA-N 342.855 5.003 30 20 EKED CCCN(C(=S)Nc1ccccc1C#N)[C@H](CC)c1ccccc1 745678182 FQNROUSBAXNXIH-LJQANCHMSA-N 337.492 5.118 30 20 EKED CC(C)Oc1ccccc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745990498 QVESCJSQBQRIHP-QXMHVHEDSA-N 343.426 5.432 30 20 EKED Oc1nc2ccccc2cc1C=Nc1cccc(C(F)F)c1Cl 753997003 ZOFDIFCFSDVPNA-UHFFFAOYSA-N 332.737 5.282 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccs1 810194972 RMKVEYPSZZFPAZ-VQHVLOKHSA-N 341.413 5.281 30 20 EKED CC(C)(C)C1CCC(C=NNc2ccc(Cl)c(C(=O)O)c2)CC1 1776033714 VYLFEBCVXDXMFU-UHFFFAOYSA-N 336.863 5.288 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccsc1 1776784604 PEYXVOQNICOPRJ-QGZVFWFLSA-N 325.518 5.336 30 20 EKED C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(OCC#N)cc1 182337208 TVQVSGMBELXELL-CQSZACIVSA-N 348.368 5.257 30 20 EKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 467610637 LVQITKFVGCZZDF-CRAIPNDOSA-N 349.434 5.003 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 471177497 NWGVLEYCKORDLR-UHFFFAOYSA-N 347.462 5.098 30 20 EKED CCN(C(=O)C[C@@H](C)C1CCCCC1)[C@H](C)c1ccc(C#N)cc1 508941054 HBKQWMQZXXSUQF-IAGOWNOFSA-N 326.484 5.074 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CC1CCCC1 510863369 BWODGQWESCDQKZ-GJZGRUSLSA-N 330.497 5.093 30 20 EKED Cc1cc(C)cc(N(C)C(=O)c2ccccc2-c2ccccc2C#N)c1 512680319 MKDKOLKSGIGHEX-UHFFFAOYSA-N 340.426 5.119 30 20 EKED Cc1ccc(F)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 539788427 INWUMFJUQSTOGI-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(OC)cc1C(F)(F)F)c1ccccc1 550532863 BUSZWIPNYZPXBP-CYBMUJFWSA-N 349.352 5.012 30 20 EKED C[C@@H]1CCCCN1Cc1ccc(N[C@@H]2CCc3ccc(C#N)cc32)cc1 571333806 KPJKFDXPGIINKR-UZUQRXQVSA-N 345.490 5.032 30 20 EKED CC1=C(C)C[C@@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 581192294 KUTOSUSOSJBLTC-CVEARBPZSA-N 328.481 5.156 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H](c1cccnc1)C1CCCCC1 611391844 BKPNYWAQCAJMAA-GOTSBHOMSA-N 345.490 5.242 30 20 EKED CCSc1ccc(Cl)cc1NC(=S)Nc1ccccc1C#N 729161365 AFAUINMLEFBJHQ-UHFFFAOYSA-N 347.896 5.133 30 20 EKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 742432224 UOBMMBSWVVHGOH-SREVYHEPSA-N 329.421 5.215 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)COC3)o1 742437623 VYRVMCRLOQBEID-CLFYSBASSA-N 348.373 5.320 30 20 EKED C=CCN(CCc1ccccc1)C(=S)Nc1cccc(C(C)C)c1 743584878 QAJURRSEFLZIPI-UHFFFAOYSA-N 338.520 5.238 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 758417835 XFBAIMYATMLOQF-NRFANRHFSA-N 330.431 5.049 30 20 EKED CC(C)(C#N)c1ccccc1CNc1ccc(SC(F)F)cc1 767805297 ATYDMBOXOGWGTR-UHFFFAOYSA-N 332.419 5.415 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1ccc(N2CCCC2=O)cc1)c1ccccc1 773077037 PRMDSWWGINNNQE-PGRDOPGGSA-N 348.490 5.172 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccnc(Cl)c3)cs2)cc1 782183885 GBSZTVNXUGSUME-SREVYHEPSA-N 340.835 5.063 30 20 EKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1cccc(C#N)c1 785535982 XNOADWLGTAUQJN-CYBMUJFWSA-N 342.851 5.108 30 20 EKED CC(C)n1nccc1/C=C1\CCc2c(Cl)sc(Cl)c2C1=O 794941492 PJXFBPVXHXCULK-VQHVLOKHSA-N 341.263 5.045 30 20 EKED CC(C)Sc1ccc([C@H](C)Nc2nc(Cl)c(C#N)s2)cc1 804431234 MUJDAYKEWAVDFS-JTQLQIEISA-N 337.901 5.342 30 20 EKED C[C@@H]1/C(=C/c2ccccc2OCc2cccnc2)C(=O)c2ccccc21 809159609 SLNJZHVJQSXDPW-JHDSZEHQSA-N 341.410 5.044 30 20 EKED CCCCc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776805976 MAVPGSPVAHXXKY-MDZDMXLPSA-N 348.851 5.338 30 20 EKED COc1cc(C(=O)/C=C/c2ccccc2OC(C)C)ccc1SC 60245406 QHUWKJXFKSJNSX-PKNBQFBNSA-N 342.460 5.100 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H](C)c1cccc(C#N)c1 153724598 CBGZXKLROXHIIX-CABCVRRESA-N 347.487 5.402 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC(C)(C)CC1 173122457 PQIWKZREAKJJSE-OAHLLOKOSA-N 345.512 5.125 30 20 EKED Cc1cc(C)cc(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)c1 189809258 HBWQPOXBKLILJW-CQSZACIVSA-N 335.432 5.078 30 20 EKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cc2ccccc2s1 237602202 QNTWIGMTHYACLT-CABCVRRESA-N 336.460 5.043 30 20 EKED CCc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 431137542 KWZJKVRICGZAPI-CQSZACIVSA-N 340.835 5.002 30 20 EKED N#CCCC[C@H](NC(=O)NCCC1=CCCCCC1)c1ccccc1 431470556 KGFZQVYJQARRCR-FQEVSTJZSA-N 339.483 5.001 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC12CCSCC2 451331552 OBKPYDZHZZZUNP-KRWDZBQOSA-N 329.509 5.010 30 20 EKED Cc1cc(Cl)c2ccccc2c1NC(=O)[C@H](C)c1cccc(C#N)c1 464397299 RMMOGNPEAAIJQJ-CQSZACIVSA-N 348.833 5.416 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C[C@@H](C)C1 475564967 VATQBBRXVJOGRP-DLBZAZTESA-N 328.500 5.438 30 20 EKED CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1SC[C@H](C)C#N 475759903 CNLWWGUUFVKGIH-OAGGEKHMSA-N 330.497 5.093 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(F)(F)F)c1 476165443 TUWMKJIYZMENQT-UHFFFAOYSA-N 347.380 5.810 30 20 EKED C=C(C)CN(C)C(=O)Nc1ccccc1-c1nc2ccccc2s1 481610361 IFBRJKKHAZKFHS-UHFFFAOYSA-N 337.448 5.003 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H]1CCSc2ccccc21 505028406 DDSUEHVWXWTFTQ-SFHVURJKSA-N 338.476 5.164 30 20 EKED C=C1CCN(C(=O)c2cc(C)c(-c3cccc(Cl)c3)s2)CC1 517453832 YZGSZXJMVRONHZ-UHFFFAOYSA-N 331.868 5.169 30 20 EKED C=CC[C@@H](C)NC(=O)Nc1ccccc1-c1nc2ccccc2s1 523992490 BRHJIVYEFVLLTR-CYBMUJFWSA-N 337.448 5.049 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCCC2 550829464 HUHVRJKXMQZLKZ-LPHOPBHVSA-N 338.520 5.713 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c2ccccc12 551221088 AQBLUAQDLXIGBA-GAJHUEQPSA-N 346.449 6.065 30 20 EKED C[C@H](NCc1cc(C#N)ccc1F)c1ccc(-c2ccccc2)cc1 591702234 WCIYFXUJDWISGS-INIZCTEOSA-N 330.406 5.215 30 20 EKED CC1(C)CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 609209786 MCYHUCWNTCNRGW-UHFFFAOYSA-N 349.434 5.004 30 20 EKED Cc1oc(C)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 609429552 MFJHQGMZDYZMFN-UHFFFAOYSA-N 346.386 5.121 30 20 EKED C[C@@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cccc(C#N)c1 613667600 QJZXHPNHYICFNE-LLVKDONJSA-N 340.295 5.385 30 20 EKED Cc1cc(F)ccc1-c1ccc(CN[C@H]2CCc3cc(C#N)ccc32)o1 618742658 OHTWRSFBDKIPJQ-NRFANRHFSA-N 346.405 5.043 30 20 EKED COCCCC[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 619465943 LRLOOBIXWWBYEO-XZOQPEGZSA-N 348.490 5.083 30 20 EKED Cc1ccc(-c2nc(/C=C3\CCc4sccc4C3=O)cs2)cc1 726892544 NEWYSEJTPDGJPK-GXDHUFHOSA-N 337.469 5.393 30 20 EKED CC[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1nc(C)cs1 729641791 XSYOFSLHTYZXSV-KLJFIRRPSA-N 329.252 5.034 30 20 EKED Clc1ccc([C@H]2CCCC2=NNc2ncnc3sccc23)cc1 741453906 BOBKEHRORZXVBY-CYBMUJFWSA-N 342.855 5.080 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3=CCCCCC3)n2)cc1 773983194 UGXJMEMBIMMYCG-KRWDZBQOSA-N 336.460 5.185 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(COC)cc2)cc1 774485414 SPRVOFNKSIZCCD-OAHLLOKOSA-N 331.843 5.137 30 20 EKED C#CCOc1ccc([C@H](C)N[C@@H](C)c2csc3ccccc23)cc1 776723684 SCDDSONKDLUUMZ-HOTGVXAUSA-N 335.472 5.325 30 20 EKED C=CCCc1ccccc1NC(=S)Nc1ccc2ccccc2c1 799900646 NAFWYESKDMRPEW-UHFFFAOYSA-N 332.472 5.767 30 20 EKED CC(/C=C\C(=O)c1cncc(F)c1)=C\c1cccc(C(F)(F)F)c1 806573861 UTZCBYIYWLSMHC-UNKATYBDSA-N 335.300 5.082 30 20 EKED CCC1(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)CCC(F)(F)CC1 850741598 LZVWVJVYWRCQGT-HNNXBMFYSA-N 342.389 5.017 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC(F)F)C1CCC1 888019887 BHUKEYYAARNXPT-UHFFFAOYSA-N 336.426 5.190 30 20 EKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)CC(F)F 892523258 ZQMQOXJGDKZMQQ-CYBMUJFWSA-N 348.418 5.058 30 20 EKED C=CC[C@H](CNc1nc2ccccc2c(C)c1C(=O)O)c1ccccc1 1776151803 CIRIKALMNWOTBD-QGZVFWFLSA-N 346.430 5.013 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OCC)cc1 189867869 CLMVYXKVOIPDAT-UHFFFAOYSA-N 337.463 5.118 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc2ccccc12 195656636 OHTOXTQAXLXDQG-QGZVFWFLSA-N 330.431 5.695 30 20 EKED O=C1CCC(C(O)=Nc2cccc(N=C(O)C3CCCCC3)c2)CC1 330312207 ODAXKCLGLODMLZ-UHFFFAOYSA-N 342.439 5.202 30 20 EKED N#CCCC[C@@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 353911702 CDQMTSZRSMWQMN-LJQANCHMSA-N 339.508 5.325 30 20 EKED N#Cc1ccc(CNc2ccc(-c3ccc(Cl)s3)cn2)s1 432729594 QUNZIJATYBVKCL-UHFFFAOYSA-N 331.853 5.009 30 20 EKED C=C(C)[C@@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(F)c(F)c1 447593449 SAPGDSAKUYFXIG-WOJBJXKFSA-N 326.390 5.195 30 20 EKED C=C(C)C[C@H](C)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 464573053 XBVPDQXGUAQBHX-PXNSSMCTSA-N 346.474 5.018 30 20 EKED C=CCCC1(C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)CC1 476397673 LOPGRMPYBMZOPD-UHFFFAOYSA-N 349.927 5.170 30 20 EKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](c1ccccc1)C(C)C 482407704 MAHJYBPKLXEOBN-QFIPXVFZSA-N 348.490 5.127 30 20 EKED C[C@H](Nc1ccc(Nc2ncc(C#N)cc2Cl)cc1)c1ccccc1 513602820 JYMWEZYEASWIPO-AWEZNQCLSA-N 348.837 5.523 30 20 EKED CN(Cc1ccccc1NCCCC(C)(C)C#N)C1CCCCC1 532296742 ITGWGMWMROPKHF-UHFFFAOYSA-N 327.516 5.193 30 20 EKED N#Cc1c(Cl)cccc1SCc1csc(-c2ccco2)n1 537841315 ORSCYSBTIQGYSA-UHFFFAOYSA-N 332.837 5.220 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCc2ccc(C#N)s2)c1 538833234 PQKNXKUFZRVMRU-UHFFFAOYSA-N 342.411 5.195 30 20 EKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 556197905 NPHJXLCORBDBBY-IFXJQAMLSA-N 330.834 5.565 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1nccc2ccccc12)c1ccc(F)c(F)c1 569860963 JHDLDYYKWRGORW-VBKZILBWSA-N 338.401 5.481 30 20 EKED N#CCCC[C@H](NCCCOc1ccc(Cl)cc1)c1ccccc1 580751929 LUBJVQYYVSZBLG-FQEVSTJZSA-N 342.870 5.134 30 20 EKED C[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1cccc(C#N)c1 610344685 FFMIAMVSQUSSFM-LLVKDONJSA-N 338.760 5.081 30 20 EKED Cc1coc(-c2ccc(C)c(NCc3ccc(C(C)(C)C#N)cc3)c2)n1 614058654 LEJSQYQXCVPQBP-UHFFFAOYSA-N 345.446 5.372 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCc2cc(Cl)cc(Cl)c21 618804272 KNAICWNBOMJIJR-QZTJIDSGSA-N 343.257 5.129 30 20 EKED O=C(/C=C/c1cc(C(F)(F)F)ccc1F)c1ccc(F)cc1F 733206702 PGLSNPPPJDHBQB-LZCJLJQNSA-N 330.227 5.019 30 20 EKED CC[C@@H](C)N(Cc1ccccc1)Cc1cc(Cl)ccc1OCC#N 735306772 UJEDWNFMZGJRSH-MRXNPFEDSA-N 342.870 5.043 30 20 EKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 735400692 YJMQXEWLQSINMI-NVXWUHKLSA-N 340.492 5.593 30 20 EKED Cc1cccn2c(/C=C/C(=O)c3ccc(SC(C)C)cc3)cnc12 741467275 LZYMVWKGMFZDPB-DHZHZOJOSA-N 336.460 5.039 30 20 EKED Cc1cccc(COc2ccc(C(=O)/C=C\c3scnc3C)cc2)c1 742434900 PQIUEKBNMJXNPT-KHPPLWFESA-N 349.455 5.235 30 20 EKED C#CC[C@H](N[C@H](C)c1sc(C(C)(C)C)nc1C)c1ccccc1 773116220 QWDUDKNNOQXCGD-PBHICJAKSA-N 326.509 5.164 30 20 EKED CCSc1ccc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)cc1 788354585 MIELDBNPNCZQNF-BQYQJAHWSA-N 343.395 5.170 30 20 EKED CCCC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 800386506 JAWUICWKOXIWCL-NWDGAFQWSA-N 348.418 5.091 30 20 EKED N#CCCCCCC(=O)Nc1ccccc1SCc1ccccc1 807555227 XCDHZBBKRYTSFU-UHFFFAOYSA-N 338.476 5.391 30 20 EKED C=CCCC[C@H](Nc1cccc([C@@H]2CCC(=O)N2)c1)c1ccccc1 883229534 LMPMHYQAESQRMN-SFTDATJTSA-N 334.463 5.147 30 20 EKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 887213081 DAZXUASIJLSFMX-GOSISDBHSA-N 347.499 5.118 30 20 EKED O=C(/C=C/c1cccc(C(=O)O)c1Cl)c1ccc2ccccc2c1 1776131547 UQJUNNQCQXCAAL-ZHACJKMWSA-N 336.774 5.088 30 20 EKED CCCCCCCOc1ccc(CNc2cccc(C(=O)O)c2)cc1 1776789272 YYXKQLXFMCIKCS-UHFFFAOYSA-N 341.451 5.346 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccccc1CCC(F)(F)F 179679255 QLYYMARSCMATJM-ZDUSSCGKSA-N 328.378 5.048 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(C2CCCC2)n1 189879028 KZKKOWCQLOYBRP-UHFFFAOYSA-N 337.467 5.102 30 20 EKED Cc1c(C2CCCCC2)noc1N=C(O)C1CCC(F)(F)CC1 330156611 YUKYOARZBATNIQ-UHFFFAOYSA-N 326.387 5.444 30 20 EKED Cc1cc(CSCC2(C#N)CCC2)nc(-c2ccc(Cl)cc2)n1 419449704 RTYJJTFDWNABGZ-UHFFFAOYSA-N 343.883 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C2CCCC2)C1 432593638 OLRRAGCPGWCCDQ-UHFFFAOYSA-N 326.484 5.192 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCc2cc(Cl)cc(Cl)c2[C@@H]1C 466414036 GLQJGATXPUDGLE-NEPJUHHUSA-N 326.267 5.041 30 20 EKED C=C(C)[C@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccc(F)c(F)c1 467362375 OYVWYCRZAKTYHD-ICSRJNTNSA-N 347.380 5.007 30 20 EKED Cc1cc(NC(=O)C[C@@H](CC#N)c2ccccc2)ccc1C(F)(F)F 480202246 UMPOWEXEJWRKTA-OAHLLOKOSA-N 346.352 5.040 30 20 EKED C=CC[C@H](C(=O)Nc1ccc(Oc2ccncc2)cc1)c1ccccc1 488714945 ORDDSUYMWXTERW-NRFANRHFSA-N 344.414 5.172 30 20 EKED C=CC[C@@H](C(=O)Nc1ccc2nc(C3CC3)oc2c1)c1ccccc1 489670872 BZJSBFAVUDMKRR-QGZVFWFLSA-N 332.403 5.004 30 20 EKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 536814129 FEWSVWBIIRDJOQ-MAUKXSAKSA-N 349.434 5.145 30 20 EKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 537928500 UTKUFJYJKWVVJF-QAPCUYQASA-N 349.434 5.145 30 20 EKED C[C@H](NC(c1ccccc1)c1ccccc1)c1ccc(C#N)c(F)c1 538502922 QEYXPTGVKONCRZ-INIZCTEOSA-N 330.406 5.138 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)o1 540627685 DFIFNPKLAFABQZ-DHIUTWEWSA-N 342.442 5.102 30 20 EKED N#Cc1cc(Oc2ccc(NCc3cccc(Cl)c3)cc2)ccn1 577684175 WTBWTJAKAVZBLA-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CCN(C(=O)[C@H]1CCC[C@H](C)C1)c1nc(-c2ccccc2)cs1 607443560 HLGGISNHZBFEGH-RDJZCZTQSA-N 340.492 5.155 30 20 EKED N#C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C1CCCCC1 609648656 ZJZBXQBYFPVAIA-LBPRGKRZSA-N 334.794 5.318 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(c2ccccc2)C1 640048653 GOKQGZGDDKLLPR-UHFFFAOYSA-N 334.463 5.170 30 20 EKED O=C1/C(=C/c2cccs2)CCc2nc(-c3ccccc3F)sc21 731937565 JLYFATYGCJBWSG-ZHACJKMWSA-N 341.432 5.223 30 20 EKED Cc1ccnc(-c2cccc(N=Cc3c(O)ccc4ccccc34)c2)n1 734303498 RKJUWTBIEXZJPU-UHFFFAOYSA-N 339.398 5.061 30 20 EKED CC(C)Oc1ccc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1 736433511 VXLLQPBMDGHROO-KHPPLWFESA-N 329.465 5.124 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@H]1c1cc(C)no1 737801418 CDCZOZBRWSBRRF-BJRSVTDJSA-N 332.488 5.343 30 20 EKED CC(C)C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 741110487 DLXLWYYBMAJJMX-IRXDYDNUSA-N 348.471 5.302 30 20 EKED N#Cc1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)s1 754689035 DQLYWNJMXRKKGR-GQCTYLIASA-N 341.741 5.188 30 20 EKED N#CCc1ccc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 759743940 ISIFYFYGELEPOQ-UHFFFAOYSA-N 340.386 5.420 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(C)CCCCC3)n2)cc1 781449550 OPKMHVYZMYCXMN-INIZCTEOSA-N 338.476 5.265 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1ccc3cnccc3c1)C2=O 782325982 DWQMZXIXUCUNLA-BOPFTXTBSA-N 331.440 5.169 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccc1O 783532002 GYQVNVIAEDWNBN-SJORKVTESA-N 342.442 5.343 30 20 EKED C[C@H](NCC1CCC(C#N)CC1)[C@H](C)c1ccccc1C(F)(F)F 799726347 OASQNDJSWFUWOK-FXQLRMTLSA-N 338.417 5.117 30 20 EKED CC[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(Cl)c1O 841760478 FNKDLJLFUMLADJ-RBUKOAKNSA-N 340.854 5.036 30 20 EKED CC1=C(C)C[C@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)CC1 842688365 FONAGVXQXLMEKS-SJORKVTESA-N 336.460 5.123 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccccc3)n2)cc1 916627169 COEPJLHDKSZZAX-DVESRUBUSA-N 344.439 5.008 30 20 EKED O=C(/C=C\c1cccc(C(=O)O)c1F)c1ccc(-c2ccccc2)cc1 1776131220 LHVMLCFRZLXREP-YPKPFQOOSA-N 346.357 5.087 30 20 EKED CC(C)n1cc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)cn1 72047948 SZFVZNIYCWNSBB-VQHVLOKHSA-N 340.810 5.274 30 20 EKED C[C@H](Sc1nnc(-c2cc3ccccc3o2)o1)c1ccc(C#N)cc1 176801846 ZNYDVROWNSJCCU-LBPRGKRZSA-N 347.399 5.208 30 20 EKED C=CCCCN(C)C(=O)N[C@H](C)c1ccc(Oc2ccccc2)cc1 303890453 RTLMHOYGDMKGRG-QGZVFWFLSA-N 338.451 5.148 30 20 EKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 303925532 WNKXWIWMPUYXDK-AWEZNQCLSA-N 348.427 5.154 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425623206 OWUPVHCADDAJGD-MRXNPFEDSA-N 335.451 5.215 30 20 EKED CC(C)(C)c1ccccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483200985 OEXLJENGTGMPFO-GOSISDBHSA-N 328.415 5.022 30 20 EKED C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccccc1 484054884 GEGIFNFEHJVZBY-CQSZACIVSA-N 332.428 5.029 30 20 EKED N#Cc1ccc(NC(=O)c2ccc(-c3cccc4cccnc34)cc2)cc1 505927782 CZEIHJRPACEWQW-UHFFFAOYSA-N 349.393 5.026 30 20 EKED CC(C)c1ccc(Nc2nnc(SCCCCC#N)s2)cc1 514290538 SABKCFBNYOMGFL-UHFFFAOYSA-N 332.498 5.191 30 20 EKED N#CCC[C@H](NCc1cnc(C2CCCCC2)s1)c1ccccc1 533360372 IHQDEMNABOWHEB-IBGZPJMESA-N 339.508 5.325 30 20 EKED C=CCCC1(c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)CC1 558388576 QHEKTFZCWNOLAP-ZDUSSCGKSA-N 340.320 5.145 30 20 EKED C[C@@H](Sc1ccc(Cl)cc1C#N)c1nc(-c2ccccc2)no1 610655032 NOQCKQXXIHZKIC-LLVKDONJSA-N 341.823 5.115 30 20 EKED C[C@H](N[C@H](C)c1ccc(-c2ccccc2)s1)c1cccc(C#N)c1 612572600 VUBKYKRJDMQIQW-JKSUJKDBSA-N 332.472 5.699 30 20 EKED CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1F 619755271 VKDARJZCLLTLDH-INIZCTEOSA-N 337.225 5.245 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(C(C)(C)O)CC1 651874400 YBVWIKNFFJLTJB-UHFFFAOYSA-N 343.511 5.054 30 20 EKED CCC/C(C)=C\C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 727996116 FJWLTXIGOUSNRF-WJDWOHSUSA-N 348.446 5.131 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 734083575 PVNAILNWYQJLSV-ZFWWWQNUSA-N 344.455 5.218 30 20 EKED CCOc1ccc(C=NOCc2csc(C3CCCCC3)n2)cc1 744180524 RNFSQGJMZVURSZ-UHFFFAOYSA-N 344.480 5.140 30 20 EKED C[C@H](ON=Cc1cccc(F)c1)c1ncc(-c2ccc(Cl)cc2)o1 752765461 XPORVQJUFQLCNS-LBPRGKRZSA-N 344.773 5.246 30 20 EKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 759187028 IATMVJNRIWTUQY-RXXLQFRUSA-N 346.817 5.168 30 20 EKED Cc1cc(NC(=S)Nc2ccccc2C#N)ccc1-c1ccccc1 762429923 DMWVFPYXFJWCIH-UHFFFAOYSA-N 343.455 5.343 30 20 EKED C=CC[C@@H](N[C@@H](CC)c1ccc2cc(OC)ccc2c1)c1ccncc1 766020509 PYCKXMYKHMWTTD-XZOQPEGZSA-N 346.474 5.602 30 20 EKED N#Cc1ccc(SCc2ccc(Cl)nc2C(F)(F)F)c(F)c1 786726559 IEWXJADPNGBHRI-UHFFFAOYSA-N 346.736 5.057 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(SC(F)F)c2)cc1 793371697 VYEOIELRPSLGBH-UHFFFAOYSA-N 346.402 5.055 30 20 EKED Cc1oc(C#N)cc1C(=O)Nc1ccc(N=Nc2ccccc2)cc1 798211957 PRMJHZJHSAHFNB-UHFFFAOYSA-N 330.347 5.127 30 20 EKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1nccc2ccccc12 802812904 HKAJVTDRMVMALL-VUBSUSDNSA-N 332.447 5.018 30 20 EKED CCCCC[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)C(C)C 813212655 FJMXAYXWGUUDFR-GJZGRUSLSA-N 340.389 5.129 30 20 EKED C=CCC1(C(=O)Nc2ccc(SC(C)(C)C)cc2C)CCOCC1 823281288 USSHKHOHJGJHLE-UHFFFAOYSA-N 347.524 5.197 30 20 EKED CCCCCC[C@@H]1CCCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776033413 CYKCFYUXDUQMTK-CYBMUJFWSA-N 336.863 5.577 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC[C@H](CCC)c1ccccc1 1776782377 NORIBZVAQUSCJA-PMACEKPBSA-N 333.516 5.364 30 20 EKED CCCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 63235952 WFGJOXACVDOENV-GOSISDBHSA-N 346.455 5.253 30 20 EKED Cc1ccc(Oc2ccc(NC(=O)C3(C#N)CCCCC3)cc2)cc1 72029878 QAFONTRPWSODRB-UHFFFAOYSA-N 334.419 5.200 30 20 EKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCCC(C)(C)C#N)cc1 177616221 PFSKTQSWCJZQHB-HNNXBMFYSA-N 345.487 5.014 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)oc12 182052399 VNXNFFBDINLCHS-APWZRJJASA-N 348.446 5.527 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(CCC)s1 189895247 ZHUWHWIUIFQWNH-UHFFFAOYSA-N 328.481 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCO[C@H](CC)C1 276464558 OTCDUHXPBXJTDZ-SJLPKXTDSA-N 329.484 5.072 30 20 EKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(-c2ccccc2)cc1 277839233 KOHSTKFNOZZMIL-XMMPIXPASA-N 339.504 5.322 30 20 EKED C=CCCc1ccccc1NC(=O)c1ccccc1SC(C)C 410351742 HDVUOXDHCILJDH-UHFFFAOYSA-N 325.477 5.558 30 20 EKED C=C(C)COc1cccc(NCc2nc3ccc(F)cc3s2)c1 428869112 AKQOOQHVBLLWPC-UHFFFAOYSA-N 328.412 5.002 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C1CCCCC1 438041567 MXAWBUNZNOHEKK-HUUCEWRRSA-N 345.512 5.029 30 20 EKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3ccc(F)cc3)c3ccccc23)C1 450585528 QLWSPORWLIDTSR-XJKSGUPXSA-N 349.434 5.220 30 20 EKED C=CCOCCCC(=O)Nc1ccccc1Oc1c(C)cccc1C 463164028 NDUFILSTUXDNHZ-UHFFFAOYSA-N 339.435 5.017 30 20 EKED C=CCN(CC1CCCCC1)C(=O)c1cccc(-c2cscn2)c1 463841177 CHHFJNRRYVABDU-UHFFFAOYSA-N 340.492 5.019 30 20 EKED C=CC[C@H](C(=O)Nc1cc(C(=O)CC)ccc1Cl)c1ccccc1 471451202 KDLUPDWLKQCZTK-INIZCTEOSA-N 341.838 5.231 30 20 EKED CC(C)Sc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2C#N)cc1 505595191 BSWQMXBGNCNASL-ZDUSSCGKSA-N 341.436 5.140 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2Oc2ccccc2)c1 505864147 KAHHARODRSJOIJ-UHFFFAOYSA-N 348.789 5.256 30 20 EKED C[C@@H](NC(=O)C1(C#N)CCCCC1)c1ccccc1Oc1ccccc1 506190075 MDJKSCPLLMJZMS-QGZVFWFLSA-N 348.446 5.130 30 20 EKED CCCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](C)c1ccccc1 538566139 LWJYDPQSAXQKFO-SFHVURJKSA-N 346.474 5.245 30 20 EKED CCCC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(OC)cc1 539610285 TYFPSBJAIBKHLC-VFNWGFHPSA-N 340.442 5.288 30 20 EKED CC(C)(C#N)CCCC[S@](=O)c1ccc(C2CCCCC2)cc1 559578114 KOIWABMLPFHZJA-QHCPKHFHSA-N 331.525 5.562 30 20 EKED C[C@](C#N)(NC(=O)c1cc2c(Cl)cccc2s1)C1CCCCC1 609638750 CQLWMKUSYFEPDE-GOSISDBHSA-N 346.883 5.147 30 20 EKED CCOc1ccccc1[C@@H](CC)N[C@H]1CCCc2cc(C#N)ccc21 611392383 PQYMZKGPLLYDTP-RTWAWAEBSA-N 334.463 5.075 30 20 EKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392130 IVKOOGTUDANQDG-SFHVURJKSA-N 346.455 5.424 30 20 EKED C#Cc1cccc(NC(=S)Nc2ccccc2Cc2ccccc2)c1 726437776 HZJUMMOGYSVDGX-UHFFFAOYSA-N 342.467 5.068 30 20 EKED C=CCN(CC1CCCCC1)C(=S)N[C@H](CC)c1cccs1 734379806 IMDXFFPBAMGHGJ-MRXNPFEDSA-N 336.570 5.142 30 20 EKED FC(F)SCc1ccc(C=NNc2cccc3ccccc23)o1 747060240 MFVYGQJZJMEUCR-UHFFFAOYSA-N 332.375 5.335 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)C1CCCCC1 766445370 AAMRZVZCTOMCER-HNNXBMFYSA-N 344.524 5.483 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775985740 PLYKIHSHKXDMHA-DYESRHJHSA-N 347.462 5.208 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3cccc(Cl)c3o2)n1 783106692 KEXRPWDSMQYHMR-NSHDSACASA-N 344.823 5.156 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(C)c(OC)c(Cl)c1)c1ccncc1 796770064 BJEFVAANTXDHRF-KSSFIOAISA-N 330.859 5.020 30 20 EKED CCCCCCCCCC(=O)N1CCCC[C@H]1c1nccn1CC 797775324 BTWMEMKXKBWSLU-SFHVURJKSA-N 333.520 5.097 30 20 EKED C=C[C@@H](CC(=O)O[C@@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798669858 MWXUCLDVMBAAQN-KBPBESRZSA-N 349.352 5.065 30 20 EKED CCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 800386509 JAWUICWKOXIWCL-VXGBXAGGSA-N 348.418 5.091 30 20 EKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1c(F)cccc1Cl 809158812 DUUNSVHXDRWZIG-SREVYHEPSA-N 335.762 5.124 30 20 EKED O=C(/C=C/c1ccc(Cl)s1)c1sccc1Br 915114049 ANBULAIZSOUUOT-HNQUOIGGSA-N 333.659 5.122 30 20 EKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)CC(C)(C)C 917027078 VUQQEGLSFKUEJL-ZBFHGGJFSA-N 340.492 5.449 30 20 EKED C=CCn1c(S[C@@H](C)c2cccc(Cl)c2)nnc1-c1ccco1 60428579 RUXKRFPCGDITCX-LBPRGKRZSA-N 345.855 5.231 30 20 EKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(C(C)(C)C)s2)c1 127305219 UKNXGNWVXNHMTQ-INIZCTEOSA-N 342.508 5.016 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccccc1 191423791 UPIMAGJOWORGMP-NRFANRHFSA-N 348.490 5.908 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)c(F)cc2CC1 329031291 XEQZQZOJAHLPOO-VHDGCEQUSA-N 344.430 5.554 30 20 EKED OC1=Nc2cc(/C(O)=N/[C@@H]3C[C@H]3C3CCCCC3)ccc2SCC1 329878745 LFVPXRODVZSUHP-LSDHHAIUSA-N 344.480 5.044 30 20 EKED C=CCC[C@H](NC(=O)N(Cc1cccs1)C1CC1)c1ccccc1 435763479 WBGRHLOWJRFONI-IBGZPJMESA-N 340.492 5.130 30 20 EKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 439131477 MAGMHNVABVMCHW-MRXNPFEDSA-N 348.233 5.160 30 20 EKED C=CCC[C@H](N[C@H](C)c1cncc(C)c1)c1ccc(C(F)(F)F)cc1 467746275 NDENTTJMGSIWNV-BEFAXECRSA-N 348.412 5.767 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 536838694 MBIPKBBZVAZGLO-SCLBCKFNSA-N 333.262 5.689 30 20 EKED C[C@H](N[C@@H](C)c1cncs1)c1ccc(-c2cccc(C#N)c2)cc1 542105932 HTJUSZKDJYIXDY-GJZGRUSLSA-N 333.460 5.094 30 20 EKED C[C@H](NC(=O)CCCCCC#N)c1ccccc1Oc1ccccc1 588155575 MYWRMNAOOLWTIF-KRWDZBQOSA-N 336.435 5.130 30 20 EKED N#C[C@H](C(=O)c1cccc(C2CCCC2)c1)c1nc(C2CC2)cs1 659115284 APNNWLHEPYNWHQ-QGZVFWFLSA-N 336.460 5.168 30 20 EKED C[C@@H]1CCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 729143789 RKSGLSXSTNSEBG-LLVKDONJSA-N 340.427 5.085 30 20 EKED CC(C)CC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCC1 757304681 LYZFGRDDGARUCQ-ZDUSSCGKSA-N 346.883 5.342 30 20 EKED CCC(CC)[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 762042714 WQJOEUVUPSEROD-ZWNOBZJWSA-N 334.872 5.198 30 20 EKED C=C[C@@H](CC(=O)O[C@H](c1ccccc1)c1nccs1)c1ccccc1 770183247 JUFMUZLIKQJBQF-OXJNMPFZSA-N 349.455 5.136 30 20 EKED N#Cc1ccc(NC(=S)Nc2ccc(C3CCC3)cc2)cc1Cl 782420003 UGNKRAHTQOYJGM-UHFFFAOYSA-N 341.867 5.288 30 20 EKED COc1cc(C(=O)/C=C\c2cc(C)c3ncccc3c2)ccc1SC 783705748 CBZQCBCSKWRCEK-VURMDHGXSA-N 349.455 5.170 30 20 EKED CCCC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 786317873 FRBUVCKGPBGVRI-OAHLLOKOSA-N 326.465 5.203 30 20 EKED N#CCCCCCC(=O)OC/C=C/c1cc(Cl)cc(Cl)c1 809101694 JPGNYKRZADVBLC-AATRIKPKSA-N 326.223 5.024 30 20 EKED CC(CCCCCCC(=O)O)=NNc1ccc(-c2ccccc2)cc1 1776059935 SAJSCNVTDDDMOJ-UHFFFAOYSA-N 338.451 5.567 30 20 EKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(-c2ccccc2)cc1 1776073288 MTASMZBPDZMFPV-UHFFFAOYSA-N 348.377 5.027 30 20 EKED Cc1c(NN=C2C[C@@H](C)C[C@@H](c3ccccc3)C2)cccc1C(=O)O 1776087055 GHEJHJXBGGDOBO-WMLDXEAASA-N 336.435 5.065 30 20 EKED O=C(O)c1ccc(/C=C\C(=O)c2cccc3ccccc23)c(Cl)c1 1776114187 IOYLCWSLTXWKQT-KHPPLWFESA-N 336.774 5.088 30 20 EKED N#Cc1ccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 7912345 MIKQMZJYZQIZCG-SXGWCWSVSA-N 341.197 5.604 30 20 EKED C=C(C)COc1cc(CN[C@@H](c2ccccc2)C(C)C)ccc1OC 60927324 OIFWCHKOCMFIJR-JOCHJYFZSA-N 339.479 5.137 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)C1CCCCCC1 66954089 XDZSKGIDCVXIAT-HNNXBMFYSA-N 345.512 5.267 30 20 EKED CC(C)[C@@H](NCc1ccc(C#N)s1)c1ccc(C(F)(F)F)cc1 130353403 CUINQHKCRCBHPB-MRXNPFEDSA-N 338.398 5.125 30 20 EKED CCCCCCC[S@@](=O)Cc1csc(-c2ccsc2)n1 133148099 ZXHBLRPFDKUXIU-FQEVSTJZSA-N 327.540 5.091 30 20 EKED O=C(/C=C/c1ccc(-c2ccccc2F)o1)c1ccc(F)cc1F 137734282 AUFXZFCZKROVAD-RMKNXTFCSA-N 328.289 5.260 30 20 EKED C=CC1CCN(C(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)CC1 442755012 REDNXIBVDVQUOU-UHFFFAOYSA-N 349.261 5.027 30 20 EKED CCCc1nc(C)c(CSc2ccc(C#N)c(C(F)(F)F)c2)o1 450899893 FBTAWXVPSZJDQG-UHFFFAOYSA-N 340.370 5.118 30 20 EKED N#CCSCCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 466626109 NXSCKATXSBAMFB-SFHVURJKSA-N 347.936 5.809 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2ccccc2)o1 476110226 MUBIATAYLPJKHV-UHFFFAOYSA-N 345.442 6.051 30 20 EKED C[C@H](SCc1ccccc1C(C)(C)C#N)c1nc2ccccc2o1 481922676 NNZDDHNVLLILNT-AWEZNQCLSA-N 336.460 5.623 30 20 EKED CCN(Cc1csc(CCC(C)C)n1)[C@H](C)c1ccc(C#N)cc1 519947677 PLAUPGNICHBCRM-MRXNPFEDSA-N 341.524 5.186 30 20 EKED CCCC(C)(C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 522597005 QGSRWWAIIHDEHH-UHFFFAOYSA-N 337.423 5.051 30 20 EKED CCOc1ccc(Cl)cc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 536841591 WMDFIBYJOXANPL-KXBFYZLASA-N 342.870 5.434 30 20 EKED C[C@@H](NCC(C)(C)CCC#N)[C@@H](C)Oc1ccc(Cl)cc1Cl 554066402 HIIDVHMIMJSIFE-CHWSQXEVSA-N 343.298 5.069 30 20 EKED CC(C)CCc1ccccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610323052 PEOBQOXLHOLWPD-INIZCTEOSA-N 335.451 5.030 30 20 EKED CCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@H](CC)c1ccccc1 610356850 BAEVREWCIFTCFB-DYESRHJHSA-N 349.478 5.192 30 20 EKED N#CCC[C@H](N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 611337034 FSOFYIBJYMLGFX-ROUUACIJSA-N 345.273 5.615 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(N2CCCCCC2)cc1 726365942 SIYSVGBBZCQRQZ-XFXZXTDPSA-N 340.854 5.012 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1sc(C)nc1C 726737457 GIWGWNFJINEYMQ-UHFFFAOYSA-N 348.686 5.556 30 20 EKED CCCC1C/C(=C/c2cccnc2C)C(=O)/C(=C/c2cccnc2C)C1 728785233 AMUMEMMKUYIGDV-BILXGNRESA-N 346.474 5.340 30 20 EKED CC[C@@H](c1ccccc1)N(CC)Cc1cc(Cl)ccc1OCC#N 735309471 FRGSHUHWJFCWJM-IBGZPJMESA-N 342.870 5.216 30 20 EKED COc1ccc(Cl)cc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741473230 ORSYZVBIVOQELK-ALCCZGGFSA-N 349.817 5.307 30 20 EKED C=CCN(C(=O)Nc1cccc(Cl)c1SC(C)C)C(C)C 743186302 ZUWXOVQCJNNVBO-UHFFFAOYSA-N 326.893 5.269 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036525 BAZASYABAILDRS-WBVHZDCISA-N 340.492 5.593 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N[C@H]1CCCc2nc(O)ccc21 774812284 ZVKAWAOJBFPHQW-APWZRJJASA-N 346.515 5.058 30 20 EKED C=CC[C@H](N[C@H](C)c1oc2ccc(C)cc2c1CC)c1ccncc1 776155186 CZISIXOYRKVTIM-UZLBHIALSA-N 334.463 5.667 30 20 EKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568369 QWNVSNQOCJSJPX-ZBFHGGJFSA-N 340.492 5.119 30 20 EKED O=C(/C=C/c1cccc(-c2cccnc2)c1)c1c(F)cccc1Cl 809158952 GBKPKGPRCJVWRV-MDZDMXLPSA-N 337.781 5.437 30 20 EKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1csc2ccccc12 850123193 LJYDICNFHWXXNK-OAHLLOKOSA-N 332.472 5.307 30 20 EKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc4ccccc4o3)c2c1 1777685583 NSLSGQOLTITTOO-FNORWQNLSA-N 348.379 5.242 30 20 EKED O=C(/C=C\c1cccc(/C=C/C(=O)c2ccccc2)c1)c1ccccc1 34688328 PSWLVTPAAJSQQT-QUDUTFMFSA-N 338.406 5.479 30 20 EKED Cc1c(Cl)cccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 192512179 MPABCJRUIRZFCS-GFCCVEGCSA-N 344.867 5.295 30 20 EKED CC1CCC(=CC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 303584235 PXSQNZNRQUYHOW-YSSOQSIOSA-N 328.481 5.156 30 20 EKED CC(C)[C@H](CC1CCCCC1)/C(O)=N/[C@H]1CCC(O)=NC12CCC2 328729138 FHDUMYAUOQJVBE-IRXDYDNUSA-N 334.504 5.227 30 20 EKED N#CCCC[C@H](NCc1ccc(C(F)(F)F)cc1)c1ccccc1 353912685 FUMOVMBNSSMZLG-SFHVURJKSA-N 332.369 5.230 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 358329208 OVOOUKZDLLJECQ-XMSQKQJNSA-N 331.463 5.230 30 20 EKED Cc1cc(CSCc2csc(-c3ccoc3)n2)ccc1C#N 447414388 RKQNVZKJSXUVAO-UHFFFAOYSA-N 326.446 5.017 30 20 EKED N#CC[C@H](CC(=O)N1CCCCC[C@H]1c1ccccc1)c1ccccc1 474956055 UMEGNVFVCRYIET-YADHBBJMSA-N 346.474 5.218 30 20 EKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1 486248991 HTESSCSJKNWGOQ-CYBMUJFWSA-N 341.842 5.024 30 20 EKED C=CCCc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 505035851 QCGBLRVUUVCPCC-UHFFFAOYSA-N 338.426 5.141 30 20 EKED CC(C)N(Cc1ccc(C#N)cc1)Cc1nc(-c2ccccc2)cs1 507170415 NJRFLKAJDLTFFF-UHFFFAOYSA-N 347.487 5.092 30 20 EKED C=CCN(Cc1ccc(Cl)s1)Cc1nc2ccccc2s1 510107127 XPCZSIIGJJSBQY-UHFFFAOYSA-N 334.897 5.199 30 20 EKED Cc1ccc([C@H](NCc2ccc(C#N)cc2C(F)(F)F)C2CC2)cc1 517266935 AMBUHZVVPWOZCP-IBGZPJMESA-N 344.380 5.126 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(Br)cc1C(C)C 536324617 LXXCQCCDTBWCBC-UHFFFAOYSA-N 339.277 5.002 30 20 EKED CCc1c(NCc2ccccc2C(C)(C)C#N)cnn1C(CC)CC 559947264 OQOPZFUBEKALKZ-UHFFFAOYSA-N 338.499 5.220 30 20 EKED C=CCCCC(=O)Nc1ccc(Br)c(Cl)c1Cl 569445316 POGMCUXZMJTPHP-UHFFFAOYSA-N 337.044 5.051 30 20 EKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)c(Cl)c1 570067733 YRUITUZDESYGFV-CWTRNNRKSA-N 328.818 5.079 30 20 EKED N#C[C@H](Sc1nc(-c2ccccc2)co1)c1ccc(Cl)cc1 588310528 XEPYTEHOSLXKKV-INIZCTEOSA-N 326.808 5.352 30 20 EKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 594922154 HSVZPGIYPDLQGU-CQSZACIVSA-N 344.380 5.111 30 20 EKED N#Cc1cccc(C2(NCc3ccc(-c4cccs4)cc3)CC2)c1 618302254 QDOBVCDYDPINLJ-UHFFFAOYSA-N 330.456 5.066 30 20 EKED CC(C)Cn1ncc(NCc2ccc(C(C)(C)C#N)cc2)c1C(C)C 619165951 VOTHMJZBVWYJAQ-UHFFFAOYSA-N 338.499 5.076 30 20 EKED Cc1ccc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)o1 789126454 FGZKBZNOCBSKMP-BQYQJAHWSA-N 329.808 5.261 30 20 EKED C=CCC1(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)CCC1 790757914 KPDYRBIGHJPQLF-NRFANRHFSA-N 349.474 5.038 30 20 EKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Cl)c1 797568984 ZEZYNVBQLMCIJN-RISCZKNCSA-N 346.883 5.074 30 20 EKED N#Cc1ccc(CNCc2ccccc2-c2ccccc2)cc1Cl 800895558 HVDXTMCRKZDRCI-UHFFFAOYSA-N 332.834 5.168 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 916138318 DTEDLSZCOOKCSI-XQRVVYSFSA-N 330.598 5.148 30 20 EKED O=C(O)c1cccc(NN=C(CC2CCCC2)CC2CCCC2)c1 1776038592 SBSZZPAUFKLVOC-UHFFFAOYSA-N 328.456 5.313 30 20 EKED Cc1cccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c1C 1777443820 LKFNNZVKINEGTN-VURMDHGXSA-N 336.412 5.112 30 20 EKED N#CCOc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3)cc2)cc1 8321694 GAZOPDAFFSUMRJ-OVCLIPMQSA-N 339.394 5.152 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(C)C)cc1C 48122093 MNNMQIPRVBCDGN-UHFFFAOYSA-N 338.451 5.002 30 20 EKED C[C@H](Nc1cc(Cl)ccc1OC(F)(F)F)c1cccc(C#N)c1 328000378 NSJRFXNVRNXLII-JTQLQIEISA-N 340.732 5.283 30 20 EKED OC(=Nc1cccc2oc(C(F)(F)F)nc12)[C@H]1CCCC(F)(F)C1 328773855 HMOYMAGEGRANFY-QMMMGPOBSA-N 348.271 5.260 30 20 EKED C[C@@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 376867057 QBPGBDBMHDDGDX-IAGOWNOFSA-N 327.431 5.032 30 20 EKED CC(C)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 391934337 OCEVRENZBMULDF-FOIQADDNSA-N 342.870 5.290 30 20 EKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 497476559 ZBAJWZIXXPVDIK-GOSISDBHSA-N 341.842 5.073 30 20 EKED Cc1cc(C)c(C#N)c(S[C@@H](C)c2ccc(OC(F)F)cc2)n1 513270985 HVEXUNDKXDSSFU-LBPRGKRZSA-N 334.391 5.025 30 20 EKED C=C[C@H](CC(=O)N(CC)[C@H](C)c1ccc(F)cc1)c1ccccc1 534623907 SPMMIQHVVYYJGD-IAGOWNOFSA-N 325.427 5.095 30 20 EKED C=CCC[C@H](N[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 539048523 NMHVZMVNSMAJSH-KSSFIOAISA-N 334.385 5.459 30 20 EKED COc1cccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c1 540314481 PNBOBPMDFPWWDU-KRWDZBQOSA-N 342.442 5.085 30 20 EKED CCc1cnc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541382614 AGULJYICPWIKOE-OAHLLOKOSA-N 347.487 5.095 30 20 EKED N#Cc1cccc(C2(N[C@@H]3CCc4c3ccc(Cl)c4Cl)CC2)c1 611475966 DEGJMEYFZPVKHL-QGZVFWFLSA-N 343.257 5.131 30 20 EKED C=C[C@H](CC(=O)N1CC2(CCCC2)[C@H]1c1ccco1)c1ccccc1 617917760 IEUDDSJLAFDYNX-DYESRHJHSA-N 335.447 5.083 30 20 EKED C=CCC[C@@H](N[C@H]1CCCn2nccc21)c1ccc(C(F)(F)F)cc1 657929911 GULVKJKOENLYDM-SJORKVTESA-N 349.400 5.034 30 20 EKED CC(C)n1cc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cn1 732713621 IKGFLVLJSPPZSR-MDWZMJQESA-N 332.403 5.152 30 20 EKED O=C(/C=C/c1cnc2ccc(Cl)cn12)c1ccc2ccccc2c1 737444018 MXBYSTLBISBCGM-CMDGGOBGSA-N 332.790 5.037 30 20 EKED CCCCN(C(=S)Nc1ccccc1C#N)[C@H](C)c1ccc(C)o1 745707775 SPIOLKFFCFCDMC-OAHLLOKOSA-N 341.480 5.020 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccccc1N1CCCCC1 754709088 JFHMXQFIMWWOGP-UHFFFAOYSA-N 348.368 5.109 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCC[Si](C)(C)C 847476487 BQLUNDUGAXQFAV-CQSZACIVSA-N 334.561 5.138 30 20 EKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1cccc(O)c1 916155624 NSYFAUHHPPMYEL-CSKARUKUSA-N 347.395 5.158 30 20 EKED CSc1ccc2cc(COc3ccc(C#N)cc3)c(Cl)nc2c1 7890322 HVRSUOFHFLOOCZ-UHFFFAOYSA-N 340.835 5.061 30 20 EKED C=CCOc1cccc(NC(=O)c2sc3ccccc3c2Cl)c1 14783729 RVXSHGYBMGJPDC-UHFFFAOYSA-N 343.835 5.372 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc3ccccc3c2)c1 113952449 HSJWOPLPHMDWJJ-HTAPYJJXSA-N 344.458 5.372 30 20 EKED C=CCC[C@@H](NCc1nc2ccccc2n1C(F)F)c1ccccc1 180035318 POHQSFZYSHVYQD-MRXNPFEDSA-N 341.405 5.229 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)OC1CCCC1 189894614 TYWPNKOZXFCCSY-LJQANCHMSA-N 329.484 5.215 30 20 EKED COc1ccc(CNc2ccc(C(C)(C)C(F)(F)F)cc2)cc1C#N 428541398 UHBZONPDPOWGAT-UHFFFAOYSA-N 348.368 5.019 30 20 EKED CC[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)c1ccc(C#N)cc1 447543184 REPZGOKHDLACTA-ZWKOTPCHSA-N 342.895 5.489 30 20 EKED C[C@@H](C#N)C(=O)Nc1ccc(-c2ccc(C(C)(C)C)cc2)cc1Cl 468498716 QHXFAPMBVYZAHP-ZDUSSCGKSA-N 340.854 5.403 30 20 EKED N#Cc1ccccc1CSCc1csc(-c2ccccc2F)n1 477220973 QCBNYZVFODERCA-UHFFFAOYSA-N 340.448 5.254 30 20 EKED Cc1csc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c1Cl 480084330 QFZFXZZUXURSFI-AWEZNQCLSA-N 346.883 5.002 30 20 EKED CCC(CC)c1cc(CN[C@@H]2CCCCc3cc(C#N)ccc32)on1 481671988 QXUPBOFNUZUELG-HXUWFJFHSA-N 337.467 5.007 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCCCc3ccccc32)cc1 523700297 URBUKQHUSOVLHB-FQEVSTJZSA-N 347.462 5.077 30 20 EKED CSc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1F 539628202 DQLPFQBNSYLHHE-CQSZACIVSA-N 344.455 5.403 30 20 EKED Cc1ccncc1[C@@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543961589 XXUKMEURCXVTPO-ZWKOTPCHSA-N 341.458 5.341 30 20 EKED C[C@H](CN[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 583090484 TYKXXHCHPCOJKF-OXQOHEQNSA-N 326.871 5.468 30 20 EKED CC1=C(C)C[C@H](C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 592590839 BWRRRNQJEVULRA-XJKSGUPXSA-N 328.481 5.013 30 20 EKED C[C@H](S[C@H](C)C(=O)Nc1ccc(Cl)cc1)c1ccc(C#N)cc1 609826180 ZHTNSHQGYBPAMG-QWHCGFSZSA-N 344.867 5.033 30 20 EKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C2CC2)cc1 611330474 CAGNDJHOPUUKHO-UHFFFAOYSA-N 347.462 5.126 30 20 EKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)s1 675644051 SRBNAUAFGAMNHQ-CQSZACIVSA-N 334.444 5.084 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CCCCCC3)n2)cc1 726321306 FSBFHKYIUJIFJX-KRWDZBQOSA-N 338.476 5.265 30 20 EKED N#Cc1cccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741845180 YLTRGEBVGCVOLP-RUDMXATFSA-N 347.361 5.109 30 20 EKED C=CC[C@H](N[C@@H](C)c1cc(Cl)ccc1OCC)c1ccncc1 766019868 NNRXTZDJYWQFRD-KSSFIOAISA-N 330.859 5.102 30 20 EKED CCCCC[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)C(C)C 813212657 FJMXAYXWGUUDFR-HUUCEWRRSA-N 340.389 5.129 30 20 EKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(CCC#N)cc1 932582171 YTKQCIREYOHSRN-CQSZACIVSA-N 341.842 5.021 30 20 EKED CC(=NNc1ccc(C(=O)O)cc1)c1ccccc1SC(C)(C)C 1776012868 SVUAVIUQAGFMRK-UHFFFAOYSA-N 342.464 5.112 30 20 EKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1csc2ccc(C(=O)O)cc12 1776666063 WHEMUCBTMZVQEM-HJPCULJESA-N 348.423 5.058 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C)c(C2CC2)c1 1776783991 BWHAJTZEYJBHBD-LJQANCHMSA-N 331.500 5.166 30 20 EKED Cc1c(NC(=O)c2ccccc2)cccc1N[C@H](C#N)C1CCCCC1 115606085 PRFUXRUURXYSDO-OAQYLSRUSA-N 347.462 5.132 30 20 EKED CC(C)c1ccccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 118445255 SJUNHMKPJFJJGU-OAHLLOKOSA-N 338.476 5.115 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(-c2ccncc2)cc1 153699925 GUIWQFRFMFTCHZ-IRXDYDNUSA-N 327.431 5.032 30 20 EKED Cc1ccccc1-c1noc([C@@H](C)SCCCC(C)(C)C#N)n1 161959786 JZWFCJHZAYMFHN-CQSZACIVSA-N 329.469 5.169 30 20 EKED CC1(C)CC[C@@H](NCc2cccc(OCCCC#N)c2)c2ccccc21 236747759 PBBWGRHMBOAPMQ-JOCHJYFZSA-N 348.490 5.271 30 20 EKED Cc1ccc2cc(CN[C@H](CCCC#N)c3ccccc3)ccc2n1 353901003 PBBAJQYGQSHTOL-OAQYLSRUSA-N 329.447 5.068 30 20 EKED CC[C@@H](c1ccc(F)cc1F)[S@@](=O)CCC1(C#N)CCCCC1 417153537 VJIMOEQHWKOLBK-SBUREZEXSA-N 339.451 5.029 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 455240515 FDPOKUMZZBYLFO-QGZVKYPTSA-N 338.495 5.048 30 20 EKED CCn1c(S[C@@H](C)CCC#N)nnc1-c1ccc(C(C)(C)C)cc1 470451225 IXFJAYDSFHXBQA-AWEZNQCLSA-N 342.512 5.047 30 20 EKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(C(F)F)c2Cl)cc1 476698875 YIEXHOCERQAMBP-UHFFFAOYSA-N 348.780 5.331 30 20 EKED Cc1ccc(C#N)cc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 476743990 VYFOOSXYQHDYMH-HXUWFJFHSA-N 333.435 5.016 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1Cl 515376878 LEGWHCZJQCEHNO-UHFFFAOYSA-N 341.263 5.275 30 20 EKED C=CC[C@H](C)NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 522645281 MGQLIOUQAPJXEP-ZDUSSCGKSA-N 333.353 5.067 30 20 EKED C=CCC(CC=C)C(=O)N(c1ccccc1)c1nc2ccccc2s1 531571024 MSGWAMVKZSDSTD-UHFFFAOYSA-N 348.471 5.729 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccccc2OC(F)F)CC1 560682744 LAMYNYDHWLZEOI-UHFFFAOYSA-N 342.389 5.104 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Cl)ccc1Cl 565670476 PPJKLVOWFCPHJP-GFCCVEGCSA-N 331.246 5.205 30 20 EKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cc(F)c(Cl)cc1Cl 571008609 AYBMKJRUGHDRGC-XTZNXHDOSA-N 349.236 5.342 30 20 EKED O=C1/C(=C/c2csc(-c3cccs3)n2)Cc2c(Cl)cccc21 728440869 XABPMWMUANAGRN-JXMROGBWSA-N 343.860 5.347 30 20 EKED C=C(C)COc1cccc(NC(=S)N[C@@H](CC)c2cccs2)c1 734379636 XHTXEMOMAZMJDR-INIZCTEOSA-N 346.521 5.141 30 20 EKED CC(C)c1ncc(/C=C/C(=O)c2cc(Cl)sc2Cl)s1 758430058 OJNDQRCUIRNEQD-ONEGZZNKSA-N 332.277 5.531 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2ccc(F)c(Cl)c2Cl)c(F)c1 761487450 SXUPCEJJJCBATP-UTCJRWHESA-N 338.140 5.039 30 20 EKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1cccc(F)c1F 776268735 TZTJZKFUAMETDQ-VOTSOKGWSA-N 339.316 5.062 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@@H]1CC=C(c2ccc(F)cc2)CC1 780746290 YNHNYBAJKDSCLT-DNVCBOLYSA-N 336.410 5.165 30 20 EKED C[C@@H](CC(=O)OCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 783742672 FKEVWDQIYRZTKX-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED C=CC[C@@H](NCc1ccc(-c2cccc(F)c2F)o1)c1ccncc1 790965005 YNZGJUTUIVOVIJ-GOSISDBHSA-N 340.373 5.027 30 20 EKED Clc1cc(Cl)c(NN=C2CCC23CCOCC3)c(Cl)c1 799864312 MPFGWWXPXXULAQ-UHFFFAOYSA-N 333.646 5.005 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCCO2 850471892 UFGIIANDTDEHNS-DYESRHJHSA-N 334.463 5.097 30 20 EKED N#Cc1ccccc1CSc1nc(-c2ccco2)nc2ccccc12 22189083 LAFOPQIXBDLALZ-UHFFFAOYSA-N 343.411 5.054 30 20 EKED CCCN(C(=O)Nc1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 65029285 URMYPJFIOZJYQZ-OAHLLOKOSA-N 347.418 5.310 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1F 189875344 KDZAZTHYOMJISM-UHFFFAOYSA-N 331.818 5.583 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC(c2nc3ccccc3s2)CC1 303740283 YXPDWEVQESWSQC-HNNXBMFYSA-N 347.487 5.109 30 20 EKED CC(C)c1nc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cs1 340447130 OZKHUOOLQBORHN-WBVHZDCISA-N 327.497 5.352 30 20 EKED C=CCC[C@@H](NC(=O)[C@H](C)CC(F)F)c1ccc(C(F)(F)F)cc1 412210807 ZQXQPWZWCHVKNI-BXUZGUMPSA-N 349.343 5.120 30 20 EKED N#Cc1ccccc1SCc1coc(-c2ccc(Cl)cc2)n1 439718140 WCSCROFTLKNXTD-UHFFFAOYSA-N 326.808 5.159 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 449445705 LDMLGYLFSKJSEC-XDKFSHSGSA-N 336.401 5.013 30 20 EKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nc(-c2ccccc2)no1 465386712 CAFHIDKWAHKIPY-LLVKDONJSA-N 341.823 5.115 30 20 EKED C=CCN(Cc1cccs1)Cc1cc(Cl)cc2cccnc12 507545271 DUKSAEZZUJZXSJ-UHFFFAOYSA-N 328.868 5.138 30 20 EKED C[C@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)cc1F 512278111 IVCRXDXWCXPQGG-INIZCTEOSA-N 337.442 5.251 30 20 EKED Cc1ccc(SCC(F)(F)F)c(NCc2ccccc2C#N)c1 522979631 CYXLOJDTDWRTJM-UHFFFAOYSA-N 336.382 5.133 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccc(SC2CCCCC2)cc1C 524656875 XLBFEWUXEGSILO-UHFFFAOYSA-N 346.540 5.850 30 20 EKED C=CCCOCCCCC(=O)N1CCCCC[C@H]1c1ccc(CC)o1 539402303 GGUNTOLSCUIEDG-IBGZPJMESA-N 347.499 5.049 30 20 EKED N#CCCCCN[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 539970505 VLHKACQGIFEFMQ-AEFFLSMTSA-N 338.417 5.405 30 20 EKED Cc1ccnc(Oc2cc(NCc3ccc(CC#N)cc3)ccc2C)c1 542225519 QHTVNZVRQDJUNM-UHFFFAOYSA-N 343.430 5.169 30 20 EKED N#Cc1ccc(Oc2ccc(NC(=O)Nc3ccccc3F)cc2)cc1 549934850 JUDZILIVHZMPOE-UHFFFAOYSA-N 347.349 5.134 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccccc2)s1)c1ccccc1 552312948 DCKDPAURAHXZJY-NRFANRHFSA-N 346.499 5.940 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H]1CC[C@@H](C#N)C1 555425021 WBXVZALMUFRXQK-NORZTCDRSA-N 345.899 5.115 30 20 EKED C=CCOc1ccc(CNCc2cnc(C3CCCCC3)s2)cc1 560496687 SFFQQLQCKCJUHQ-UHFFFAOYSA-N 342.508 5.045 30 20 EKED Cc1ccc2c(C(=O)[C@H](C#N)c3ccc4ccccc4n3)csc2c1 684629869 IZERWHLPNKSRMD-MRXNPFEDSA-N 342.423 5.248 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(C#N)cc3)s2)cc1 727654003 DZFMUOOVRBFXHL-FMIVXFBMSA-N 344.439 5.195 30 20 EKED CCC/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 729320490 ZKBRFGOTUCVHBK-CXKPLTABSA-N 338.838 5.290 30 20 EKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(O)c(C)c3)s2)cc1 734304394 IIGSNDPJSOILPW-NTMALXAHSA-N 335.428 5.029 30 20 EKED COc1ccc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)c2ccccc12 746345592 IFQHNGLKLWEWKD-BENRWUELSA-N 348.446 5.139 30 20 EKED CCc1oc2ccccc2c1C=NO[C@H](C)c1ncc(C(C)(C)C)o1 756844180 CAADPVKGGRGHHV-CYBMUJFWSA-N 340.423 5.392 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CC[C@@H](C)c3ccccc32)c1 772985753 YANLRCQVUCOUBG-CDMIOBSGSA-N 334.463 5.096 30 20 EKED CCC/C(C)=C/C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 920222165 REIOHAFEWNRCIF-BMRADRMJSA-N 348.446 5.017 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Br)cs1 194121270 MUUXGZALKNNRCI-DOMZBBRYSA-N 349.297 5.206 30 20 EKED O/C(CC/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)=N/Cc1ccccc1 329065775 LAZFESIFWNWUNC-GBESFXJTSA-N 342.483 5.096 30 20 EKED Cc1cc(C)c(-c2nnc(SCCCCC(C)(C)C#N)o2)c(C)c1 436191934 ZVXWETHUKATPGD-UHFFFAOYSA-N 343.496 5.474 30 20 EKED C=C(C)[C@H]1OCC[C@H]1CNC(=O)Nc1ccc(C(C)C)cc1C(C)C 436314668 YZSDSAZIWNVDGU-FXAWDEMLSA-N 344.499 5.036 30 20 EKED N#CC1CCC(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)CC1 442870081 UFYMJUAAMCZTEZ-OBFZPWGMSA-N 336.454 5.029 30 20 EKED C=CCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 481752359 CUKXPSVOHQEATO-UHFFFAOYSA-N 336.460 5.626 30 20 EKED CC(C)(C#N)c1ccccc1CSCc1ccn(C2CCCC2)n1 486740526 GWSWQPKVKFBZGX-UHFFFAOYSA-N 339.508 5.233 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](c2cccc(C)c2)C1 505035198 KXFSXAOGQANEOS-FQEVSTJZSA-N 334.463 5.135 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512624972 LCAJRYXHTUMTRB-CABCVRRESA-N 342.483 5.610 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(-c2ccc(F)cc2)cc1 537327278 KIBMWMZCQIGTSF-CQSZACIVSA-N 336.435 5.277 30 20 EKED N#CCCCOc1cccc(N[C@H]2CCCc3c2[nH]c2ccccc32)c1 567424468 CRHJLKPEGMQNGP-NRFANRHFSA-N 345.446 5.340 30 20 EKED N#CCCCCCC(=O)Nc1nc(-c2cccc3ccccc23)cs1 588264569 DBEODOVMDCNRNP-UHFFFAOYSA-N 349.459 5.376 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 588757995 RDQAJSIVRYAGOQ-MUSGIIIZSA-N 330.497 5.007 30 20 EKED CCC[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccccc1 600841913 SGKFZRUIYLZDBZ-OAHLLOKOSA-N 338.476 5.021 30 20 EKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CCCCC2)c1ccccc1 602774131 BPHSNDAULLIOHO-CQSZACIVSA-N 338.476 5.021 30 20 EKED CCCCCC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400889 XGADOQSKTRZIFY-HZPDHXFCSA-N 347.528 5.561 30 20 EKED C=CC[C@@H](NC(=O)C[C@H](C)c1ccc(C(C)C)cc1)c1ccncc1 737854610 KKYPSCKJMJLSRL-LAUBAEHRSA-N 336.479 5.132 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(OC(C)(C)C)cc2)cc1 764921342 RXNIAYXBDKCZDM-ACQAZONXSA-N 349.430 5.051 30 20 EKED CSc1ccc(C(=O)/C=C\c2cncc3ccccc23)c(Cl)c1 765613517 MULHFPCXCZSZOU-TWGQIWQCSA-N 339.847 5.506 30 20 EKED Cc1ccccc1-c1cccc(CNc2cccc(OCC#N)c2)c1 779587552 BMWMDVIJSZRVRX-UHFFFAOYSA-N 328.415 5.177 30 20 EKED C=CCCc1ccccc1NC(=O)c1nc(-c2cccs2)oc1C 800156950 CHVWXBFSLNSPOL-UHFFFAOYSA-N 338.432 5.082 30 20 EKED CC[C@H](NCC(C)(C)CCC#N)c1cc(Cl)cc(Cl)c1O 806177734 IEFNIZIVIHHBBC-AWEZNQCLSA-N 329.271 5.070 30 20 EKED CCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 916650301 BJNXLHHFEJIAOZ-OAHLLOKOSA-N 346.883 5.610 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NC/C=C\c1cc(C)c(C)cc1C 1776783289 MSEMAKCZFMFRSX-XPTLAUCJSA-N 345.527 5.418 30 20 EKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2)cc1 90001040 CPOIXHAOCMLSAQ-OAQYLSRUSA-N 347.462 5.245 30 20 EKED Cc1ccc(/C=C\CC(=O)Nc2ccccc2SCCC#N)cc1 255730930 YDMNREUKSFYPIJ-XQRVVYSFSA-N 336.460 5.043 30 20 EKED C/N=C(/O)c1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329662264 PGYMHIUKDZAERY-AEGPPILISA-N 348.874 5.469 30 20 EKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)ccc1C(F)(F)F 414450558 GOFJXUDAOHTXRB-LJQANCHMSA-N 346.396 5.539 30 20 EKED N#CCCC[C@H](NCc1ccc(-c2ccsc2)cc1)c1ccccc1 433026341 PEJPCTWEXMPRPM-QFIPXVFZSA-N 346.499 5.940 30 20 EKED N#CCC[C@@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 436389240 LVFOTHHPGLFHTF-MRXNPFEDSA-N 348.233 5.160 30 20 EKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 461922631 NOXQIKSWIIEKBX-CVEARBPZSA-N 346.430 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCC[C@@H](C)C1 475581111 DVBYGQURHPXXCQ-SJLPKXTDSA-N 328.500 5.581 30 20 EKED CCc1ccccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482377367 BMERWQWHFVWTGD-UHFFFAOYSA-N 342.398 5.165 30 20 EKED C[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1c[nH]c2ccccc12 486336612 ZWFHGLGMZFBKGX-OAHLLOKOSA-N 345.446 5.101 30 20 EKED Cc1ccccc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 503193954 ROHVXLWUJYAHQK-UHFFFAOYSA-N 343.386 5.303 30 20 EKED CC[C@H](CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1)c1ccccc1 504329826 VONNMRBUPUPUQS-IEBWSBKVSA-N 334.463 5.052 30 20 EKED C=C[C@H](CC(=O)Nc1ccc(C)cc1Br)c1ccccc1 534704074 DSWRXIKIXFUFBB-CQSZACIVSA-N 344.252 5.056 30 20 EKED CCN(Cc1ncc(-c2ccccc2)s1)[C@H](C)c1ccc(C#N)cc1 538308064 KASFNSXFDJABHS-MRXNPFEDSA-N 347.487 5.265 30 20 EKED CC1=C(C)C[C@@H](C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 592590837 BWRRRNQJEVULRA-CJNGLKHVSA-N 328.481 5.013 30 20 EKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(C2(C#N)CC2)cc1 596978688 COXIQCYCUYZULS-OAHLLOKOSA-N 347.487 5.044 30 20 EKED C=CCCCCCN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 606816646 HWAAGLPEQBXWMR-IAGOWNOFSA-N 339.401 5.014 30 20 EKED CC(C)(C)[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1 735308568 JKQLHXFEDZMIMH-IBGZPJMESA-N 342.870 5.119 30 20 EKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 742430765 AUDMREKSMOLFND-VOTSOKGWSA-N 329.421 5.215 30 20 EKED O=C(/C=C\c1cnn(-c2ccccc2)c1)c1cc(Cl)ccc1Cl 747003474 HSRDESSLLJUEKY-TWGQIWQCSA-N 343.213 5.075 30 20 EKED Cc1cc(N[C@@H](C)c2ccc(OCC#N)cc2)cc(C(F)(F)F)c1 754123550 LKYFPKYOZZDCEX-ZDUSSCGKSA-N 334.341 5.089 30 20 EKED CCN(Cc1ccc(O[C@@H](C)C#N)cc1)[C@H](C)c1cc2ccccc2o1 769081599 LFJKJEAPPKQBQJ-DLBZAZTESA-N 348.446 5.307 30 20 EKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(OC)c(OC)c2)cc1 776794409 HNCDGOMYBNJGJV-AWEZNQCLSA-N 347.842 5.008 30 20 EKED Oc1ccc(Cl)cc1C=Nc1ccc2nc(C(F)F)sc2c1 794676329 MSXMMAGQKJLDEO-UHFFFAOYSA-N 338.766 5.344 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(C(C)C)cc1 794994831 ILXBCYWHNXIHMG-UHFFFAOYSA-N 338.520 5.585 30 20 EKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccccc2C#N)cc1 799499054 HMYIDRDBPZIVNI-NTCAYCPXSA-N 339.394 5.130 30 20 EKED CC(/C=C\C(=O)c1cncc(F)c1)=C/c1ccccc1C(F)(F)F 799893922 WSMPHXHGNGEVTO-IJDSZTBYSA-N 335.300 5.082 30 20 EKED CCCCC[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)C(C)C 813212653 FJMXAYXWGUUDFR-CABCVRRESA-N 340.389 5.129 30 20 EKED CC(C)c1ccc(-c2ncc(COC(=O)CCCCC#N)s2)cc1 848862992 YVJWQAYAEDMNAR-UHFFFAOYSA-N 342.464 5.061 30 20 EKED Cc1cc(C)c(-c2nnc(SCC3CCC(C#N)CC3)o2)c(C)c1 916944155 VKVBPVSZUBGHIH-UHFFFAOYSA-N 341.480 5.084 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 917043020 FYNRQERHWYVPMX-SOFGYWHQSA-N 339.372 5.121 30 20 EKED C#Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)c1 919903212 MQXVELYTODJCDY-JOCHJYFZSA-N 340.426 5.190 30 20 EKED CC(=NNc1ccccc1C(=O)O)c1cc2c(ccc3ccccc32)o1 1776030078 VLQLKKJFKZWTSF-UHFFFAOYSA-N 344.370 5.120 30 20 EKED CC(C)c1noc([C@@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)n1 60036134 PDZOCOLODRFTFK-CQSZACIVSA-N 348.406 5.030 30 20 EKED CCN(CCC#N)C(=O)Nc1ccc(SC2CCCCC2)cc1C 78534704 XFOQZHSLOLFQMY-UHFFFAOYSA-N 345.512 5.187 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1coc2ccccc12 113053355 AMYQBGWHLPXRLW-CYBMUJFWSA-N 336.416 5.079 30 20 EKED CC[C@@H](Nc1ccc(C#N)c(Cl)c1)c1nc(C(F)(F)F)cs1 301434058 QLPIAWZJVRNEKQ-LLVKDONJSA-N 345.777 5.250 30 20 EKED CC[C@H]1CC[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 433144559 MZAJTIMOGRUYCB-BZUAXINKSA-N 345.512 5.171 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Cl)cc1F 435903117 RWXVWMUOHMPRJJ-GFCCVEGCSA-N 334.847 5.343 30 20 EKED CC#CCCCC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1 466417643 PTVCXAOAQLUYJQ-GOSISDBHSA-N 349.474 5.075 30 20 EKED Cc1cc2occ(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2cc1C 473495102 YVYHKHKEZKIDKH-AWEZNQCLSA-N 346.411 5.149 30 20 EKED C=CCC[C@H](C(=O)Nc1ccc(C)c(-c2ncco2)c1)c1ccccc1 489693332 XYULIGLKVIPLPD-IBGZPJMESA-N 346.430 5.339 30 20 EKED CCC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 511913587 BNEQVDQYWBTYMC-INIZCTEOSA-N 332.403 5.005 30 20 EKED CC(C)COc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512641121 DKHBLPDKGPEODG-HOTGVXAUSA-N 340.442 5.144 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H]1CCC[C@@H](C)C1 520824913 HWKRMJXNBMJTHD-BZUAXINKSA-N 330.497 5.093 30 20 EKED C[C@H](SCc1coc(-c2cccc(F)c2)n1)c1ccc(C#N)cc1 522841712 LQWJKAYOMFNRCB-ZDUSSCGKSA-N 338.407 5.347 30 20 EKED C=CCC[C@H](NCc1ncc(-c2ccccc2F)o1)c1ccccc1 538257848 PJKRDDRZPWUUGB-IBGZPJMESA-N 336.410 5.278 30 20 EKED CCC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(F)cc1F 538508716 ZXINPMVJGXWNDE-HXPMCKFVSA-N 332.369 5.168 30 20 EKED N#Cc1ccc(SCc2nc(C3CC3)cs2)cc1C(F)(F)F 542214503 YALMOYLGZHTYCZ-UHFFFAOYSA-N 340.395 5.203 30 20 EKED CCCCOc1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 585765038 CJGHLCHQFOCHKU-OAHLLOKOSA-N 342.870 5.241 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 588154964 RGYLEFMOZOAOEE-UHFFFAOYSA-N 342.826 5.545 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](C)CC(C)(C)C 609427764 JJSLKIZKGDLIQZ-GJZGRUSLSA-N 332.513 5.482 30 20 EKED CCCCCCCCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 732018768 NLYGUXUPZOYBMU-UHFFFAOYSA-N 346.515 5.669 30 20 EKED CCCCCCCCCN(C)C(=O)N[C@H](C)c1cccc(C#N)c1 743709220 UGWKAOYSJARPHD-QGZVFWFLSA-N 329.488 5.011 30 20 EKED O=C(/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ccsc1 749105102 QVSKGJILBVAEMG-XQRVVYSFSA-N 341.413 5.281 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)o2)cc1 761804896 UIQQPYLJPQDHOG-ONOODXEBSA-N 343.382 5.134 30 20 EKED C=CCCC[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775985741 PLYKIHSHKXDMHA-LAUBAEHRSA-N 347.462 5.208 30 20 EKED CCNc1ccc(C#N)cc1NCc1csc(C2CCCCC2)n1 776850759 XNEJQTCJZBOSLY-UHFFFAOYSA-N 340.496 5.106 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccn2)cc1C 819840337 MDVDFVRQTSZMQW-OUKQBFOZSA-N 343.426 5.174 30 20 EKED C#CC[C@H]1CCCN(C(=O)Nc2c(CCC)cccc2C(C)C)C1 831715850 ADOKCNNRDSTDLU-KRWDZBQOSA-N 326.484 5.030 30 20 EKED COc1cccc(-c2nc(/C=C\C(=O)c3ccccc3C)cs2)c1 916155974 SVEJMWAHCURNIH-KHPPLWFESA-N 335.428 5.023 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Br)cc1 37284434 SBCTXRUKVOTQAR-SCLBCKFNSA-N 343.268 5.123 30 20 EKED CSc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1F 90665301 OABHGJFEJXOOMW-KSSFIOAISA-N 328.456 5.243 30 20 EKED C[C@H](N[C@@H](C)c1ccc(SCC(F)F)cc1)c1ccc(C#N)cc1 154319832 DUNFRRNRLFFCTQ-KBPBESRZSA-N 346.446 5.327 30 20 EKED C[C@H](c1ccc(C#N)cc1)N1CCC(c2nc3ccccc3s2)CC1 303740286 YXPDWEVQESWSQC-OAHLLOKOSA-N 347.487 5.109 30 20 EKED N#CCCC[C@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 340444328 DAKISKHSKPKGKI-LEWJYISDSA-N 346.474 5.458 30 20 EKED Cc1sc2ncnc(N[C@H](CCCC#N)c3ccccc3)c2c1C 431143515 KQIFTRFCOLWNIA-MRXNPFEDSA-N 336.464 5.155 30 20 EKED CCn1c(SCCCCC(C)(C)C#N)nnc1-c1cccc(C)c1 436143068 UJPWVKKVMRTVBR-UHFFFAOYSA-N 342.512 5.086 30 20 EKED C=CCCOCCCCC(=O)Nc1c(C)cc(Cl)c2ccccc12 462213709 VPVZDGYJHXZNQY-UHFFFAOYSA-N 345.870 5.503 30 20 EKED N#CCCCC(=O)Nc1cccc(Sc2ccc(Cl)cc2)c1 464098678 CDIPQIFYFULGDE-UHFFFAOYSA-N 330.840 5.124 30 20 EKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)cc1 468281954 NOWUHJZQKCSIHU-UHFFFAOYSA-N 332.790 5.131 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CCCC[C@@H]2C[C@H]1C 475552847 JCFASMGRSKEXOZ-POAQFYNOSA-N 340.511 5.723 30 20 EKED C=CCc1cc(CN[C@H](c2ccccc2)C(C)(C)C)cc(OC)c1O 500262050 BNIBVCLEBIHMGB-OAQYLSRUSA-N 339.479 5.006 30 20 EKED N#CC1(CCCSCc2cc(Cl)ccc2Cl)CCOCC1 507694062 JVPHLBCNJIWUEZ-UHFFFAOYSA-N 344.307 5.327 30 20 EKED Cc1ccc(CN[C@H](C)c2ccc(C#N)cc2F)c(OC(C)(C)C)c1 512668183 TVAKGQFOBDAJTJ-OAHLLOKOSA-N 340.442 5.034 30 20 EKED C=C(C)CN(CC)C(=O)Nc1ccccc1Oc1cccc(F)c1 520263187 LCUMKIPOVQMEHK-UHFFFAOYSA-N 328.387 5.048 30 20 EKED Cc1ccccc1-c1cnc(CS[C@H](C)c2cccc(C#N)c2)o1 525955551 HXTGSECCNBGKJV-OAHLLOKOSA-N 334.444 5.516 30 20 EKED Cc1nc(-c2ccc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)cc2)cs1 540597422 NSJQKAMWUFVISQ-HUUCEWRRSA-N 347.487 5.402 30 20 EKED C[C@H](N[C@@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 543961292 HTBHFCWSNLUVSN-HOTGVXAUSA-N 332.472 5.699 30 20 EKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cl 550831237 UQEASSWSSHFIKR-HNAYVOBHSA-N 342.870 5.434 30 20 EKED CC(C)(CCC#N)CN[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 554366179 HXPNXYHLHVRQJC-IAGOWNOFSA-N 338.417 5.261 30 20 EKED Cc1cccc(C)c1[C@@H](C)NCc1ccc(C#N)cc1C(F)(F)F 558574760 PWPPOPXSDVYHOQ-CQSZACIVSA-N 332.369 5.045 30 20 EKED N#C[C@H](N[C@@H](COCc1ccccc1)c1ccccc1)C1CCCCC1 583328796 DBIAIOWEGPWIDH-GOTSBHOMSA-N 348.490 5.007 30 20 EKED C=CCCNc1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1C 584702702 YNVOVCOQAMLQRI-UHFFFAOYSA-N 348.368 5.254 30 20 EKED CCc1ccsc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 609784672 NKKYHTPLVYEBFD-UHFFFAOYSA-N 344.505 5.155 30 20 EKED C[C@@H](NC(=O)Nc1ccccc1-c1cccs1)c1cccc(C#N)c1 610318110 IUUMLFBTENNNOT-CQSZACIVSA-N 347.443 5.169 30 20 EKED CCC/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 729320499 ZKBRFGOTUCVHBK-YPHWWSSASA-N 338.838 5.290 30 20 EKED CC[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(C)cc1 739144472 ZHFHCMRWMMQAPV-WBVHZDCISA-N 348.471 5.365 30 20 EKED CC1(C)CCC(CC(=O)[C@@H](C#N)c2nc3ccccc3s2)CC1 752474701 YCQGXOJZVJGJDI-CQSZACIVSA-N 326.465 5.079 30 20 EKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2)s1 756686026 QROBAVXWESLJLA-MRXNPFEDSA-N 348.471 5.168 30 20 EKED O=C(/C=C/c1cc2ccccc2s1)c1c(Cl)nc2sccn12 758434459 RVYKFKJCRJQXQA-AATRIKPKSA-N 344.848 5.160 30 20 EKED CSc1ccc(C(=O)/C=C/c2cnc(C3CCC3)s2)cc1F 760266726 ZHAWHCDBTNQVKI-VOTSOKGWSA-N 333.453 5.168 30 20 EKED CCCCCCCCCCC(C)(C)C(=O)N1CCC12CCOCC2 765218631 TWCBMSSYIVBDCE-UHFFFAOYSA-N 337.548 5.325 30 20 EKED C=CC[C@H](N[C@@H]1CCSc2c(Cl)cccc21)c1ccncc1 766019862 NMLWVVKPCXIRIB-DLBZAZTESA-N 330.884 5.179 30 20 EKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1O 815636454 VOSNUMVKVBYAFV-MOPGFXCFSA-N 326.415 5.007 30 20 EKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC 886648707 BRMPLCHGEFUDTE-IBGZPJMESA-N 347.499 5.118 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776697866 SXFNLGKXOOCJOQ-OEYXZAGESA-N 342.822 5.448 30 20 EKED CCc1ccc(-c2csc(N=C(O)[C@@H]3CCC(=O)C[C@H]3C)n2)s1 328909066 DKEQNLBQXWQIKY-ZWNOBZJWSA-N 348.493 5.027 30 20 EKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CSCCC#N 413014892 JJOYIOUYMFRNRY-UHFFFAOYSA-N 342.411 5.284 30 20 EKED N#CCCCOc1cccc(N[C@H](CCc2ccccc2)C(F)F)c1 498752652 MCVNQGQWYPZWDQ-LJQANCHMSA-N 344.405 5.048 30 20 EKED CCCN(C(=O)Nc1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 516172386 LBKWCXLLEDOAOF-OAHLLOKOSA-N 347.418 5.310 30 20 EKED N#Cc1cccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)c1 518375213 GJLRBGKLDMTTSZ-UHFFFAOYSA-N 332.790 5.131 30 20 EKED CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 576811897 HRHXGZDEPBWZRH-UHFFFAOYSA-N 343.386 5.019 30 20 EKED Cc1cc(C(=O)N[C@H](C#N)CC(C)C)sc1-c1cccc(Cl)c1 608822864 AQPXDAJHWLJBFP-HNNXBMFYSA-N 346.883 5.045 30 20 EKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1cccc2ccccc12 609387077 JSEIWCWECRSRCE-IAGOWNOFSA-N 346.499 6.265 30 20 EKED C[C@H](SCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(C#N)cc1 609825539 CZRCAYOIFZUDPR-NSHDSACASA-N 332.812 5.114 30 20 EKED C[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1cccc(C#N)c1 612605162 CVOUEQJNAYKEEF-JTQLQIEISA-N 349.768 5.032 30 20 EKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(F)c(C3CC3)c2)c(Cl)c1 619619522 XBDUTKHOCAFKKN-UHFFFAOYSA-N 349.192 5.134 30 20 EKED Cc1ccc([C@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)cc1 740874442 SMOABLFYCAJSJN-QFIPXVFZSA-N 346.861 5.399 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)cc(Cl)c2)cc1 755706006 QEGCPENISZSSQE-RPTYSRGTSA-N 346.213 5.180 30 20 EKED CC(=O)Nc1ccc(/C=C2\CCc3c(sc4ccccc34)C2=O)cc1 763102665 ZPNXLOGZUAIPKO-NTCAYCPXSA-N 347.439 5.072 30 20 EKED C/C(=C\C(C)(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772161366 IOCURHYALBSPCR-KETLNSEPSA-N 332.447 5.273 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3cccc(F)c3F)cs2)cc1 776267886 IEDKGQRSMKAHGL-MDZDMXLPSA-N 341.382 5.293 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccccc1C(F)(F)F 789128417 SWVRPOUKBSNJCY-BQYQJAHWSA-N 349.333 5.318 30 20 EKED N#Cc1sc(N[C@@H](c2ccccc2)c2ccc(F)cc2)nc1Cl 804352651 VSDIHDOYZOPYPD-HNNXBMFYSA-N 343.814 5.009 30 20 EKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1O 815636225 RDQZILVSJRNSOR-OALUTQOASA-N 342.870 5.521 30 20 EKED CCCCCCCCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917025225 IHVLXQMIVXBCSM-KRWDZBQOSA-N 340.492 5.737 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1cccnc1 920062935 IGBBWJDHGAMZOC-CLFYSBASSA-N 343.304 5.257 30 20 EKED COc1ccc2cc([C@H](C)N[C@H](CCC#N)c3ccccc3)ccc2c1 90665695 YKRUXWGNILMACI-GAJHUEQPSA-N 344.458 5.544 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(C#N)s1 176973051 LZNLWLQNBGFFQB-SFHVURJKSA-N 338.501 5.063 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccc(F)c(F)c1 191507775 JFEXXYWUFQMNAT-DJJJIMSYSA-N 333.426 5.019 30 20 EKED Cc1ccc(C)c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 191947785 KSILBPFFOLOKOR-AWEZNQCLSA-N 339.464 5.199 30 20 EKED C=CCCSc1nnc(-c2ccccc2Cl)n1C1CCCC1 303880867 YODUSWDKVGEKTH-UHFFFAOYSA-N 333.888 5.382 30 20 EKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nc(C2CC2)no1 329061618 JRJQNYAZELLXPB-LLLHUVSDSA-N 345.487 5.207 30 20 EKED CC1(C)CC[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340444163 GQASTBBTQVQZJD-VXKWHMMOSA-N 332.491 5.824 30 20 EKED CCN(C(=O)CC1CC(c2ccccc2)C1)[C@H](C)c1ccc(C#N)cc1 409753759 QQFJVIUXGYSSOZ-BWDFOLQRSA-N 346.474 5.052 30 20 EKED C[C@H](SCC1(C#N)CCC1)c1ncc(-c2ccc(Cl)cc2)o1 419589994 WBBQAPIADHFBAK-LBPRGKRZSA-N 332.856 5.483 30 20 EKED CCC1(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCCC1 461015437 NBECMPIMZJQWCE-HNNXBMFYSA-N 330.497 5.237 30 20 EKED Cc1ccccc1-c1ccc(CN(C(=O)CCCC#N)C(C)C)s1 462033681 ARLYRZOPPRMCGQ-UHFFFAOYSA-N 340.492 5.154 30 20 EKED C=C(C)C[C@H](C)C(=O)N1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 466650555 JIKHIWYTTMZBFY-KEYYUXOJSA-N 339.401 5.217 30 20 EKED C=CCC(CC=C)C(=O)N(Cc1ccco1)c1ccc(F)cc1C 468599473 JGEKUAUWBRADGL-UHFFFAOYSA-N 327.399 5.029 30 20 EKED N#CC[C@@H](CC(=O)N1CCC[C@H]1CCC1CCCC1)c1ccccc1 476379289 VCTGCPTWCIGYPS-SFTDATJTSA-N 338.495 5.035 30 20 EKED C=CCCCC(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 480904349 WEEXBIDRRASPPW-MRXNPFEDSA-N 325.374 5.115 30 20 EKED C=CCSc1ccccc1C(=O)Nc1ccccc1OCC1CC1 486403477 GKLKUHCOLXUBBF-UHFFFAOYSA-N 339.460 5.006 30 20 EKED C=CCN(Cc1cccs1)C(=O)c1ccccc1SC(C)C 493137618 IBADNQKOWXKEQF-UHFFFAOYSA-N 331.506 5.077 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 536841552 WMDFIBYJOXANPL-BEFAXECRSA-N 342.870 5.434 30 20 EKED COc1cccc(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)cc2)c1 538395394 MRJSPKYCDJULDJ-KRWDZBQOSA-N 342.442 5.085 30 20 EKED C=C[C@H](Cc1nc(-c2ccccc2COC(C)C)no1)c1ccccc1 547055863 YAQJTNCMGYYKAF-QGZVFWFLSA-N 348.446 5.174 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 556203541 RUNMMQOUXMYNBP-KXBFYZLASA-N 346.396 5.791 30 20 EKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2SC[C@H](C)C#N)C1(C)C 609376750 IWFQWNPEXYYPOO-IIDMSEBBSA-N 342.508 5.115 30 20 EKED CC(C)(C#N)c1ccc(CNc2ccccc2CCC(F)(F)F)cc1 614058576 GLODBJLXXQPATM-UHFFFAOYSA-N 346.396 5.595 30 20 EKED Cc1cc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)c(C)s1 727975736 HHLRSAAKVOSQON-HJWRWDBZSA-N 325.458 5.385 30 20 EKED Cc1nc(-c2ccc(N=Cc3cc(Cl)ccc3O)cc2)cs1 730546569 FTUOTHXFALHBAU-UHFFFAOYSA-N 328.824 5.228 30 20 EKED FC(F)Oc1cccc(Cl)c1C=NNc1cccc(Cl)c1 732924436 SYDWMCIAFUJYDW-UHFFFAOYSA-N 331.149 5.041 30 20 EKED N#CCCCOc1cccc(NC(=O)Nc2ccc3ccccc3c2)c1 733615846 ZNZDSHGIUUBNBE-UHFFFAOYSA-N 345.402 5.166 30 20 EKED COc1ccccc1-c1ccc(/C=C\C(=O)c2scnc2C)cc1 741467125 HBIZHGCFNLPPQQ-XFXZXTDPSA-N 335.428 5.023 30 20 EKED Cc1ccc(CCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 746417455 YXVWZBQAHFWGGV-HXUWFJFHSA-N 342.442 5.133 30 20 EKED C#CC[C@@H](N[C@H](C)c1ccc(N2CCCCC2)cc1)c1ccccc1 773118068 YKNSGMPIYQKMHP-AUSIDOKSSA-N 332.491 5.092 30 20 EKED N#CCCC[C@@H](NCc1cc(Cl)cc(Cl)c1O)c1ccccc1 814304577 OFQJTVLAHPXLSA-QGZVFWFLSA-N 349.261 5.224 30 20 EKED CC(=NNc1nc2cc(Cl)ccc2cc1C)c1ccc(C)nc1C 814897705 SADXDTRPPKLAJN-UHFFFAOYSA-N 338.842 5.045 30 20 EKED COc1ccccc1-c1nc(CSCCCCC(C)(C)C#N)co1 865284695 FPXJCRDBLZXXOR-UHFFFAOYSA-N 344.480 5.303 30 20 EKED CC(C)(C)c1cc(NC(=O)c2cscc2C(F)F)c(C#N)s1 889708310 UOXWAVJRZUMTDH-UHFFFAOYSA-N 340.420 5.169 30 20 EKED CCc1oc2ccccc2c1C=NOCc1csc(C(C)(C)C)n1 918185467 AGPNRXHCGUQADK-UHFFFAOYSA-N 342.464 5.300 30 20 EKED CCCCCCCC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 918389181 DJODXCICTPSWPC-UHFFFAOYSA-N 349.902 5.122 30 20 EKED O=C(O)c1ccc(NN=C2CCC[C@H](C3CCCCC3)C2)cc1F 1776076879 KQURPPUNLOUKGJ-AWEZNQCLSA-N 332.419 5.062 30 20 EKED Cc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1C 1777433868 GUNZKVYQXONMLX-FNORWQNLSA-N 336.412 5.112 30 20 EKED N#CCc1ccc(NC(=O)c2sc3cc(F)ccc3c2Cl)cc1 16495776 BXMKMKGDPYKXTO-UHFFFAOYSA-N 344.798 5.012 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1Cl 66907449 FBGKDWGQMRFHOK-GFCCVEGCSA-N 345.855 5.378 30 20 EKED CCCCCCCCCCCCCCCC[C@@H](CO)CCCC 141557352 XAPVLYDBPDYDAB-QFIPXVFZSA-N 326.609 7.657 30 20 EKED CC[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177750241 MMZWWMQWHCZHLZ-GDBMZVCRSA-N 344.505 5.014 30 20 EKED CC[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 195635631 BCWWTARXTSTAOZ-SFHVURJKSA-N 349.434 5.147 30 20 EKED CCC(CC)(C(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)cc1 303109060 FQPGKARPGVJNSM-UHFFFAOYSA-N 340.854 5.103 30 20 EKED CC1(C)CCC[C@H](C/C(O)=N/CC[C@H]2C(O)=Nc3ccccc32)C1 328793616 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5.029 30 20 EKED C=CCCCN(C)C(=O)c1oc2cc(OC)ccc2c1-c1ccccc1 522995490 VLAGYHXEHCPXLZ-UHFFFAOYSA-N 349.430 5.147 30 20 EKED CC(C)CCC[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 523006384 AYVSZSJVUSSDJO-JKSUJKDBSA-N 347.528 5.275 30 20 EKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(Cl)c1Cl 551807283 DJUKNZZFFOIUCT-GFCCVEGCSA-N 331.246 5.205 30 20 EKED COc1ccc(CC[C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 568891739 XYAXRDFXKOUFNN-AVRDEDQJSA-N 336.479 5.041 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cc(C)ccc1SCC(F)(F)F 605941295 HXYQPJKDDBLDEU-UHFFFAOYSA-N 346.418 5.079 30 20 EKED CCCCN(Cc1ccccc1Cl)C(=O)Nc1cccc(C#N)c1 608861003 VGHVRZJQDKTGME-UHFFFAOYSA-N 341.842 5.046 30 20 EKED CCc1ccccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609990726 VHNFQZVSRABNMG-UHFFFAOYSA-N 341.414 5.117 30 20 EKED CCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@@H](CC)c1ccccc1 610356852 BAEVREWCIFTCFB-UTKZUKDTSA-N 349.478 5.192 30 20 EKED C=CC[C@H](NCc1ccc(Sc2ccccc2)cc1)c1ccncc1 754058411 COHUEFFBKPETIS-QFIPXVFZSA-N 346.499 5.640 30 20 EKED O=C(/C=C/c1cscc1Cl)c1sccc1Br 771856153 FROGDBVSXPIGIL-OWOJBTEDSA-N 333.659 5.122 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc3c(c2)CCCC3)c1 772982151 FTONXEDSLZAIPS-HTAPYJJXSA-N 348.490 5.097 30 20 EKED CCC(CC)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccs1 776161691 ZIDGYUHUHBVAGK-FOIQADDNSA-N 342.508 5.479 30 20 EKED C#CCCCCCC(=O)N1CC=C(c2cccc3ccccc23)CC1 779891368 DCWNAZXFYZCPBX-UHFFFAOYSA-N 331.459 5.039 30 20 EKED CCCCCCCC(=O)N1CCc2sccc2[C@@H]1c1cccs1 888828130 UPLCEGPOXWQLHE-LJQANCHMSA-N 347.549 5.644 30 20 EKED Cc1cc(C)cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915087797 XRQXXESWNIBYTQ-JOCHJYFZSA-N 340.426 5.211 30 20 EKED CC(Cc1ccc(-c2ccccc2)cc1)=NNc1cccc(C(=O)O)c1 1776036762 IEMPRXILUFUUQZ-UHFFFAOYSA-N 344.414 5.082 30 20 EKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1ccc(-c2cccs2)cc1 98054990 BWUKOEFOFFOJTN-BAQGIRSFSA-N 341.413 5.281 30 20 EKED C[C@H](C#N)CSc1ccccc1NCc1csc(C(C)(C)C)n1 153872989 KGCOPHCBGVCEEW-CYBMUJFWSA-N 345.537 5.304 30 20 EKED Cc1nc(C)c([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 180221573 QUAJUXCDCAYLOQ-CQSZACIVSA-N 347.487 5.149 30 20 EKED C=C(C)[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(F)c(F)c1 187369515 PCUHXKSAVBRZCK-LJQANCHMSA-N 340.373 5.027 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])ccc1C 189877323 MYPCMJGJYYCEMF-UHFFFAOYSA-N 338.407 5.007 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C(C)(C)C)n1 189882137 BJZWJLVLKKDHPJ-UHFFFAOYSA-N 339.483 5.051 30 20 EKED N#CCCCCSc1ncnc2sc(-c3ccccc3)cc12 195564758 VVJUEGZFUKSNNB-UHFFFAOYSA-N 325.462 5.144 30 20 EKED C=CCC[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 438850572 HVHHULSGPHYCEL-SFTDATJTSA-N 347.462 5.038 30 20 EKED CCCCC[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458799767 KDLIHNJRJILQKT-VQTJNVASSA-N 341.499 5.176 30 20 EKED COc1cccc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)c1 463230996 UWDFVBSPZPTWLO-UHFFFAOYSA-N 348.377 5.110 30 20 EKED C=CCC(CC=C)C(=O)N(Cc1cccs1)c1ccc(OC)cc1 467536187 DOWZMTQUXZIESH-UHFFFAOYSA-N 341.476 5.058 30 20 EKED N#Cc1cc(N(C#N)Cc2sc3ccccc3c2Cl)ccc1F 467776699 MIELXDBOVQRBIL-UHFFFAOYSA-N 341.798 5.053 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(Cl)c1 475575040 PUXPBEKSHKKPEG-UHFFFAOYSA-N 342.870 5.514 30 20 EKED N#CC[C@H](CC(=O)N1CCCC2(CCCCCC2)C1)c1ccccc1 476194478 OYNKFMWCPPRKJC-HXUWFJFHSA-N 338.495 5.037 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1cccc(Oc2ccccc2)c1 484451600 CDWXZPWYIMGKJG-UHFFFAOYSA-N 336.435 5.023 30 20 EKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C2CCC2)cc1 489749238 WKHBUGKBTBHOBF-UHFFFAOYSA-N 345.446 5.046 30 20 EKED Cc1ccc(Cc2ccccn2)cc1N[C@H](C)c1ccc(C#N)cc1F 510977579 IOMJGBQUDIGDGK-MRXNPFEDSA-N 345.421 5.165 30 20 EKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3F)c2)cs1 512613242 REDVMPGUXQGPSZ-GFCCVEGCSA-N 337.423 5.302 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)CCC=C2 551507399 QAFGQURLSSRMJV-OAHLLOKOSA-N 348.471 5.150 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2s1 553294862 STKNXKALFFMABD-IFXJQAMLSA-N 332.472 5.501 30 20 EKED C[C@@H](Nc1ccccc1NC(=O)C[C@@H]1C=CCC1)c1cccc(C#N)c1 601920383 GAZQIZPIOZQESD-IAGOWNOFSA-N 345.446 5.026 30 20 EKED CCc1c(C)sc(NC(=O)C(C)(C)c2cccc(Cl)c2)c1C#N 609907434 VZBFHJPJXPIPMD-UHFFFAOYSA-N 346.883 5.060 30 20 EKED CCCCc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 673813543 BEWFPPFRUFPRLF-MRXNPFEDSA-N 326.465 5.099 30 20 EKED Cc1ccc(N(CCC#N)C(=O)CCCCCc2cccs2)cc1 731474324 MVPVGWUUEPZIST-UHFFFAOYSA-N 340.492 5.106 30 20 EKED COc1ccccc1/C=C/C=C\C(=O)c1cccc(-c2ccncc2)c1 741473237 OUKZLGLSAYHKKD-ABIYIKCLSA-N 341.410 5.210 30 20 EKED CCCCCCCC[S@@](=O)Cc1coc(-c2ccc(F)cc2)n1 790139316 LFTRVXTWOVMEKM-HSZRJFAPSA-N 337.460 5.090 30 20 EKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1csc2ccccc12 793446157 VEYPSDMQZGMHEH-RDJZCZTQSA-N 348.471 5.166 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2c(Cl)nccc2o1 866309184 MHGSPIRVXYDABU-XJKSGUPXSA-N 339.826 5.177 30 20 EKED O=C(O)c1ccccc1NN=C1CCC[C@H](c2cccc(Cl)c2)C1 1776030715 INBIZZWPDSTIBF-AWEZNQCLSA-N 342.826 5.164 30 20 EKED CCCCCCCCC[C@H](C)CCN1C[C@@H](C(=O)O)[C@H](C2CC2)C1 1776785328 WMZSULDVDLSBPJ-YSIASYRMSA-N 337.548 5.196 30 20 EKED COc1cc2c(cc1NCc1ccc(C#N)cc1)oc1ccccc12 11619464 DMKQMEOIQWKIIH-UHFFFAOYSA-N 328.371 5.078 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCOc2ccccc21 189894835 PKITUORXKYRCGA-SFHVURJKSA-N 349.474 5.433 30 20 EKED CC(C)Cc1ccc([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 326611198 LWEMOLMRLCFILE-QZTJIDSGSA-N 336.479 5.199 30 20 EKED CC(O)=Nc1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 329000158 KXUGLSSISGDMQF-VNQPRFMTSA-N 348.874 6.142 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](SC)c1ccccc1 415517166 KUCDAGYMICQQTB-HXUWFJFHSA-N 339.504 5.581 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC(C)(C)C1 443595048 SVMUZKRSAADREA-HUUCEWRRSA-N 345.512 5.171 30 20 EKED C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 470196268 XYRSERFTIVVHQC-RHSMWYFYSA-N 339.401 5.361 30 20 EKED N#CC[C@@H](CC(=O)N1CCCC2(CCCCCC2)C1)c1ccccc1 476194431 OYNKFMWCPPRKJC-FQEVSTJZSA-N 338.495 5.037 30 20 EKED CCC1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 510680990 KZSALTHYDVNOMC-UHFFFAOYSA-N 349.434 5.004 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(OCc2ccccc2C)c1 524089101 PJQFMCDPXUZHIN-UHFFFAOYSA-N 338.451 5.004 30 20 EKED C[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 525952009 QGYNKPYZUWAZGC-QWRGUYRKSA-N 337.225 5.416 30 20 EKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H](c2nc3ccccc3s2)C1 533013017 APJPWITWFLNMGH-MAUKXSAKSA-N 347.487 5.109 30 20 EKED C[C@@H](N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 539495786 DUDFXWUKVQEXAG-OPAMFIHVSA-N 346.861 5.652 30 20 EKED CCc1c([C@H](C)NC2(c3cccc(C#N)c3)CC2)oc2ccccc12 572742786 PWXWOHCJEPCSMK-HNNXBMFYSA-N 330.431 5.207 30 20 EKED CC(C)CN(C(=O)CCCCCC#N)[C@@H](C)c1ccccc1Cl 588990300 PNYFCAITGUEOTF-INIZCTEOSA-N 334.891 5.360 30 20 EKED Cc1ccc(Sc2ccc(NC(=O)CC3(C#N)CC3)cc2)c(C)c1 590126780 GULLPYANVUVPCB-UHFFFAOYSA-N 336.460 5.087 30 20 EKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc2ccccc12 594929301 UWDPLFYRVNIWFS-KRWDZBQOSA-N 326.443 5.246 30 20 EKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(OCC#N)cc1 729267354 RSNLQYFBTBAOHS-ZDUSSCGKSA-N 349.261 5.089 30 20 EKED 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DJEOYNKRTGVIPL-UHFFFAOYSA-N 347.380 5.868 30 20 EKED Cc1c(NN=C2CCCCC[C@H]2c2ccccc2)cccc1C(=O)O 1776089104 BQAKAEKGVPZCNO-SFHVURJKSA-N 336.435 5.209 30 20 EKED C=CC[C@@]1(C(=O)O)CCCN([C@H](CC(C)C)c2ccc(CC)cc2)C1 1776154461 BEUCZJZDYQQDEW-IFMALSPDSA-N 343.511 5.079 30 20 EKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccnc1Cl 91412165 HASFDBNQELHEKI-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1sc(-c2ccccc2)nc1C 185845327 RWCDAZSFXSDGOP-GOEBONIOSA-N 342.508 5.240 30 20 EKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 193007862 YYUHQOMYXAHVEK-UONOGXRCSA-N 348.368 5.020 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)ccc2CC1 329191915 RROKIGFIZNGZLP-RRQGHBQHSA-N 326.440 5.415 30 20 EKED C=CCCc1ccccc1NCc1nnc(-c2ccccc2Cl)o1 409849389 OCSVDFMFDQXNNK-UHFFFAOYSA-N 339.826 5.121 30 20 EKED CC[C@@H](N[C@H](CC(F)(F)F)c1ccccc1C)c1ccc(C#N)cc1 447576860 CYTUTTNBXIYPBW-RTBURBONSA-N 346.396 5.601 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C/C=C\c1cccc(F)c1 476090955 QABBOYCKMVZONM-POHAHGRESA-N 337.438 5.720 30 20 EKED CCN(C(=O)c1cc2sccc2s1)[C@H](C)c1ccc(C#N)cc1 517420097 AAONIRUTQNAIES-GFCCVEGCSA-N 340.473 5.058 30 20 EKED C=CCOc1ccc(CN[C@H](CC(C)C)c2cccs2)cc1OC 520946888 SCFZLQHQTQZGQE-QGZVFWFLSA-N 345.508 5.199 30 20 EKED C=CCC[C@H](N[C@H]1CCCc2nc(CC)sc21)c1ccccc1 540146139 AKJMYNVQXNNEIA-IRXDYDNUSA-N 326.509 5.380 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCC=C2 552474044 NTJPSLANCSJNJJ-UHFFFAOYSA-N 331.459 5.750 30 20 EKED Cc1cccc(C)c1[C@H](C)NCc1ccc(C#N)cc1C(F)(F)F 558574759 PWPPOPXSDVYHOQ-AWEZNQCLSA-N 332.369 5.045 30 20 EKED Cc1cc(C)cc(Oc2cccc(Cl)c2NC(=O)[C@H](C)CC#N)c1 598843722 IMSLVYYHUPNSOW-CQSZACIVSA-N 342.826 5.237 30 20 EKED N#Cc1ccc(SCc2ccc(Cl)c3cccnc23)c(F)c1 610164826 ZIJNBYOTYYOEOC-UHFFFAOYSA-N 328.799 5.191 30 20 EKED C=CC[C@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)c1ccccc1 681709036 QVYBRWSACVILHX-SFHVURJKSA-N 347.380 5.024 30 20 EKED CC[C@@H](/N=C/c1cc(Cl)ccc1O)c1nc(C(F)(F)F)cs1 745976943 OYPLVDXECNPIIO-GFKCFBEASA-N 348.777 5.091 30 20 EKED CCOc1ccccc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745990162 MBXSJPBZYWFOEL-QXMHVHEDSA-N 329.399 5.043 30 20 EKED CCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749050116 ZXFPUCCVEGHVTP-ZBFHGGJFSA-N 326.465 5.121 30 20 EKED Cc1ccccc1C=NOCc1nc(C)c(-c2ccc(Cl)cc2)o1 768512143 NNPSSATXNACLDE-UHFFFAOYSA-N 340.810 5.163 30 20 EKED C/C(=C/C(C)(C)C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 773984986 XUFHPXYEPPSSGO-CUZBXDDWSA-N 332.856 5.118 30 20 EKED Cc1ccc2c(C[S@](=O)CCCC(C)(C)C#N)c(C)ccc2c1 871614641 JGESYHQWQCRQIN-HSZRJFAPSA-N 327.493 5.035 30 20 EKED CC(C)(C)C[C@H](NC(=S)Nc1ccccc1C#N)c1ccccc1 916001411 XWPKMUGGONGPCN-SFHVURJKSA-N 337.492 5.022 30 20 EKED Fc1cc(F)cc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 920375241 VBWCWSYVKBBYLN-UHFFFAOYSA-N 335.568 5.371 30 20 EKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(F)cc3)cc2)cc1 1776131066 GHHNHQUSZLTRBY-BNNQUZSASA-N 346.357 5.087 30 20 EKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)s1 72041989 JBFRWGQLXIAMCC-ZZXKWVIFSA-N 346.757 5.239 30 20 EKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1coc2ccccc12 329342333 PNJCCBHRTMDDOS-SFHVURJKSA-N 349.434 5.127 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCC[C@H](C)C1)C(O)=N2 329701467 HJVBXZOBNPAUGT-IMJJTQAJSA-N 328.456 5.107 30 20 EKED CCC[C@H](C)[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458798801 IPUZUCDRYVRJBT-DFQSSKMNSA-N 341.499 5.032 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC(C)(C)C1 475550891 SMGDQMNEWWTPKH-INIZCTEOSA-N 328.500 5.438 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCc2ccccc21 475553961 GYKZUSLBNYOAES-NRFANRHFSA-N 348.490 5.690 30 20 EKED C=CC[C@H](C(=O)Nc1cccc(C)c1Br)c1ccccc1 490221188 FVYTWHVHOIOINU-HNNXBMFYSA-N 344.252 5.056 30 20 EKED CCCc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 497477141 KXOMXHZOXMDAJN-UHFFFAOYSA-N 340.426 5.430 30 20 EKED Cc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1 513562764 MVWJNUWHSSXXLY-UHFFFAOYSA-N 328.415 5.058 30 20 EKED CC(C)CN(C(=O)[C@@H](C)c1cccc(Cl)c1)c1ccc(C#N)cc1 525114305 UZYZLIXFFYDZTK-HNNXBMFYSA-N 340.854 5.004 30 20 EKED CC(C)(C)[C@@H]1CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 525714147 CSOHOWNFFZRFQX-FQEVSTJZSA-N 348.446 5.001 30 20 EKED CC(C)(CCC#N)CNc1cc(C(F)F)nc2ccc(Cl)cc12 561378400 TXTNWKCNJPCIFP-UHFFFAOYSA-N 337.801 5.568 30 20 EKED CCCCN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](C)c1ccc(C)o1 604501783 MGVFDEJEIOHGLZ-INIZCTEOSA-N 339.439 5.163 30 20 EKED COc1ccc2cc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)ccc2c1 610343454 HOJHMPGVYRJPIM-JKSUJKDBSA-N 330.431 5.132 30 20 EKED Cc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610356321 OVFBRSWVFHEYFW-UWJYYQICSA-N 349.478 5.014 30 20 EKED CC(C)Oc1ccccc1[C@@H](C)NCc1ccc(C(C)(C)C#N)cc1 614179181 HMPFWMWBRGATRF-QGZVFWFLSA-N 336.479 5.126 30 20 EKED CC(C)(C#N)c1ccc(CNC(C)(C)c2cccc(Cl)c2)cc1 614179617 URWYCXPFQZLYDR-UHFFFAOYSA-N 326.871 5.166 30 20 EKED Cc1cc(F)ccc1C(=O)/C=C\c1csc(-c2ccsc2)n1 731321534 JEVXYOCIXAUQRA-HYXAFXHYSA-N 329.421 5.215 30 20 EKED CC(/C=C\C(=O)c1cccc(-c2ccncc2)c1)=C\c1ccccc1 741471177 XCMXHRMGLJPQJF-JARQXYAPSA-N 325.411 5.591 30 20 EKED CCCCCCCC(=O)Nc1c(-c2ccccc2)ncn1C1CC1 749601123 MWHBTJKCTNZIFM-UHFFFAOYSA-N 325.456 5.184 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1O)c1ccccc1 756774863 DOSPGFGHLBEPQL-LRDDRELGSA-N 334.246 5.114 30 20 EKED C#CC[C@H](NC(=S)Nc1c(C)cc(C)cc1Cl)c1ccccc1 756857218 QEHRCTVWBFHFHO-KRWDZBQOSA-N 342.895 5.008 30 20 EKED C#CCCCCC(=O)Nc1ccccc1NCc1ccc(Cl)cc1 765819036 HVVAVKBIWGEKBM-UHFFFAOYSA-N 340.854 5.084 30 20 EKED C#CC[C@H](N[C@H](C)c1ccc(N2CCCCC2)cc1)c1ccccc1 773118083 YKNSGMPIYQKMHP-XXBNENTESA-N 332.491 5.092 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)CC(C)(C)C)n2)cc1 773982393 IEHJATGVAPHJBP-GOEBONIOSA-N 340.492 5.367 30 20 EKED C=CC[C@@H](N[C@@H](C)c1oc2ccc(C)cc2c1CC)c1ccncc1 776155184 CZISIXOYRKVTIM-OXJNMPFZSA-N 334.463 5.667 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1cccc(N2CCCCC2)c1 776867752 AGPNQYDTGDYTGA-JOCHJYFZSA-N 331.463 5.038 30 20 EKED C[C@@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)c(F)c1 777695914 MOCYYPHTLLPFSF-MRXNPFEDSA-N 337.442 5.251 30 20 EKED C=CC[C@H](C(=O)OCc1nc(-c2ccccc2)oc1C)c1ccccc1 778426334 DHTCNVMQMNHFSN-IBGZPJMESA-N 347.414 5.053 30 20 EKED C[C@H](Cc1ccc(C(F)(F)F)cc1)Nc1ccccc1O[C@H](C)C#N 780743419 BHFBWWMTDSJKDB-ZIAGYGMSSA-N 348.368 5.039 30 20 EKED C[C@H](Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc(C#N)cc1F 781423793 YNSMMKJEJYJXTR-ZDUSSCGKSA-N 343.833 5.124 30 20 EKED C/C(=C\c1ccccc1C(F)(F)F)COC(=O)CCCCCC#N 805984400 OJRRXLHLIUYTQA-WYMLVPIESA-N 339.357 5.126 30 20 EKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1c(F)cccc1Cl 809158449 AOMUZZVVDHIEIR-KTKRTIGZSA-N 343.810 5.499 30 20 EKED C=CCOc1c(Cl)cc(CNc2ccc3occc3c2)cc1OC 864017536 OZUDXACFMZGDES-UHFFFAOYSA-N 343.810 5.272 30 20 EKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2ccccc2F)s1 915987946 OBUQRBPYGPGTDK-SOFGYWHQSA-N 329.421 5.215 30 20 EKED C=CCN(C(=O)Nc1ccc(C)cc1OCc1ccccc1)C(C)C 916717223 XDOSGMFQNTYRGE-UHFFFAOYSA-N 338.451 5.002 30 20 EKED COc1ccccc1Oc1ccc(N=Cc2ccccc2O)cc1F 920178465 RGKGOFKZTSHPQR-UHFFFAOYSA-N 337.350 5.083 30 20 EKED CC(CC[C@H]1[C@H](C)CCCC1(C)C)=NNc1ccc(C(=O)O)cc1 1776013451 ATXSDKQDSPHJNH-KDOFPFPSSA-N 330.472 5.415 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)oc2ccccc12 1776783391 XSFAUVKVOKXGCE-INIZCTEOSA-N 331.456 5.035 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1nc2ccccc2o1 182069920 RYVVHINLUHSXTR-KGLIPLIRSA-N 337.448 5.253 30 20 EKED C[C@@H](Nc1cccc(SC(F)F)c1)c1ccc(OCC#N)cc1 183117714 ZHMWCNBNGASASE-GFCCVEGCSA-N 334.391 5.077 30 20 EKED O/C(Cc1coc(-c2cccs2)n1)=N/[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329160154 YBCNBORBSBPLAH-SOUVJXGZSA-N 344.480 5.261 30 20 EKED C[C@@H]1C[C@H](/C(O)=N/[C@H](CC2CCCC2)c2ccccc2)CC(O)=N1 329675759 PFBGUKLFZXTVNL-FHLIZLRMSA-N 328.456 5.020 30 20 EKED CC[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(C)cc1 329999466 UUQAWFKQJRWVFV-ACBHZAAOSA-N 342.483 5.328 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)[C@@H]1C[C@H]1c1cccs1 417322984 XEJRHFPGWLVNQT-JCGIZDLHSA-N 326.465 5.035 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1[C@@H](C)[C@H]1c1ccccc1 430810833 MUSHTDHWWMRMAU-ORYQWCPZSA-N 333.475 5.527 30 20 EKED CCc1cccc(C)c1NC(=O)c1sc2ccc(C#N)cc2c1C 431396177 KPUAMGWWFMURBE-UHFFFAOYSA-N 334.444 5.205 30 20 EKED C=CCC[C@H](NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 435290888 SOYZKMRUVJYHOD-ULQDDVLXSA-N 339.401 5.179 30 20 EKED CC(C)CC[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458806831 WOQNDFPDOAWVPL-WOJBJXKFSA-N 341.499 5.032 30 20 EKED CC(C)c1ccc([C@H]2CCCN2C(=O)[C@H](C)c2cccc(C#N)c2)cc1 462270532 IWRQBCSVGWETKO-VGOFRKELSA-N 346.474 5.149 30 20 EKED C=C(C)C[C@H](C)C(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C 466248880 VVUHRVQOWZLXQV-NWDGAFQWSA-N 326.267 5.041 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(-n2cccc2)c1 476081495 TUAWQUYOCCGIMS-UHFFFAOYSA-N 344.458 5.582 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 539495784 DUDFXWUKVQEXAG-AOMKIAJQSA-N 346.861 5.652 30 20 EKED Cc1ccccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297592 QPJAKCPLKMVZLB-UHFFFAOYSA-N 346.361 5.050 30 20 EKED C=C(C)CN(CC)C(=O)Nc1cccc(CSC2CCCC2)c1 610143566 BIDLMYIRENIPKP-UHFFFAOYSA-N 332.513 5.292 30 20 EKED N#C[C@H](C(=O)c1cc2sccc2s1)c1ccc2ccccc2n1 617896339 CJWHXAYHRARBLU-LBPRGKRZSA-N 334.425 5.001 30 20 EKED CC(C)c1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726434845 JDXLCJXUWMEFQM-UHFFFAOYSA-N 329.856 5.144 30 20 EKED N#CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c1 727744031 BAENTUUBHOKGMX-NTEUORMPSA-N 339.394 5.152 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc(F)c(Cl)c1 731836009 YYKVMROKKJLQEQ-VQHVLOKHSA-N 327.742 5.030 30 20 EKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 734083317 PVNAILNWYQJLSV-DZGCQCFKSA-N 344.455 5.218 30 20 EKED CCCCCCCCC/C=C/C(=O)N1CCC[C@H]1c1cc(C)on1 737790418 NCIWQJFFKXDIFC-VUVZNRFTSA-N 332.488 5.343 30 20 EKED C=CCC[C@H](NCc1ccccc1O)c1ccc(C(F)(F)F)cc1 749839682 GBRWXQJFXQTONR-KRWDZBQOSA-N 335.369 5.208 30 20 EKED C=CC[C@@H](N[C@@H](C)c1cccc(-c2ccccc2)c1)c1ccncc1 766023379 UMPIOOVQWXDJRM-FDDCHVKYSA-N 328.459 5.717 30 20 EKED O=C(/C=C\c1cccc2cnccc12)c1cccc(C(F)(F)F)c1 782880759 NPVVCXAPAXLFGJ-FPLPWBNLSA-N 327.305 5.150 30 20 EKED C=CCC1(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)CCC1 790760383 VOOTXOOKGUISQD-OAQYLSRUSA-N 349.474 5.038 30 20 EKED C[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(OCC#N)cc1 806664103 ZWCCRMNUTOAVGZ-JKSUJKDBSA-N 348.421 5.293 30 20 EKED CC(=NNc1c(C)cc(C)cc1C)c1nc2ccccc2n1C(F)F 812434943 YCMAIGPCHAWQOP-UHFFFAOYSA-N 342.393 5.193 30 20 EKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1cccc2ccccc12 917143474 FWJHPYASQSCTIU-YPKPFQOOSA-N 336.394 5.193 30 20 EKED N#CCCCOc1cccc(NCc2ncc(-c3ccccc3)s2)c1 161275233 JSEUCOSVMMCTRE-UHFFFAOYSA-N 349.459 5.105 30 20 EKED C=C[C@@H](CC(=O)N(Cc1ccsc1)c1cccnc1)c1ccccc1 193520873 YQJDJPVZZRNWNL-SFHVURJKSA-N 348.471 5.036 30 20 EKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](CC)c1ccccc1 303061540 UVAYOXWTGAABIK-LJQANCHMSA-N 349.503 5.298 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)cc1 324870276 OIQYFFVCTUJXNG-CQSZACIVSA-N 335.369 5.121 30 20 EKED C/N=C(/O)c1ccc(Cl)c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329662265 PGYMHIUKDZAERY-NWANDNLSSA-N 348.874 5.469 30 20 EKED CCC1CCC(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CC1 329995105 MURQPIWINBQEHU-UHFFFAOYSA-N 334.504 5.085 30 20 EKED C=CCCc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 410361351 DMBHFZSVGAAUQD-KRWDZBQOSA-N 347.380 5.480 30 20 EKED N#Cc1ccc(SCc2ncc(-c3cccs3)o2)c(Cl)c1 465389645 UISNZFVYUKQDGG-UHFFFAOYSA-N 332.837 5.220 30 20 EKED C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 467823243 DZGJDKPOEGLXBP-AWEZNQCLSA-N 340.492 5.064 30 20 EKED CC(C)Sc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476351582 DNWYURFCPYTWSS-QGZVFWFLSA-N 338.476 5.213 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC(C)C)c1ccccc1 504203300 HECGDLSHFZHLTI-LJQANCHMSA-N 342.508 5.233 30 20 EKED CCc1ccc2occ(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2c1 513733180 OSDDGYATBWXTAD-AWEZNQCLSA-N 346.411 5.095 30 20 EKED C[C@H](NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)c(F)c1 545273996 KOUKNHHQXXQVJY-NSHDSACASA-N 349.236 5.344 30 20 EKED N#CCCOCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 549013641 ZSDKZIXLKWXGHS-SFHVURJKSA-N 331.868 5.093 30 20 EKED C[C@@H](NC1(c2ccc(Cl)cc2)CCC1)c1ccc(C#N)cc1F 579986583 AZWDQVVYOBRSDG-CYBMUJFWSA-N 328.818 5.081 30 20 EKED COCCSc1ccc([C@@H](C)Nc2cc(Cl)ccc2C#N)cc1 609892901 IZERGSISZFUIFO-CYBMUJFWSA-N 346.883 5.123 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc(Cl)ccc1Cl 619746842 NXNUZFUVMDJDPH-JTQLQIEISA-N 339.653 5.369 30 20 EKED C=C(C)CCc1noc(-c2sc(-c3ccccc3)nc2C(F)F)n1 671670980 MAWYJIWSOGCGGN-UHFFFAOYSA-N 347.390 5.306 30 20 EKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)C1CCCCC1 725830198 AMPFWZSJUAZGFP-UHFFFAOYSA-N 336.361 5.017 30 20 EKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccc(C#N)c3)s2)cc1 727655464 XAWWPUZUEDAOQJ-DHZHZOJOSA-N 344.439 5.195 30 20 EKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 727952107 AOZGWUYQDGKZML-GJZGRUSLSA-N 328.481 5.469 30 20 EKED C#Cc1cccc(N(CC)C(=S)Nc2cc(Cl)cc(Cl)c2)c1 728447407 AQPBLBSVSCWNOW-UHFFFAOYSA-N 349.286 5.198 30 20 EKED CC[C@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 738415481 DYVOOTNVZMEOFW-GOTSBHOMSA-N 344.433 6.044 30 20 EKED CC(C)c1ccc(C=NO[C@H](C)c2nc(-c3cccs3)no2)cc1 744445606 SSZMJQCHAVGCBV-CYBMUJFWSA-N 341.436 5.033 30 20 EKED CCOc1ccc(O)c(/C=N\[C@@H](C)c2ccc(-c3ccncc3)cc2)c1 746393868 LRCAWNIXTAHUGW-PHQOBFFQSA-N 346.430 5.033 30 20 EKED N#Cc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)s1 748998875 SWJZGGQNQZDTBD-FLIBITNWSA-N 347.411 5.147 30 20 EKED N#CCCN(Cc1ccc2oc3ccccc3c2c1)Cc1ccco1 755859986 LNVWIXIRATVBIJ-UHFFFAOYSA-N 330.387 5.095 30 20 EKED CC(C)(C)[C@@H](NCc1cc(C#N)ccc1F)c1cc2ccccc2o1 779412538 MXTSLIKEWUWMBI-FQEVSTJZSA-N 336.410 5.321 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1ccccc1C(F)(F)F 782301145 KJQPQDGNZBLBCQ-SOFGYWHQSA-N 327.305 5.150 30 20 EKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1 792095621 WBHGPSURYSYZPF-NHCUHLMSSA-N 342.442 5.241 30 20 EKED C=C[C@@H](CC(=O)O[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1 803060431 VZUIYMRRGQFYOD-KBPBESRZSA-N 349.352 5.065 30 20 EKED CCCCCCCNC(=O)c1ccccc1SCc1cscn1 862360383 IRWZSTLAHXNKMC-UHFFFAOYSA-N 348.537 5.136 30 20 EKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1cccc(Cl)c1 916137507 ANUWZTBYRCDJLL-MDZDMXLPSA-N 325.820 5.360 30 20 EKED O=C(O)c1ccc(NN=C2CC=C(c3ccc(Cl)cc3)CC2)cc1 1776012598 FRNFATYWXGWUHU-UHFFFAOYSA-N 340.810 5.074 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Br)c1 90664484 VSYSXZGPYQORBP-KBXCAEBGSA-N 343.268 5.145 30 20 EKED N#Cc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3)c2)cc1 108013004 UGQRGXXRAZYKMB-KAMYIIQDSA-N 339.394 5.033 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cccc2ccccc12 108293793 NPSIAJNQHJYXOE-UHFFFAOYSA-N 332.428 5.098 30 20 EKED CCCCSc1nnc(S[C@H](C)c2ccc(C#N)cc2)s1 118173799 XTGQPJUPDNWHMR-LLVKDONJSA-N 335.523 5.155 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cccc1F 121314220 TTWGIVAUVMEBCW-UHFFFAOYSA-N 338.835 5.069 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cnc2ccsc2c1 126533961 STEBZUAZLQTKRJ-CQSZACIVSA-N 337.448 5.152 30 20 EKED CC(C)c1nc(CNc2ccccc2SC[C@H](C)C#N)cs1 153872224 QPFDTVIBAJWVML-CYBMUJFWSA-N 331.510 5.130 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1cccc2ccccc12 237333758 FEJLPCJNDULRKT-GOSISDBHSA-N 344.458 5.373 30 20 EKED CC1CCC(=CC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 303598981 URXYJIVKYMJMTO-YSSOQSIOSA-N 328.481 5.013 30 20 EKED CC(C)c1ccc([C@H](/N=C(/O)C[C@H]2CCCC(O)=N2)C(C)C)cc1 329263417 BRCIYWNRQLKWHD-YLJYHZDGSA-N 330.472 5.363 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1cc2c(ccc3ccccc32)[nH]1 519156599 WXPNBMFNIWTDGD-UHFFFAOYSA-N 347.462 5.113 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1SCCC#N)C1CCCCC1 520805442 CYKHFCPZKSLZCS-HNNXBMFYSA-N 330.497 5.237 30 20 EKED CCC1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 522072973 MLSLTAYQHNJVPP-UHFFFAOYSA-N 349.434 5.004 30 20 EKED CCC(C)(C)OCc1cccc(NCc2ccc(C#N)s2)c1C 537720762 QTBSGMLZXSCBLL-UHFFFAOYSA-N 328.481 5.246 30 20 EKED N#CC1(CC(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)CCCCC1 596756746 QPYZHMGRWSOETA-UHFFFAOYSA-N 349.434 5.022 30 20 EKED C[C@H](Sc1nnc(CCC2CCCCC2)o1)c1ccc(C#N)cc1 609813727 JVRXEKIDABOJRB-AWEZNQCLSA-N 341.480 5.307 30 20 EKED C[C@H](CCC(F)(F)F)Nc1ccc(C(F)(F)C(F)(F)F)cc1 681140652 BHKFIJMYSUAGKU-MRVPVSSYSA-N 335.238 5.484 30 20 EKED CC(=NNc1cc(Cl)ccc1Cl)c1c(C)nn(C(C)C)c1C 751895863 VXZWKIFTWSJGBL-UHFFFAOYSA-N 339.270 5.224 30 20 EKED CC1(C)CCC[C@@H](CC(=O)[C@@H](C#N)c2nc3ccccc3s2)C1 756506087 SUVRQOMPUDWFNY-UONOGXRCSA-N 326.465 5.079 30 20 EKED Cc1cccc2c1[C@H](C)/C(=C/c1cccc(OCCCC#N)c1)C2=O 766694283 BVEDOMMPSTVACD-ZHTGWBIJSA-N 331.415 5.061 30 20 EKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1C 792092495 CAGNIMHUPVBVQP-HEDKFQSOSA-N 340.426 5.050 30 20 EKED COc1cccc(/C=C\C(=O)c2cccc(Cl)c2)c1OC(C)C 916137601 UPIUKXLZHYCHKP-KHPPLWFESA-N 330.811 5.032 30 20 EKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cccc(OC)c1 1776785097 CQWRFGHMVVZEEN-FQEVSTJZSA-N 349.515 5.284 30 20 EKED CC(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)=C1CCCC1 161973437 VJNYEJYLFJZSEU-ZDUSSCGKSA-N 330.840 5.016 30 20 EKED C=CCn1c(SCc2ccc(Cl)s2)nnc1-c1ccccc1 247966215 BMYZVPNAHDEQPY-UHFFFAOYSA-N 347.896 5.138 30 20 EKED CC(C)/N=C(/O)[C@@H]1CCC[C@H](/N=C(/O)[C@H](c2ccccc2)C2CC2)C1 328979410 RACAVGXZFPRFKW-CEXWTWQISA-N 342.483 5.060 30 20 EKED OC1=Nc2ccc(/C(O)=N/[C@@H]3CCCCC34CCCC4)cc2SC1 329623660 NUKGLGOBZQPHGN-MRXNPFEDSA-N 344.480 5.188 30 20 EKED COc1ccc2c(c1)C(C)(C)C[C@@H]2N[C@H](CCC#N)c1ccccc1 353314793 NJYLXAQNECYXLB-RTWAWAEBSA-N 334.463 5.052 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)s1 439795325 RLUHWEMLFLDPQV-ZDUSSCGKSA-N 334.444 5.078 30 20 EKED Cc1cccc(Oc2ccccc2C(=O)[C@H](C#N)c2nc(C)cs2)c1 442020950 HBEFKOXIXLUWNE-KRWDZBQOSA-N 348.427 5.042 30 20 EKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(C#N)c1 442775275 FMTDFPYGMGWPTJ-MRXNPFEDSA-N 339.398 5.395 30 20 EKED CC[C@@H](N[C@H](Cc1ccccc1)c1cccs1)c1ccc(C#N)cc1 447579358 KHAPLQFJDCTCIC-NHCUHLMSSA-N 346.499 5.644 30 20 EKED CC(C)c1occc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 479960572 HZSPACGEBQINPN-UHFFFAOYSA-N 346.386 5.319 30 20 EKED CC(C)(C#N)c1ccccc1COc1ccccc1OCC(F)(F)F 486883356 GVEGLRAZBPUIGU-UHFFFAOYSA-N 349.352 5.008 30 20 EKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)c2cccc(CC#N)c2)cc1 502699392 RNWFAQNVSAQETR-OAQYLSRUSA-N 346.474 5.027 30 20 EKED Cc1c([C@H](NCc2cc(C#N)ccc2F)C(C)C)oc2ccccc12 540358671 GNBYCRKNDNSWLK-HXUWFJFHSA-N 336.410 5.239 30 20 EKED CCC(C)(C)OCc1ccccc1NCc1ccc(C#N)cc1F 544591068 XTABHSYWMVBKTM-UHFFFAOYSA-N 326.415 5.015 30 20 EKED C=CCOc1ccc(CN[C@H](C)c2sc(C(C)(C)C)nc2C)cc1 552087494 JOQNMDQXCFANGQ-CQSZACIVSA-N 344.524 5.165 30 20 EKED N#CC1(CCCSc2cc(Cl)ccc2Cl)CCOCC1 558175502 JDIRYIGXBKQNNO-UHFFFAOYSA-N 330.280 5.186 30 20 EKED COc1ccc(C(C)C)cc1CN[C@@H](CCCC#N)c1ccccc1 593994708 HHCGWRXTQSSVAE-NRFANRHFSA-N 336.479 5.343 30 20 EKED C[C@@H](Nc1ncccc1C#N)c1ccc(Oc2ccccc2)c(F)c1 603871575 GUTCQGVREIQCCV-CQSZACIVSA-N 333.366 5.058 30 20 EKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 619755665 OXRQLJROMCICNU-HNNXBMFYSA-N 347.849 5.124 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2 626534523 PBBKKAOPGQLHNS-HOTGVXAUSA-N 348.437 5.333 30 20 EKED COc1ccccc1/C=C/C(=O)c1ccc(-c2ccccc2OC)cc1 741468581 FSOALPUQYCWOEE-FOCLMDBBSA-N 344.410 5.267 30 20 EKED O=C(/C=C/c1cc2ccccc2o1)c1cccc(-c2ccncc2)c1 741473921 UVXURYVDRIKKGZ-CMDGGOBGSA-N 325.367 5.391 30 20 EKED C#CCCCCCC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 779970205 BCLLYQVMPSWSTJ-UHFFFAOYSA-N 345.364 5.293 30 20 EKED COc1ccc(C(=O)/C=C\c2scnc2C2CC2)c2ccccc12 782312878 LUQJVWRHTWXSEE-LUAWRHEFSA-N 335.428 5.078 30 20 EKED CCN(CC)c1ccc(C=Nc2ccc3oc(C4CC4)nc3c2)c(O)c1 914702389 DKVCSAUWJTYAOV-UHFFFAOYSA-N 349.434 5.008 30 20 EKED Oc1ccc2ccccc2c1/C=N\C[C@@H]1CCCO[C@H]1c1ccccc1 920387154 MGFPYEFLCHBVMB-AQGMBIETSA-N 345.442 5.132 30 20 EKED C[C@@H]1CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 920790719 KJLLVLXMBTXGTN-MBNYWOFBSA-N 346.883 5.342 30 20 EKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccc(CCC#N)cc2)cc1 932576294 PUHXHGPANCZICT-OAQYLSRUSA-N 347.462 5.210 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCSc1ccccn1 189907346 CKTUIIYDRMXMOT-UHFFFAOYSA-N 340.492 5.054 30 20 EKED Cc1ccc(-c2csc(/C=C\c3ccc(O[C@@H](C)C#N)cc3)n2)cc1 208015299 CLMOJWUWLJYOBR-FGLWMGOFSA-N 346.455 5.580 30 20 EKED CC(C)(C)[C@@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 236656382 PNIMWXXGMSEHIR-NRFANRHFSA-N 336.479 5.246 30 20 EKED Cc1ncc(N=C(O)CC2CCC(C(F)(F)F)CC2)c(C2CC2)n1 328777663 LPIHZQDDMHNEII-UHFFFAOYSA-N 341.377 5.009 30 20 EKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2o1 352198374 LFBHZDKHQQORJV-APWZRJJASA-N 346.430 5.088 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 442860815 SRCJVBLUFXFAQW-CRAIPNDOSA-N 326.827 5.023 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C2CC2)[C@@H]1C1CC1 455242723 HPHQDOKOCKDIGY-FPOVZHCZSA-N 338.495 5.191 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(CC(C)C)n1 476144796 JUDXSGAPKJPSEE-UHFFFAOYSA-N 342.508 5.446 30 20 EKED N#CCCSc1ccccc1NC(=O)Nc1ccc(F)c(Cl)c1 479747153 UZNWHNDCJZSWIR-UHFFFAOYSA-N 349.818 5.129 30 20 EKED CC(C)[C@H](CNC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 505195315 GHUUKHREEKGDBS-FQEVSTJZSA-N 349.478 5.049 30 20 EKED C=CCN(Cc1csc(-c2ccsc2)n1)Cc1cccs1 506013210 VOQDUKRZBAEUCR-UHFFFAOYSA-N 332.519 5.121 30 20 EKED CC[C@H](C)Oc1cc(C)ccc1CN[C@@H](C)c1ccc(C#N)cc1F 512628100 CWRXRCRKGVUNSD-HOTGVXAUSA-N 340.442 5.034 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H]1CCC[C@H](C)C1 530402003 JJXSWRVBTKWMPK-FUHWJXTLSA-N 329.484 5.072 30 20 EKED N#CCC[C@H](NCc1cc(-c2ccccc2)cs1)c1ccccc1 533037996 SICSQHXWGVUYRQ-NRFANRHFSA-N 332.472 5.550 30 20 EKED Cc1cc(F)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 540888507 WTVPYBUCCQMJCD-UHFFFAOYSA-N 346.361 5.050 30 20 EKED N#CCc1ccc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)cc1 542233750 WJESUTFICGHQRH-QFIPXVFZSA-N 346.861 5.285 30 20 EKED CCOc1ccc(CN[C@@H](C)c2ccc(C#N)cc2Cl)cc1Cl 565765289 XVSSLNFNBKUGSZ-LBPRGKRZSA-N 349.261 5.115 30 20 EKED Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cccc(CC#N)c1 609445578 VZQQHPLEKYHKEK-UHFFFAOYSA-N 342.398 5.106 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(Cl)cc1 649956051 BDKSPIZPVCOOFB-HNNXBMFYSA-N 341.882 5.934 30 20 EKED CC(=NNc1ccccn1)c1c(F)cccc1O[C@H](C)c1ccccc1 730140916 CBQSYNVWELRRKZ-MRXNPFEDSA-N 349.409 5.197 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 731836010 YZDUBCZRPOXZSM-KHPPLWFESA-N 343.304 5.257 30 20 EKED CCC[C@@H](C#N)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732658589 UADSVYVEBQBOPM-LBPRGKRZSA-N 334.872 5.100 30 20 EKED CCC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 733679583 BLLCRHDMMHUQEX-JKSUJKDBSA-N 340.492 5.469 30 20 EKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1nccc3ccccc13)CO2 740765295 VMADBNZVNIQKQA-ATVHPVEESA-N 329.399 5.017 30 20 EKED CCCCCCCCCC(=O)N1CCC2(CC1)OCc1ccccc12 760094529 ANOFJLIYFMXLPX-UHFFFAOYSA-N 343.511 5.175 30 20 EKED FC(F)(F)C1CCC(C=NNc2cccc(Br)c2)CC1 767360070 JTVROTPTIHKFLI-UHFFFAOYSA-N 349.194 5.216 30 20 EKED O=C(/C=C/c1cc(Cl)cs1)c1ccc(-c2ccncc2)cc1 782343740 XHJSAAUMQZHNRU-AATRIKPKSA-N 325.820 5.360 30 20 EKED Fc1ccc(/C=C\C=NOc2ccccc2C(F)(F)F)cc1F 794923930 SNWJKTUUVZLTMM-XQGJOHEMSA-N 327.252 5.062 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1ccc(N2CCCC2)cc1 795810926 LGTASWHSBRXHTG-QFIPXVFZSA-N 331.463 5.038 30 20 EKED N#CC[C@@H](CC(=O)OCc1cc2ccccc2s1)c1ccccc1 795986739 RGOIGVVUJKSYEF-INIZCTEOSA-N 335.428 5.032 30 20 EKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(C)cc3)cs2)cc1 796968777 LSHMAQUSDFQAJH-FMIVXFBMSA-N 335.428 5.023 30 20 EKED Cc1cc(N[C@@H](C)CC(C)(C)C#N)ccc1NC(=O)OC(C)(C)C 895471724 YCYSSNQOGBKFAF-AWEZNQCLSA-N 331.460 5.082 30 20 EKED CC(=NOCc1cc(-c2ccccc2)no1)c1cc2ccccc2o1 913029352 GNWXDKLJAYWZNY-UHFFFAOYSA-N 332.359 5.029 30 20 EKED C/C=C/C=C\C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 917876133 FGRMHRMKHNNMSX-IAROGAJJSA-N 338.794 5.075 30 20 EKED Cc1ccc([C@@H]2CCCC2=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033488 PWYDVKDBMIDTRC-HNNXBMFYSA-N 342.826 5.082 30 20 EKED C=CC[C@]1(C(=O)O)CCCN([C@@H](CC(C)C)c2ccc(CC)cc2)C1 1776154464 BEUCZJZDYQQDEW-UNMCSNQZSA-N 343.511 5.079 30 20 EKED CC(C)c1ccc([C@@H](Nc2ccc(C#N)cn2)c2cccs2)cc1 58489078 JQDKHWDMGHZXCB-HXUWFJFHSA-N 333.460 5.340 30 20 EKED N#Cc1c(-c2ccccc2)cc(-c2cc(F)cc(F)c2)nc1Cl 95831312 CXDINSBRJLBKEZ-UHFFFAOYSA-N 326.733 5.219 30 20 EKED Cc1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 113570618 UKEVJYPQZIJIQD-CQSZACIVSA-N 339.464 5.342 30 20 EKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)C2CCCCC2)cc1 237505147 NGCQZNWVJLAWDY-MBSDFSHPSA-N 348.490 5.389 30 20 EKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 237850886 QWIUGCMJNDLEOM-HSZRJFAPSA-N 338.410 5.184 30 20 EKED CCOc1cccc(C=Nc2cccc(C3SCCS3)c2)c1O 255337405 SNTFPWQBTWGNMP-UHFFFAOYSA-N 345.489 5.020 30 20 EKED OC1=Nc2cc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)c(F)cc2CC1 329031290 XEQZQZOJAHLPOO-NWANDNLSSA-N 344.430 5.554 30 20 EKED CC[C@@H](C)n1ncc(N=C(O)N2CC(C)(C)CC(C)(C)C2)c1C1CC1 329847802 RDYUJSKPHCEMAZ-CQSZACIVSA-N 346.519 5.035 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCCCCC1CCOCC1 538611018 DCDHHSXEKPLJOG-INIZCTEOSA-N 332.513 5.090 30 20 EKED C=CCOc1ccc(CNc2ccc(Oc3cccnc3)cc2)cc1 584432889 AHWNFYDONYYGSW-UHFFFAOYSA-N 332.403 5.051 30 20 EKED N#CCCCCCC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 588371156 KMPPBNQQVSMJHZ-LJQANCHMSA-N 332.875 5.162 30 20 EKED N#CCCCCCC(=O)N1CCCCC[C@H]1/C=C/c1cccs1 588758000 RDQAJSIVRYAGOQ-UJGDBWEASA-N 330.497 5.007 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NC2CCC(C#N)CC2)cc1 602562904 KDQDAFRZJQEZMF-ZRZPHAQCSA-N 334.463 5.095 30 20 EKED N#Cc1ccc(Cl)cc1NCc1ccnc(Oc2ccccc2)c1 609891802 TVXMMUBPWDKXGL-UHFFFAOYSA-N 335.794 5.011 30 20 EKED C=CC1CCN(C(=O)Nc2cccc(CSC3CCCC3)c2)CC1 610143908 BVTQXYDLHHGZAZ-UHFFFAOYSA-N 344.524 5.292 30 20 EKED N#Cc1ccc(CN[C@@H]2CCCSc3ccc(Cl)cc32)c(F)c1 610812493 GYUBXAAGKXYBBO-QGZVFWFLSA-N 346.858 5.068 30 20 EKED N#CCC[C@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1ccccc1 611337063 LMJQLPOKNWWQBM-ROUUACIJSA-N 345.273 5.615 30 20 EKED CC(C)Sc1ccc(C(=O)/C=C\c2csc([N+](=O)[O-])c2)cc1 728442108 WGWHQFHKBGYGER-BAQGIRSFSA-N 333.434 5.053 30 20 EKED C#Cc1cccc(NC(=O)N(CC2CCC2)[C@H](C)c2ccccc2)c1 741057171 RXEDJLYZRSTFCH-QGZVFWFLSA-N 332.447 5.063 30 20 EKED O=C(/C=C\c1ccc2ccccc2c1)c1c(Cl)nc2sccn12 741846464 AJWHYIGMFVZDGA-VURMDHGXSA-N 338.819 5.099 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1cccc(OC(F)F)c1 742436954 PATXCCSVSOKOKL-LMRAXHDRSA-N 338.400 5.110 30 20 EKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1ccc(OC(F)F)cc1 742437556 VJYNIFDAGXUKIL-LMRAXHDRSA-N 338.400 5.110 30 20 EKED C[C@@H](Nc1cccc(COc2ccccc2)c1)c1ccc(C#N)cc1 743472117 KMFRFAXPADLNEV-QGZVFWFLSA-N 328.415 5.310 30 20 EKED CCCCCCCC[C@@H](C)CC(=O)N1CCCC[C@H]1c1noc(C)n1 775490078 VISIYRUVALONET-AEFFLSMTSA-N 349.519 5.208 30 20 EKED N#C[C@@H](C(=O)c1cc2cccc(Cl)c2o1)c1ccc2ccccc2n1 783068220 IAGXZVQPYSAPGT-CQSZACIVSA-N 346.773 5.124 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(OC(C)C)c(Cl)c1)c1ccncc1 793543776 WBMPQGRBYSRJDC-BEFAXECRSA-N 344.886 5.490 30 20 EKED CC(C)c1ccc(-c2ncc(CSCCO[C@H](C)C#N)s2)cc1 802752080 OBLZTDGNPKUBRR-CQSZACIVSA-N 346.521 5.095 30 20 EKED C=C(C)[C@@H](NCc1ccnc(Cl)c1Cl)c1ccc(F)c(F)c1 811490247 NKAHITQQFKITDH-OAHLLOKOSA-N 343.204 5.074 30 20 EKED Fc1cccc(Cl)c1CON=Cc1ccccc1C(F)(F)F 852181277 GCLMXJBVDZEJIW-UHFFFAOYSA-N 331.696 5.049 30 20 EKED Cc1cc(Cl)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 120335383 YTHQUNZIDLQJFS-GFCCVEGCSA-N 344.867 5.153 30 20 EKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1ccc(C(F)(F)F)cc1 182241814 WQAWPKPODIBANB-OLZOCXBDSA-N 334.341 5.169 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2ccc(F)cc2c1 189913414 BLEUGINZVVVMEF-UHFFFAOYSA-N 348.421 5.478 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(O)c1 191442430 NRQHLCVAYIHSBT-HNNXBMFYSA-N 338.451 5.127 30 20 EKED COc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1N=C(C)O 329001561 LGWZWBAAAKJRAE-BHYGNILZSA-N 344.455 5.498 30 20 EKED COc1cc(N=C(C)O)ccc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 329209888 ZGHXRSUVQYAEBO-HYVNUMGLSA-N 344.455 5.498 30 20 EKED C=CCC(C)(C)CNC(=O)N(Cc1cccs1)Cc1cccs1 432557838 NGRJXGAEQNIZCK-UHFFFAOYSA-N 348.537 5.124 30 20 EKED Cc1nnc(SCCCCC(C)(C)C#N)n1[C@H]1CCC[C@H](C)C1 436194619 PKDYXTLROKANFV-HOCLYGCPSA-N 334.533 5.150 30 20 EKED C=CC[C@H]1N(C(=O)Nc2ccc(COC(C)C)cc2)CCCC1(C)C 445235381 IMEUYWRCFYOCCE-LJQANCHMSA-N 344.499 5.210 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N[C@@H]2CCC[C@H](C#N)C2)cc1 447525972 AJOKCUYDCVBXDY-ABSDTBQOSA-N 334.463 5.095 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1CC(C(C)(C)C)C1 457569781 HSHBVZTYRCDKQT-WLYUNCDWSA-N 330.497 5.092 30 20 EKED C[C@H]1CCCc2ccccc2[C@@H]1NCc1cccc(OCCCC#N)c1 462542360 MIAUPNMYFBRZDB-FDDCHVKYSA-N 348.490 5.172 30 20 EKED C/C(=C\c1ccccc1C(F)(F)F)CNCC1CCC(C#N)CC1 500371542 RRJOMVBXHMIIIN-GXDHUFHOSA-N 336.401 5.028 30 20 EKED N#CC1(CCCS[C@H]2CCc3c(Cl)cccc32)CCOCC1 510084374 JWNPPMUXDYUKCB-KRWDZBQOSA-N 335.900 5.161 30 20 EKED C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1F 512278840 LADMPFWXWCNVNV-LBPRGKRZSA-N 336.332 5.365 30 20 EKED C=CCN(Cc1ccccc1)Cc1csc(-c2ccsc2)n1 520044166 VMBPXXWXDYGTMN-UHFFFAOYSA-N 326.490 5.060 30 20 EKED C=CCC[C@H](NCc1ccc(C)cn1)c1ccc(C(F)(F)F)cc1 532725926 KJQNEOIBPQHVPG-SFHVURJKSA-N 334.385 5.206 30 20 EKED N#CCCSc1ccccc1NC(=O)c1cccc(C2CCC2)c1 543065201 ATMNCRNQFBJMMG-UHFFFAOYSA-N 336.460 5.212 30 20 EKED C[C@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1Cl 554357714 KXAUNAMVACAYDG-JTQLQIEISA-N 333.690 5.627 30 20 EKED C[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1F 559837845 SCWAWMAUVUMOQA-ZIAGYGMSSA-N 336.385 5.401 30 20 EKED C=CCC1(c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)CCC1 580919470 ULJWRXHSTHKHMY-CYBMUJFWSA-N 340.320 5.145 30 20 EKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1F 610007995 BROSUHUZOKSFEZ-IBGZPJMESA-N 330.378 5.211 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(C(F)(F)F)ccc1Cl 665120984 JUVQJGGJBZQMPF-TXEJJXNPSA-N 344.764 5.074 30 20 EKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccsc3)s2)cc1 727973869 ATTITHVQYQFPQV-BAQGIRSFSA-N 341.457 5.085 30 20 EKED CCOc1c(Cl)cc(/C=C\C(=O)c2sccc2C)cc1OC 733748702 HLLDANABDKVDHM-WAYWQWQTSA-N 336.840 5.013 30 20 EKED CSc1ccc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1F 741848346 YEMYOHIPLFNFSE-SREVYHEPSA-N 335.469 5.198 30 20 EKED CC(C)(C)c1nc(C=NOCc2ccc(C(F)(F)F)cc2)cs1 746575317 APVAIVPEJOXKMM-UHFFFAOYSA-N 342.386 5.010 30 20 EKED CC1(C)CCC(=CC(=O)Nc2ccccc2SCCC#N)CC1 751929648 QITKXGAPRJQXGU-UHFFFAOYSA-N 328.481 5.157 30 20 EKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc(Cl)c(F)c1 765612219 DYNHHZKRWSSGRB-CLFYSBASSA-N 327.742 5.030 30 20 EKED CCCCCCCCC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C 778954277 GPUYYFMCQXZCKS-SFHVURJKSA-N 333.520 5.221 30 20 EKED COc1ccc(NN=Cc2c(Cl)cccc2Cl)cc1Cl 782228979 FOXUNASVWJSHML-UHFFFAOYSA-N 329.614 5.101 30 20 EKED Oc1ccc(C2CCC(=NNc3cccc4ncccc34)CC2)cc1 814804206 DSJPZQYJRZKTQT-UHFFFAOYSA-N 331.419 5.066 30 20 EKED C=CCCC[C@H](NCc1csc([C@@H](C)OC)n1)c1ccccc1 880388619 MUYYHJKLEDEFMA-QAPCUYQASA-N 330.497 5.038 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1cc(F)ccc1F 108407512 BVQHZOYRXQHCPB-STQMWFEESA-N 332.419 5.390 30 20 EKED CC(C)(C#N)CCCSCc1coc(-c2ccc(F)c(F)c2)n1 161721010 UYTUZYXKQMAQRJ-UHFFFAOYSA-N 336.407 5.183 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCC1CCCCC1 303288401 LWYYLYRZQWSTTG-MRXNPFEDSA-N 344.524 5.627 30 20 EKED Cc1ccc2cc(CN[C@@H](CCCC#N)c3ccccc3)ccc2n1 353901002 PBBAJQYGQSHTOL-NRFANRHFSA-N 329.447 5.068 30 20 EKED Cc1[nH]c2ccccc2c1C1=CCN(CCCCC(C)(C)C#N)CC1 444657893 MEKBMPGLLWSKSE-UHFFFAOYSA-N 335.495 5.286 30 20 EKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1C(F)(F)F 462890804 YCVNZZGGKIWRDQ-SECBINFHSA-N 326.268 5.028 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(C)C)CC1 475569494 AFWQLBFEKWPURD-UHFFFAOYSA-N 328.500 5.438 30 20 EKED C=CCOc1cccc(NC(=O)N(C)Cc2cccc3ccccc23)c1 510983502 NLOPUHLYYSEGAK-UHFFFAOYSA-N 346.430 5.069 30 20 EKED Cc1c([C@H](NCc2cccc(C#N)c2F)C(C)C)oc2ccccc12 537059693 TWCQMGKQYMXEKE-HXUWFJFHSA-N 336.410 5.239 30 20 EKED CCOc1ccccc1[C@@H](CC)NCc1ccccc1C(C)(C)C#N 539253011 JEQDMMTWBBSLJN-HXUWFJFHSA-N 336.479 5.127 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C)c1cccc(C#N)c1 540595074 UBRHSKWNDJKAIC-LAUBAEHRSA-N 346.499 5.563 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 576057007 DYHSSXSUQJAKOU-KXBFYZLASA-N 346.396 5.791 30 20 EKED N#Cc1ccc(CNC2c3ccccc3-c3ccccc32)cc1Cl 619755461 YAJRKMISMLJOOB-UHFFFAOYSA-N 330.818 5.071 30 20 EKED Cc1cc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)c(C)s1 727264007 LGAJIVOOUYWARC-HJWRWDBZSA-N 325.458 5.385 30 20 EKED COc1ccc2cc(C(=O)/C=C/c3ccnc4ccccc34)ccc2c1 731835616 KUWILSQHWDMRIS-PKNBQFBNSA-N 339.394 5.293 30 20 EKED C[C@H](c1ccccc1Cl)N(C)Cc1cc(Cl)ccc1OCC#N 735308332 HUKOCLPTWNGOGX-CYBMUJFWSA-N 349.261 5.089 30 20 EKED C=C(C)CNC(=S)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 752238899 BALYRNILHJJZDC-OAHLLOKOSA-N 342.533 5.402 30 20 EKED Cc1cc(C)c(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1C 753134643 KWFDYWBCSSXBHH-BQYQJAHWSA-N 334.444 5.026 30 20 EKED Cc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1F 760366147 UONAHLOFCLMVNV-FQEVSTJZSA-N 344.389 5.042 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2cnn(C(C)C)c2)cc1 765948044 YJYUIQXREUOLDZ-JKSUJKDBSA-N 347.890 5.007 30 20 EKED CC1(C)CCC[C@@H]1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772162970 WYHVSEFZLFIPFO-WOJBJXKFSA-N 332.447 5.107 30 20 EKED C=C[C@](C)(CC)C(=O)OCC(=O)Nc1c(C(C)C)cccc1C(C)C 785756450 AHBQXNRJOILYDY-OAQYLSRUSA-N 345.483 5.017 30 20 EKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc2ccccc2c1 788344883 LOAGPQTYJMLBAN-FPLPWBNLSA-N 333.334 5.211 30 20 EKED CSc1ccc([C@H](C)OC(=O)C[C@H](CC#N)c2ccccc2)cc1 798664145 GPHDECCLRHMBRC-YJBOKZPZSA-N 339.460 5.100 30 20 EKED CC(C)[C@@H](N[C@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902785224 CABRTXLQGQZCEM-FZKQIMNGSA-N 347.384 5.020 30 20 EKED CC(C)CC[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351477 CUFRNYQPLYBMLL-LAUBAEHRSA-N 349.478 5.288 30 20 EKED CCC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccn1 91412243 ZWGVBAPIHVRRDC-QFIPXVFZSA-N 341.458 5.251 30 20 EKED CC(C)(C)c1nc(CNc2ccccc2SCCC#N)cs1 153869156 VKXKGQRQXVUDPL-UHFFFAOYSA-N 331.510 5.058 30 20 EKED C[C@@H](NCc1ccc(-c2cccc(F)c2)s1)c1cccc(C#N)c1 237425099 FKQSFHXVKYFVHQ-CQSZACIVSA-N 336.435 5.277 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC[C@H]1CCC2(CCCCC2)O1 466847464 SMVSAHKULRURRR-DLBZAZTESA-N 344.524 5.232 30 20 EKED N#CC[C@H](CC(=O)N1CCC[C@H]1CC1CCCCC1)c1ccccc1 475394322 XKKXANZJNKIANX-RTWAWAEBSA-N 338.495 5.035 30 20 EKED CC(C)CN(C(=O)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 499319608 MLACJTNCVDDCMQ-UHFFFAOYSA-N 347.245 5.168 30 20 EKED CC(C)c1ccc([C@H](NC(=O)c2cccc(CC#N)c2)C(C)C)cc1 514431713 KRVDFPFHNGQSHI-OAQYLSRUSA-N 334.463 5.003 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(Cl)c1 521796829 HJSRXNKSDDPAPC-LBPRGKRZSA-N 345.855 5.378 30 20 EKED N#Cc1ccc(-c2ccccc2)nc1SCc1csc(C2CC2)n1 536091292 YEHBHXOPZMQYMP-UHFFFAOYSA-N 349.484 5.246 30 20 EKED C[C@H](NCc1cc(C#N)cs1)c1ccc(-c2cccc(C#N)c2)cc1 542018591 VGVCLHBUXAVMQZ-HNNXBMFYSA-N 343.455 5.009 30 20 EKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1nc(-c2ccccc2)cs1 564428794 YHSSMDFQMYHNSO-AUUYWEPGSA-N 345.471 5.020 30 20 EKED Cc1cccn2cc(-c3ccc(NCC(C)(C)CCC#N)cc3)nc12 610910232 UZMDHFHMBVAUHH-UHFFFAOYSA-N 332.451 5.052 30 20 EKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1c[nH]c2ccccc12 741844818 UGNBTYHRNWDMRY-KTKRTIGZSA-N 345.320 5.005 30 20 EKED Cc1ccoc1C(=O)/C=C\c1cccc(/C=C\C(=O)c2occc2C)c1 769784549 YYCJSQBVAJIKMR-VRHVFUOLSA-N 346.382 5.282 30 20 EKED C=CC[C@H](N[C@H](C)c1cc2c(ccc3ccccc32)o1)c1ccncc1 776158353 SXXHKZGDOKPJGU-IERDGZPVSA-N 342.442 5.949 30 20 EKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1c(F)cccc1Cl 809158817 DUUNSVHXDRWZIG-VOTSOKGWSA-N 335.762 5.124 30 20 EKED Cc1cccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1Cl 179063201 AMWCHHIFJQBCMF-LBPRGKRZSA-N 344.867 5.153 30 20 EKED N#CCCC[C@@H](NCc1ccccc1C(F)(F)F)c1ccccc1 353916223 PATSAGSRMUYMHK-GOSISDBHSA-N 332.369 5.230 30 20 EKED N#Cc1c(F)cccc1CSCc1csc(-c2ccsc2)n1 427817719 MRYVXZDLXXGDEV-UHFFFAOYSA-N 346.477 5.316 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(Cl)cc(F)c1F 441571265 VKPAMZYLJIDLLU-UHFFFAOYSA-N 339.794 5.149 30 20 EKED C=CCCC1(C(=O)Nc2ccc(SCc3cccnc3)cc2)CC1 474426897 MTBVAUBMRFNSMY-UHFFFAOYSA-N 338.476 5.059 30 20 EKED Cc1c([C@H](C)NC(=O)C[C@H](CC#N)c2ccccc2)oc2ccccc12 474950119 VFUAWMXUHXBYST-WMZOPIPTSA-N 346.430 5.006 30 20 EKED CC(C)N(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)cc1 483434015 NWZHISDSZVKTBU-KRWDZBQOSA-N 340.854 5.169 30 20 EKED C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1nc2ccccc2n1C(F)F 486440467 VMWVGHGWDIUEMJ-SNVBAGLBSA-N 346.768 5.130 30 20 EKED CC(C)c1ccc2c(c1)[C@H](NCc1cccc(OCCCC#N)c1)CC2 495150339 JKJJQTNQVQDIMR-HSZRJFAPSA-N 348.490 5.270 30 20 EKED C=CCC[C@@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 537156901 FFRWBIUCKXMHER-HXUWFJFHSA-N 336.410 5.278 30 20 EKED COc1cccc(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)cc2)c1 538395395 MRJSPKYCDJULDJ-QGZVFWFLSA-N 342.442 5.085 30 20 EKED C[C@H](Nc1ccc(Cl)cc1OC(F)F)c1ccc(C#N)cc1F 545866469 YHERVSGJCNDDSI-VIFPVBQESA-N 340.732 5.125 30 20 EKED C=CC[C@@H](C(=O)N(CC)c1nc2ccccc2s1)c1ccccc1 548607575 VHBRKKIJLQBMLA-MRXNPFEDSA-N 336.460 5.009 30 20 EKED Cc1c(COc2ccccc2)cccc1NCc1cccc(F)c1C#N 600852632 WUTYYUOZZXWXFT-UHFFFAOYSA-N 346.405 5.197 30 20 EKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1 609826178 ZHTNSHQGYBPAMG-CHWSQXEVSA-N 344.867 5.033 30 20 EKED CCCCCN(CCCCC)C(=O)N[C@H](C)c1cccc(C#N)c1 610408149 KTTYSXOEKRYFCJ-QGZVFWFLSA-N 329.488 5.011 30 20 EKED N#Cc1ccc(CN[C@H]2CCSc3ccc(Cl)cc32)cc1Cl 619754620 GCMTZWVRMGRUFG-INIZCTEOSA-N 349.286 5.192 30 20 EKED Cc1ccc(C)c(C(=O)/C=C/c2csc(-c3cccs3)n2)c1 728440019 RLBHCLMVHXPHCO-BQYQJAHWSA-N 325.458 5.385 30 20 EKED CCOc1c(Cl)cc(/C=C/C(=O)c2sccc2C)cc1OC 733748701 HLLDANABDKVDHM-AATRIKPKSA-N 336.840 5.013 30 20 EKED CCO[C@H](C)c1nc(CON=Cc2ccc(C(C)(C)C)cc2)cs1 736604820 PFIFTAUTEJAORC-CQSZACIVSA-N 346.496 5.089 30 20 EKED CC(=NNc1cccc(C(F)(F)F)n1)c1ccc2ccccc2c1 739420971 BLFBLNMSZVPONH-UHFFFAOYSA-N 329.325 5.090 30 20 EKED COc1cc(/C=C/C(=O)c2cc(C)c(F)c(C)c2)ccc1SC 741467022 JFSIROCFTISMSC-FNORWQNLSA-N 330.424 5.069 30 20 EKED C[C@@H](N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(C#N)cc1 765330296 JROLNVFLMIEGCK-BDJLRTHQSA-N 347.245 5.039 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 765333476 VFZBKXPGULHXJL-HOTGVXAUSA-N 340.854 5.101 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(SC(C)C)cc1)c1ccncc1 766022568 XECVEJWIMBMODN-OXQOHEQNSA-N 326.509 5.550 30 20 EKED O=C(/C=C\c1cc(Cl)cs1)c1cccc(-c2ccncc2)c1 782342116 ODSSXJYTBKEJHO-PLNGDYQASA-N 325.820 5.360 30 20 EKED N#Cc1cc2ccccc2cc1NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 839436123 SNKJODORCDZTJQ-GDBMZVCRSA-N 346.352 5.019 30 20 EKED CCC/C(C)=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920323767 JQYLFUKRPBCVGU-RZXPCSSPSA-N 344.867 5.386 30 20 EKED C[C@@H](Nc1cccc(NC(=O)c2cccs2)c1)c1ccc(C#N)cc1 173864778 CPTMAOGCIYPYMQ-CQSZACIVSA-N 347.443 5.045 30 20 EKED Cc1ccc2c(c1)[C@@H](Nc1cccc(OCCCC#N)c1)CCCO2 179820465 ZVSZNTFHPJCYRC-FQEVSTJZSA-N 336.435 5.003 30 20 EKED CC(C)(C#N)CCCn1ccc(=O)c2cc(Oc3ccccc3)ccc21 278480549 FPFWYAVTDMTBTQ-UHFFFAOYSA-N 346.430 5.124 30 20 EKED CC1CCC(=CC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 303584234 PXSQNZNRQUYHOW-LOACHALJSA-N 328.481 5.156 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C(C)(C)C)cc1)c1ccc(OCC#N)cc1 327067553 CCZHXPDMNAZKCC-IRXDYDNUSA-N 336.479 5.298 30 20 EKED Cc1cnc(-c2ccccc2N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)[nH]1 328797904 WESITVSBTPABHJ-IXDOHACOSA-N 337.467 5.580 30 20 EKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](CC(F)F)c1ccccc1 421877279 LOILLMWUPKOCSN-VQTJNVASSA-N 340.417 5.312 30 20 EKED C=CCCC1(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)CC1 474428240 QWHGBXHGQAYFIZ-UHFFFAOYSA-N 349.434 5.016 30 20 EKED C[C@@H](S[C@H](C)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 476156927 QSFLAGVKBPDOQA-ZIAGYGMSSA-N 335.432 5.164 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2ccccc2o1 518738860 BRPOGIKUQNDDBJ-CYBMUJFWSA-N 336.416 5.079 30 20 EKED C[C@H](Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cccc(C#N)c1 538642508 YUZAEDMJJDECHN-AWEZNQCLSA-N 329.403 5.264 30 20 EKED N#CCc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)cc1 567037133 VTTMNIDPRPVWKA-LJQANCHMSA-N 345.273 5.300 30 20 EKED C[C@H](Cc1ccc(Cl)cc1)N[C@H](CCCC#N)c1ccccc1 590069245 LDUATWVREHCEGV-OXQOHEQNSA-N 326.871 5.296 30 20 EKED N#CC1(CC(=O)Nc2cccc(C(F)F)c2Cl)CCCCC1 597501812 XIJZQWAUFVMSBZ-UHFFFAOYSA-N 326.774 5.080 30 20 EKED Cc1cc2cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)oc2cc1C 682127841 PNPGHYYFHFKHID-KRWDZBQOSA-N 340.382 5.088 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cccc(F)c2o1 682803577 CIDXWQKUFZZZIJ-UHFFFAOYSA-N 337.394 5.676 30 20 EKED Cc1cc(/C=C/C(=O)c2cccc(F)c2)ccc1Oc1cccnc1 732714346 XYMBWGMMPRVWEE-VQHVLOKHSA-N 333.362 5.218 30 20 EKED CC(C)CCCCCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 749026523 YDBPJGXMMSZTSK-AWEZNQCLSA-N 347.409 5.214 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 759188184 SUEZGUGOOSDSLU-DEQJRXDXSA-N 346.817 5.168 30 20 EKED C[C@H](CC(C)(C)C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 773984065 QDCPVNJQXGZUBD-ZYHUDNBSSA-N 334.872 5.198 30 20 EKED C[C@H](Cc1cccc(C(F)(F)F)c1)Nc1ccccc1O[C@H](C)C#N 798931580 GFEIIASMUMLSAL-ZIAGYGMSSA-N 348.368 5.039 30 20 EKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1c(F)cccc1Cl 809159691 URTNXHHPWMVDBV-SREVYHEPSA-N 349.839 5.560 30 20 EKED C[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1ccc2ccccc2c1O 848567503 XDNLLCHYXLRMSA-MRXNPFEDSA-N 342.442 5.147 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)s1 66800714 LCXPQVHULASUCB-JTQLQIEISA-N 336.869 5.048 30 20 EKED CCO[C@H](C)c1nc(CS[C@H](C)c2ccc(C#N)cc2)cs1 76861221 KNAAIVCBDHFLQW-CHWSQXEVSA-N 332.494 5.107 30 20 EKED Cc1c(NC(=O)c2ccccc2)cccc1N[C@@H](C#N)C1CCCCC1 115606083 PRFUXRUURXYSDO-NRFANRHFSA-N 347.462 5.132 30 20 EKED CC(C)[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 155961527 FYLCCDUAIFVDQY-WBVHZDCISA-N 345.512 5.123 30 20 EKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H]1CC[C@H](C#N)C1 424335006 WBXVZALMUFRXQK-DETPVDSQSA-N 345.899 5.115 30 20 EKED Cc1sc2ncnc(N[C@@H](CCCC#N)c3ccccc3)c2c1C 431143514 KQIFTRFCOLWNIA-INIZCTEOSA-N 336.464 5.155 30 20 EKED Cc1nc(-c2ccc([C@@H](C)Nc3c(C#N)cccc3C#N)cc2)cs1 436311337 WVFHCVPLYUWCDT-CYBMUJFWSA-N 344.443 5.035 30 20 EKED COc1ccc(Cl)cc1CNc1ccccc1SC[C@H](C)C#N 466387846 VQFFQXMNGVQLRQ-CYBMUJFWSA-N 346.883 5.212 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)cc(C)cc1C 476089348 GUTDNFBJQVMFBU-UHFFFAOYSA-N 335.491 5.645 30 20 EKED C=C(C)[C@H](NC(=O)c1scc(C)c1Cl)c1ccc(F)c(F)c1 480422400 UAWOSTWVQBLHCP-AWEZNQCLSA-N 341.810 5.035 30 20 EKED CC(C)(NCc1ccc(C#N)c(F)c1)c1ccc(Cl)c(Cl)c1 484082261 ZSAIZENXCNVUHG-UHFFFAOYSA-N 337.225 5.029 30 20 EKED CC(C)(CCC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1 487432507 WKCBJFXQBRYRDM-OAQYLSRUSA-N 348.490 5.296 30 20 EKED CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1sccc1C#N 497986610 QNIRUZOZDAOBSQ-UHFFFAOYSA-N 346.883 5.106 30 20 EKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2cc(C#N)ccc2C)cc1 531320552 VKPPPGHUUDVXFC-UTKZUKDTSA-N 347.462 5.180 30 20 EKED C[C@@H](NC(=O)Nc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 541091815 BKSGOYXFXBCIMB-CQSZACIVSA-N 347.443 5.169 30 20 EKED CCSc1ccccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 584387545 NAQMUNYYXFRCHD-CYBMUJFWSA-N 344.505 5.043 30 20 EKED CC(C)(CCC#N)CNCc1cn(Cc2ccccc2)c2ccccc12 588929598 YZLJFXGBECHSEN-UHFFFAOYSA-N 345.490 5.109 30 20 EKED CC[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 596737029 YKBOHAYUDFQMJV-OWCLPIDISA-N 345.512 5.123 30 20 EKED C[C@H](SCc1csc(-c2cccs2)n1)c1ccc(C#N)cc1 609825473 ZSVZDAXJGSORMV-LBPRGKRZSA-N 342.514 5.738 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cc(C)cc1Cl 615476838 RVHVMNSFKXWSHG-UHFFFAOYSA-N 346.833 5.316 30 20 EKED C=CCC[C@@H](NCc1ccnc(C)c1)c1ccc(C(F)(F)F)cc1 621274596 RPGTYDBXQYHXOR-GOSISDBHSA-N 334.385 5.206 30 20 EKED CC(C)(C)Sc1ccc(NC(=O)/C=C/c2ccccc2C#N)cc1 726760070 ITTGVXDWYMBCMS-MDWZMJQESA-N 336.460 5.101 30 20 EKED CCc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)s1 728438950 CTUSNUFSMIEUCF-ALCCZGGFSA-N 331.487 5.392 30 20 EKED CC(C)n1cc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cn1 732713789 HDHFQZILKWSQIM-FPLPWBNLSA-N 340.423 5.228 30 20 EKED C=CCCCCCCCNC(=O)c1c(Cl)cc(C#N)cc1Cl 752981621 DPONHMYWQNUVBP-UHFFFAOYSA-N 339.266 5.121 30 20 EKED C=CCC[C@@H](N[C@H](C)c1ccc(N2CCCC2=O)cc1)c1ccccc1 773077042 PRMDSWWGINNNQE-XMSQKQJNSA-N 348.490 5.172 30 20 EKED CCCCCCCC[C@H](C)CC(=O)N1CCC[C@@H]1c1cc(C)on1 775137073 SRYADAWBRAIACM-QFBILLFUSA-N 334.504 5.423 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(OCC#N)cc1 776159237 WCAFFJLKNOZROF-XMSQKQJNSA-N 336.479 5.335 30 20 EKED C[C@@H](C#N)OCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 801655429 ZFXKHIKKTFQOBB-KBXCAEBGSA-N 331.868 5.091 30 20 EKED C[C@H](CCc1ccc(C(F)(F)F)cc1)Nc1cccc(OCC#N)c1 802648722 PAMMLZDFABACOZ-CQSZACIVSA-N 348.368 5.041 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3(C)CCCC3)n2)cc1 808979832 NLMAHVSURWYZQH-INIZCTEOSA-N 338.476 5.265 30 20 EKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)o1)c1cc(F)ccc1F 916134995 WOLZILYCYOVTGO-TWGQIWQCSA-N 328.289 5.260 30 20 EKED CCCOc1cc(/C=C/C(=O)c2ccc(Cl)s2)ccc1OC 916135807 UXGNSAPLGGFXSU-GQCTYLIASA-N 336.840 5.095 30 20 EKED CCCCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917025226 IHVLXQMIVXBCSM-QGZVFWFLSA-N 340.492 5.737 30 20 EKED N#C[C@H](C(=O)CCC1CCCC1)c1nc2cc(Cl)ccc2s1 917043792 NLWMJYHRNQLMHD-CYBMUJFWSA-N 332.856 5.096 30 20 EKED C=CCN(C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)C(C)C 918076755 NBXRKOIJQXDUDM-IBGZPJMESA-N 342.870 5.035 30 20 EKED CCCCCCCCCN(C)C(=S)Nc1ccc(Cl)cc1 918722329 DPSSJXJXXPCGQC-UHFFFAOYSA-N 326.937 5.719 30 20 EKED CC(=NNc1ccccc1C(=O)O)C(c1ccccc1)c1ccccc1 1776029867 CDEZULYTJPYTLN-UHFFFAOYSA-N 344.414 5.005 30 20 EKED CC(C)(C)CC(=NNc1cccc(C(=O)O)c1)c1ccc(Cl)cc1 1776036821 AESBNTMJZWJIKQ-UHFFFAOYSA-N 344.842 5.291 30 20 EKED CCc1c(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)oc2ccccc12 110969098 LRZFEOGIQZFJMJ-NRMKIYEFSA-N 345.398 5.182 30 20 EKED C[C@@H](Nc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1 173961495 XYOGCBBGKXWQAL-MRXNPFEDSA-N 332.403 5.041 30 20 EKED Cc1csc(-c2ccc(N[C@@H](C)c3ccc(OCC#N)cc3)cc2)n1 183015576 DQAAJMMUWXGBGG-HNNXBMFYSA-N 349.459 5.194 30 20 EKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(OCC#N)cc3)c2)cs1 192995590 AXZJXQSQXZCTCT-AWEZNQCLSA-N 349.459 5.194 30 20 EKED N#CCCC[C@@H](NCc1ccc(Br)s1)c1ccccc1 353916233 PHKVOCSFZGQNTH-OAHLLOKOSA-N 349.297 5.035 30 20 EKED N#CCCC[C@H](NCc1cc(Br)cs1)c1ccccc1 353917168 SNODHPWJWGJURD-INIZCTEOSA-N 349.297 5.035 30 20 EKED CC(C)(c1ccc(NCc2cccc(F)c2C#N)cc1)C(F)(F)F 427400634 VOYGNODHFCNZMU-UHFFFAOYSA-N 336.332 5.149 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccccc1F 476123801 QAYPRKFWNZEPIF-OAHLLOKOSA-N 341.426 5.084 30 20 EKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(-c2ccccc2Cl)o1 484454352 CTNLPLBUGOCMMT-UHFFFAOYSA-N 344.842 5.144 30 20 EKED CC[C@H](C)[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 499604513 DPMMVQAFYCNPDV-QFBILLFUSA-N 348.918 5.117 30 20 EKED Cc1nc(S[C@H](C#N)C2CCCCC2)c2c(C)c(C)sc2n1 524535829 VOSCIJAXJKGYDD-CQSZACIVSA-N 331.510 5.181 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 539047849 XTWAXAJTBHCHQE-ACJLOTCBSA-N 333.262 5.689 30 20 EKED CCC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1F 540424610 GAKKTVFNTGBZPD-HXUWFJFHSA-N 342.433 5.397 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(OC(F)(F)F)cc1 586790325 SMDIWGQVQHEGBF-SCLBCKFNSA-N 348.368 5.259 30 20 EKED C=CC1CCN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CC1 599680873 UKQTXMUKYDCVSY-UHFFFAOYSA-N 331.868 5.107 30 20 EKED CC(C)c1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 603755327 NMXVJSYCCSDQNM-UHFFFAOYSA-N 348.490 5.051 30 20 EKED Cc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610356318 OVFBRSWVFHEYFW-DYESRHJHSA-N 349.478 5.014 30 20 EKED CCOc1ccc(Cl)cc1[C@@H](C)N[C@H](C)c1cccc(C#N)c1 610829681 DRIHHCVOHCGXNX-ZIAGYGMSSA-N 328.843 5.022 30 20 EKED C[C@H](N[C@H]1CCc2cc(Cl)cc(Cl)c21)c1cccc(C#N)c1 611166831 AEIJOGHAOHPFNF-GTNSWQLSSA-N 331.246 5.203 30 20 EKED CC(C)C[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 727955160 ZZRLNPCRPZJFFT-GDBMZVCRSA-N 326.465 5.059 30 20 EKED COc1ccc2oc(C(C)=NNc3ccc4ccccc4n3)c(C)c2c1 729141252 VPNRNDISEQFHAD-UHFFFAOYSA-N 345.402 5.134 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 740764698 CAWUBHYUXLUCLC-KTKRTIGZSA-N 327.305 5.150 30 20 EKED CC(=NNc1cc([N+](=O)[O-])ccc1C)c1cc(Cl)sc1Cl 747062021 RODDBFILMGIPKB-UHFFFAOYSA-N 344.223 5.108 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccc(N3CCCC3)cc2)CC1 770401315 AAVUXIHLPWULIH-UHFFFAOYSA-N 345.490 5.103 30 20 EKED O=C(/C=C/c1cccc2cnccc12)c1c[nH]c2cc(Cl)ccc12 782889579 IXEILOCYMXPCIM-QPJJXVBHSA-N 332.790 5.266 30 20 EKED Cc1c(C(=O)/C=C/c2ncc(C(F)(F)F)s2)oc2ccccc12 788347460 AXOJLBMLYWEGAQ-VOTSOKGWSA-N 337.322 5.113 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1 1776699938 IZVDEYFZUKKXRK-BMSUMIBZSA-N 336.431 5.411 30 20 EKED CCCCCCCCCN(C)c1nc2ccccc2c(C)c1C(=O)O 1776785417 ZPNQPQBBHMLUAM-UHFFFAOYSA-N 342.483 5.428 30 20 EKED CCc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)oc1CC 125235421 HRFCLXAHBLBTTA-CYBMUJFWSA-N 342.464 5.051 30 20 EKED CCOc1cccc2cc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)oc12 181418059 VCGCOPZXFIQRKZ-HUUCEWRRSA-N 334.419 5.115 30 20 EKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 255168571 VKAGENUEJISLLF-XCHKQJEOSA-N 344.867 5.200 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccc(C)cc2C1 432583961 KNUFDBUGPSBHHV-UHFFFAOYSA-N 334.463 5.395 30 20 EKED CCN(C(=O)CC[C@H](C)c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 440791639 KEALPRRRGKDWGP-ROUUACIJSA-N 334.463 5.052 30 20 EKED CCc1cccc2c(C3CCN(CCCC(C)(C)C#N)CC3)c[nH]c12 472440687 RSDFMJNQTJSAAT-UHFFFAOYSA-N 337.511 5.240 30 20 EKED C=CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 474544825 RCGNMFVFICORCV-HKBOAZHASA-N 332.447 5.295 30 20 EKED CC[C@H](CN(CC)C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 476830098 NWJZFNXKMMQCQM-GOSISDBHSA-N 348.490 5.144 30 20 EKED CC(C)(C#N)c1ccccc1CSc1ccc(C(F)(F)F)cn1 488495036 ZIYXUGFACKFBJI-UHFFFAOYSA-N 336.382 5.194 30 20 EKED CCN(Cc1ccc(Cl)c2cccnc12)[C@H](C)c1ccc(C#N)cc1 507704194 RBGQNKQXTAMLST-OAHLLOKOSA-N 349.865 5.343 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)Nc3ccc(C#N)cc3)s2)cc1 517393166 IJJGZYAVHSVKTI-AWEZNQCLSA-N 333.460 5.472 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3ccccc3)o2)n1 541405928 HVTVHPQMRHGOPN-AWEZNQCLSA-N 336.416 5.017 30 20 EKED C=CCC[C@H](NC[C@@H]1CCCN(C)[C@H]1c1cccs1)c1ccco1 552047203 DANJAMHZJXRDPF-ABSDTBQOSA-N 344.524 5.021 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 573825937 WQBVFTZHAGCQGL-QAPCUYQASA-N 339.401 5.014 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCCc2sc(Cl)cc21 589949256 BVBAQMNAVPWLKH-SJORKVTESA-N 342.895 5.318 30 20 EKED C=C(C)CN(CC)C(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 595916678 NFYKLBJQBWKPOM-UHFFFAOYSA-N 346.430 5.047 30 20 EKED CCC1CCC(=NNc2nc(C(F)(F)F)nc3ccccc23)CC1 725830379 FQPZJXWTGUSSGI-UHFFFAOYSA-N 336.361 5.017 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(OC(F)F)c(Cl)c2)s1 731490215 VHAJUBLQZQBLCE-HYXAFXHYSA-N 328.767 5.207 30 20 EKED CC(C)c1nc(C#N)c(NN=C2CCC[C@H]2c2ccc(Cl)cc2)o1 741461160 XGNRPZUGSRKQJP-AWEZNQCLSA-N 342.830 5.059 30 20 EKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 744119479 RXGZNWVBMQPUGS-JSGCOSHPSA-N 332.444 5.218 30 20 EKED C=CC[C@@H](N[C@@H](C)c1sc(C(C)(C)C)nc1C)c1ccncc1 766018819 JAFITRZUOMUELP-XJKSGUPXSA-N 329.513 5.112 30 20 EKED Cc1cc2ccc(Cl)cc2nc1NN=C1CCC2(CCCO2)CC1 788023436 DHECQJICFNZYEK-UHFFFAOYSA-N 343.858 5.088 30 20 EKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc(CCC#N)cc1 932579175 KWWJAQGMPSKGRL-FQEVSTJZSA-N 335.451 5.148 30 20 EKED CC(Cc1ccc(-c2ccccc2)cc1)=NNc1ccccc1C(=O)O 1776029888 FZYSQZUJBUMACI-UHFFFAOYSA-N 344.414 5.082 30 20 EKED CCCCCCC[C@H](CC(=O)O)NC[C@@H](C)CCc1ccccc1 1776782389 PWGLCUANAOXCTF-AZUAARDMSA-N 333.516 5.049 30 20 EKED CCCCc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1 1776806025 VFLYVLOCUHJJSZ-QXMHVHEDSA-N 336.431 5.240 30 20 EKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 90665393 BCUZKIOAKXTOIQ-OALUTQOASA-N 344.405 5.374 30 20 EKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc3ccccc3c2)cc1 110650065 FVHKHUCKPYYEHB-OIQJVACTSA-N 327.383 5.027 30 20 EKED C[C@@H](Cc1nnc(SCCCCC(C)(C)C#N)o1)c1ccccc1 277502013 DRERFNYUOJVVAY-HNNXBMFYSA-N 343.496 5.228 30 20 EKED Cc1ccc(-c2nnc(SCCCCC(C)(C)C#N)o2)c(C)c1 277553486 JQEJPKDHABLDLI-UHFFFAOYSA-N 329.469 5.166 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2ccccc2F)o1)c1ccccc1 344862166 WQFIKTFJGMBFEB-HXUWFJFHSA-N 334.394 5.220 30 20 EKED C[C@@H](N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1(C)CC1 438694803 QLIICDQTEZILCJ-OAHLLOKOSA-N 349.434 5.003 30 20 EKED Cc1ccc([C@H]2CCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1C 475174981 JSGFAMYOHKKZAZ-RBBKRZOGSA-N 346.474 5.055 30 20 EKED CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(C(C)(C)C#N)cc1 475365968 CTDWXCNNDZMZNR-HXUWFJFHSA-N 334.463 5.101 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H]1CCCC[C@@H]1CC 476149447 NLYPBPGBKDUUSS-PXNSSMCTSA-N 343.511 5.462 30 20 EKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC)c1cccc(Cl)c1 500384522 OSMCXRFKGKYDKC-KRWDZBQOSA-N 348.899 5.250 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)CCC=C2 511695034 IXTMEZHBPWYXCW-OAHLLOKOSA-N 348.471 5.293 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 550829416 FXEAIYWWCLMYJV-KUHUBIRLSA-N 330.834 5.565 30 20 EKED Cc1ccc(-c2cncc(F)c2)cc1N[C@@H](C)c1cccc(C#N)c1 600853552 KUCOEAOPGXDGJO-HNNXBMFYSA-N 331.394 5.241 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C#N)Cc1ccccc1 609918797 PHDRUTPCCGLHLK-LEWJYISDSA-N 346.499 5.065 30 20 EKED Cc1cc2occ(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2cc1C 681173641 NCASPUNKNAGMJF-KRWDZBQOSA-N 340.382 5.088 30 20 EKED N#CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c1 727744032 BAENTUUBHOKGMX-ZROIWOOFSA-N 339.394 5.152 30 20 EKED CC(C)(C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739154752 DMDNMSVSNVFXEU-CQSZACIVSA-N 346.883 5.466 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1ccc(N2CCCCC2)cc1 740764389 UIQRTRIGWYHXSF-SEYXRHQNSA-N 342.442 5.121 30 20 EKED CCOc1ccccc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741473479 QNIOZIWSLKOIKO-ZHACJKMWSA-N 329.399 5.043 30 20 EKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1C(F)(F)F 750900056 LSWGLZJZTSEZKB-CAOUKYIASA-N 347.292 5.066 30 20 EKED C[C@H](OC(=O)C1(C#N)CCCC1)c1ccc(Cl)c(C(F)(F)F)c1 759587006 XZLZGDXHGUGZED-JTQLQIEISA-N 345.748 5.047 30 20 EKED CC/C(C)=C(\C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 779910906 SZERPGIXTFFMGL-BMRADRMJSA-N 348.446 5.131 30 20 EKED C#CCOc1ccc(C(=O)Nc2c(CCC)cccc2C(C)C)cc1 788488418 POPMURDFNIDZJG-UHFFFAOYSA-N 335.447 5.027 30 20 EKED CCCCCCCC[S@](=O)Cc1cc(-c2cccs2)on1 790140223 QIRRAEHMSJNBSW-NRFANRHFSA-N 325.499 5.012 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792101825 HCVNTSQTAFDVTI-LAUBAEHRSA-N 342.442 5.070 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1csc(C(F)(F)F)c1 925601014 JGDRKXQVKUPEIM-SWLSCSKDSA-N 338.398 5.463 30 20 EKED CCCCCCCCC=CCCCCCCCC(=O)N[C@@H](C)CO 1857777076 IPVYNYWIRWMRHH-FQEVSTJZSA-N 339.564 5.521 30 20 EKED COc1ccc(-c2csc(CN[C@H](C)c3ccc(C#N)cc3)c2)cc1 177484203 NQQYGNGHLQMNQZ-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1cccc(C)c1 189909465 JTCPQHJLBNOCHN-UHFFFAOYSA-N 337.463 5.255 30 20 EKED CC(O)=Nc1cc(N=C(O)N[C@@H]2CCCCC23CCCC3)ccc1F 329595818 BZNSEAFGSDHPGG-QGZVFWFLSA-N 347.434 5.072 30 20 EKED N#CCCC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccc1 340445180 LSTZDBAOFJJRJW-GOTSBHOMSA-N 343.474 5.351 30 20 EKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1F 478430917 HPEFFDNTKXKRCA-ZDUSSCGKSA-N 332.806 5.335 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1ccc2ccccc2n1)c1ccc(F)c(F)c1 480680165 KLGRHTZQTGGUNA-SPLOXXLWSA-N 338.401 5.481 30 20 EKED CC(C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 483431843 FAMFXFOAGYNLDY-UHFFFAOYSA-N 340.854 5.196 30 20 EKED C=CCC(CC=C)C(=O)Nc1ccccc1-c1c(F)cccc1F 494532563 UCVZXHYUCIQJNF-UHFFFAOYSA-N 327.374 5.339 30 20 EKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2ccccc2)cc1 524243897 VZJUNJRQUKSTOX-MRXNPFEDSA-N 344.414 5.532 30 20 EKED Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c(C)c1 540875609 HRXOKAMNJHQEGU-UHFFFAOYSA-N 342.398 5.220 30 20 EKED CC[C@H](C)n1ncc(NCc2ccc(C(C)(C)C#N)cc2)c1C1CC1 594500494 NNWZMHIWBUVBLX-HNNXBMFYSA-N 336.483 5.145 30 20 EKED Cc1sc(NC(=O)c2cc3c(Cl)cccc3s2)c(C#N)c1C 603445221 XHRQRUDMVWVLGI-UHFFFAOYSA-N 346.864 5.357 30 20 EKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1Cl 609387307 WPPKSTNJACGOHC-UONOGXRCSA-N 330.884 5.765 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1COC(C)(C)CC 666702519 XSMWJDVCVZCZAG-HDICACEKSA-N 342.483 5.107 30 20 EKED CC(=NNc1c(F)cccc1F)c1csc(-c2csc(C)n2)c1 735615265 MKBZSWYMGGBKCE-UHFFFAOYSA-N 349.431 5.294 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1cccc(OC(F)(F)F)c1 740765718 PCRBDOOXXVVASF-HJWRWDBZSA-N 343.304 5.030 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(C)c(C)cc2C)c1 772981735 ABBJOYQHGJZUPV-AZUAARDMSA-N 336.479 5.144 30 20 EKED CC1(C)CCCC[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 789404835 FVUGFJGRVOSXBI-JKSUJKDBSA-N 338.476 5.203 30 20 EKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1Cl 792100263 DIBDADTWYFWESA-GOSISDBHSA-N 348.833 5.006 30 20 EKED C/C(=C/c1cccc(C(F)(F)F)c1)CNc1cccc(OCC#N)c1 809636047 OFCWXRQNUYGZHC-UVTDQMKNSA-N 346.352 5.123 30 20 EKED N#Cc1cccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)c1 834709725 MEMHQSRNLJTOLH-FLIBITNWSA-N 349.336 5.209 30 20 EKED CC(CCCCC#N)=NNc1nc2cc(C(F)(F)F)ccc2s1 841625373 JFOWKCOGPULKKG-UHFFFAOYSA-N 340.374 5.187 30 20 EKED CC(=NNc1ccc(Cl)cc1)c1sc2nc(C)nc(C)c2c1C 863950898 UNOKAQOTTDUGMQ-UHFFFAOYSA-N 344.871 5.106 30 20 EKED O=C(/C=C/c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)s1 917142923 DZPBEWKCWYNIHS-VOTSOKGWSA-N 341.413 5.281 30 20 EKED O=C(O)c1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)s1 917518626 HPNLTUXDBFEEHJ-VOTSOKGWSA-N 340.425 5.071 30 20 EKED C=C(C)CNC(=S)Nc1ccc(Sc2ccccc2)cc1C 63793737 ZTAAYMMUOUTVCX-UHFFFAOYSA-N 328.506 5.009 30 20 EKED C[C@H](NCc1cccc(OCCCC#N)c1)c1c(F)cccc1Cl 177714265 YKNJRNFNEHNUEG-AWEZNQCLSA-N 346.833 5.012 30 20 EKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccsc1 303161309 PCRQXYHYWLEBIZ-FARCUNLSSA-N 329.421 5.215 30 20 EKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccoc3C3CC3)cc2)c1 409673380 OIWYHPQCRVKAFG-UHFFFAOYSA-N 344.370 5.073 30 20 EKED CC[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 426303438 YBBDLNIILIWQSM-CVEARBPZSA-N 330.884 5.391 30 20 EKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)s1 429565544 IGGCJDNUIHBRPV-CYBMUJFWSA-N 348.418 5.042 30 20 EKED N#CCCC[C@@H](NCCCOc1cccc(Cl)c1)c1ccccc1 433024784 YPSJSVGGUVORPH-HXUWFJFHSA-N 342.870 5.134 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)CC(F)(F)F 451332649 QJAGPPAUGNESAP-ZDUSSCGKSA-N 327.390 5.456 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)c1cccs1 475565489 PXLSSMXMTNVWJU-QGZVFWFLSA-N 342.508 5.873 30 20 EKED C=C(C)[C@@H](NCc1cnc(CC(C)C)s1)c1ccc(F)c(F)c1 479384701 CAHVJDZSYAFBCU-GOSISDBHSA-N 336.451 5.027 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC=C(c2ccccc2C)C1 505028531 FZFXHFVEMSJHRL-UHFFFAOYSA-N 332.447 5.045 30 20 EKED N#Cc1ccc(N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1 507027243 LINZXQKNSFIKKC-OAQYLSRUSA-N 326.399 5.161 30 20 EKED Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 542994263 JSTYBZXGSMDSIB-DLBZAZTESA-N 330.431 5.539 30 20 EKED C=C(C)[C@H](NCc1cscc1C(F)(F)F)c1ccc(F)c(F)c1 558575654 SXDUBLFHKUJBEN-HNNXBMFYSA-N 347.352 5.452 30 20 EKED N#CCc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 573910228 UZQGAEHDCXFCAQ-IBGZPJMESA-N 344.380 5.012 30 20 EKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)CC2 575841202 SRZDVCCMXVWGFM-SFTDATJTSA-N 344.483 5.181 30 20 EKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc4ccccc4s3)cc2c1 583352732 JWUPZHKLQALXFW-ZDUSSCGKSA-N 348.452 5.310 30 20 EKED N#CC1(c2ccc(CNc3ccc(CCC(F)(F)F)cc3)cc2)CC1 594931195 DVJAFKJLFYGEOF-UHFFFAOYSA-N 344.380 5.349 30 20 EKED C[C@@H](Nc1ccccc1COc1ccccc1)c1cccc(C#N)c1 600849180 KYDSEXGVCONAAB-QGZVFWFLSA-N 328.415 5.310 30 20 EKED C=CCOc1cccc(CN[C@H](Cc2ccccc2)c2cccs2)c1 604891930 BGXGXDBGRXRYKZ-OAQYLSRUSA-N 349.499 5.387 30 20 EKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)C1CCCCC1 730420152 AKIDYTQDRQFLMU-SWLSCSKDSA-N 344.455 5.218 30 20 EKED N#C[C@H](C(=O)CCCCCc1cccs1)c1ccc2ccccc2n1 731547335 YBNQQJKSDJOKHQ-SFHVURJKSA-N 348.471 5.276 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)OCCCCC#N)sc2c1 732684447 LIBDMGJIGPBXEJ-UHFFFAOYSA-N 335.856 5.529 30 20 EKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 734079632 SONVSRZHSXVLPU-HUUCEWRRSA-N 326.465 5.079 30 20 EKED CSc1ccc2c(c1)CC/C(=C/c1nccc3ccccc13)C2=O 740765342 XGUOOUHIIVMPBA-SSZFMOIBSA-N 331.440 5.169 30 20 EKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2ccc(F)cc2F)ccc1OC 749450700 CVSQGPJWYVSNNJ-OMDQHUAHSA-N 346.373 5.047 30 20 EKED CC(C)[C@@H]1/C(=C/c2csc(-c3ccccn3)n2)C(=O)c2ccccc21 766507726 XAHUJNOJDHIHGN-XGHXRCDJSA-N 346.455 5.225 30 20 EKED C#CCCCCCC(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 779894787 BVBRPLRSELHLGU-UHFFFAOYSA-N 342.826 5.050 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)s1 902884382 GYEIWXFIHHUKGP-JSGCOSHPSA-N 338.398 5.463 30 20 EKED N#CCC[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)c1ccccc1 178755926 USFWIUMDWSOFIU-HXUWFJFHSA-N 334.394 5.220 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1SC 189891367 AAQVUQWTZNSSAJ-UHFFFAOYSA-N 325.477 5.513 30 20 EKED CCO[C@@H](C)c1nc(CS[C@H](C)c2cccc(C#N)c2)cs1 190801816 FKQRJFZLPFDYQL-QWHCGFSZSA-N 332.494 5.107 30 20 EKED C[C@@H]1C[C@@H](C(O)=Nc2cccc(COC3CCCCC3)c2)CCC1=O 328954131 MTEJYRCVEUKXIC-WBVHZDCISA-N 343.467 5.129 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(Cl)sc1Cl 410351717 MVWBQWBQZIXHAI-UHFFFAOYSA-N 326.248 5.426 30 20 EKED C[C@@H]1c2c(sc(NC(=O)c3ccoc3C3CC3)c2C#N)CC[C@H]1C 410978378 CVYJWNCUCOROET-MNOVXSKESA-N 340.448 5.028 30 20 EKED C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466230950 APKZMLSRRUFNIG-IRXDYDNUSA-N 332.447 5.005 30 20 EKED Cc1c(C(=O)N2[C@H]3CC[C@H]2c2ccccc23)sc2ccc(C#N)cc12 516322700 WUBKZLOLGVFJAD-ROUUACIJSA-N 344.439 5.113 30 20 EKED C[C@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 525952010 QGYNKPYZUWAZGC-WDEREUQCSA-N 337.225 5.416 30 20 EKED CC(C)C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccs1 539628087 YLCRWBHNLQQUHZ-GOSISDBHSA-N 328.481 5.630 30 20 EKED C=CCC[C@H](NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccco1 552048229 LMYLDLCUUHVJOR-DYXWJJEUSA-N 325.452 5.044 30 20 EKED C=CCSc1ccccc1C(=O)Nc1cc(C)c(F)cc1Cl 579521533 ASQAFRGLNWZHHU-UHFFFAOYSA-N 335.831 5.318 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(C2CC2)c1 593974601 JSDFKPOAOWMPBK-AWEZNQCLSA-N 336.460 5.068 30 20 EKED N#CCCCCSc1ncnc2scc(-c3ccc(F)cc3)c12 594669398 JHYALRORDRKITA-UHFFFAOYSA-N 343.452 5.283 30 20 EKED CSc1cc(Cl)ccc1NCc1cccc(OCCCC#N)c1 600862447 WWUNZYBQWPUCBR-UHFFFAOYSA-N 346.883 5.357 30 20 EKED CC(C)CCN1Cc2cccc(N[C@H](C)c3ccc(C#N)cc3)c2C1 609824877 BUISCRCHBYXDSU-QGZVFWFLSA-N 333.479 5.093 30 20 EKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccc(OC(F)F)cc1 741840403 SMBKVVSBQYRDML-VOTSOKGWSA-N 332.277 5.069 30 20 EKED C/C(C=NOc1ccccc1C(F)(F)F)=C\c1ccc(Cl)cc1 754713095 ZCLKCOFEXWRONW-SJLHFSNBSA-N 339.744 5.827 30 20 EKED Cc1ccoc1C(=O)/C=C/c1cc(C)c(OCc2ccccn2)c(C)c1 769784536 YPZHXVIDOHHLSK-BQYQJAHWSA-N 347.414 5.075 30 20 EKED C#CC[C@@H](N[C@H](CC)c1ccccc1OC(F)F)c1ccccc1 773106233 KWTXMQDDIKZBHW-QZTJIDSGSA-N 329.390 5.093 30 20 EKED C#CC[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 773117326 VJKXBJYYAQRRLA-MSOLQXFVSA-N 327.880 5.231 30 20 EKED O=C1/C(=C\c2coc(-c3ccccc3)n2)CCc2[nH]c3ccccc3c21 781551990 POWRIWQQGCCONR-QINSGFPZSA-N 340.382 5.035 30 20 EKED O=C1/C(=C/c2cc(Cl)cs2)CCc2ncc(C(F)(F)F)cc21 782350785 DJRZINRTCFQDMW-FPYGCLRLSA-N 343.757 5.028 30 20 EKED C=CC[C@@H](C(=O)O[C@H](C)c1ccc(C(F)(F)F)cn1)c1ccccc1 798671105 XMGICFGSDBPOOJ-CZUORRHYSA-N 349.352 5.065 30 20 EKED CC(C)c1ccc(N2Cc3ccc(N[C@@H]4CC[C@@H](C#N)C4)cc3C2)cc1 799718828 AKRYIODLKXMAMX-DYESRHJHSA-N 345.490 5.434 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2coc3ccccc23)c(C(F)(F)F)c1 811692416 FLABFSVYINSIEZ-FPLPWBNLSA-N 341.288 5.219 30 20 EKED N#Cc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 834693761 QSYQHRZZDHNXIR-DAXSKMNVSA-N 336.605 5.415 30 20 EKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1 1776697836 QJWHJSFMEOEMON-JVPRBTQMSA-N 334.415 5.194 30 20 EKED CCN(Cc1c(Cl)ccc2cccnc12)[C@H](C)c1ccc(C#N)cc1 60469658 GSSBWTSXWVOHIA-OAHLLOKOSA-N 349.865 5.343 30 20 EKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3ccsc3)c2C#N)C1 60751591 RMLFQPHHSQJGSY-LBPRGKRZSA-N 344.505 5.085 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1 173990902 XROZWPNIHDXZGE-CABCVRRESA-N 347.487 5.402 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cc2ccccc2o1 189878850 GHDQZBIWQZMFJV-MRXNPFEDSA-N 347.458 6.027 30 20 EKED C=CCN(Cc1ncc(-c2ccccc2)o1)Cc1ccc(Cl)s1 301765480 TXCLSOKWUCSCTE-UHFFFAOYSA-N 344.867 5.245 30 20 EKED C=CCCc1ccccc1NC(=O)[C@H]1CCCC[C@H]1C(F)(F)F 410377123 ZVKPQEJLFVLPLS-LSDHHAIUSA-N 325.374 5.112 30 20 EKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 424356096 UWJUMWCKNOHIBV-FOIQADDNSA-N 342.870 5.434 30 20 EKED C[C@H](N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccc(C#N)cc1 435661188 CJXQVXAOEMGFDK-IXDGSTSKSA-N 344.380 5.174 30 20 EKED CC(C)(C#N)CCCN[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F 445990808 CQAZGKFZODTGBM-RDJZCZTQSA-N 338.417 5.261 30 20 EKED N#Cc1ccc(S[C@H](c2ccccc2)c2ccc(F)c(F)c2)nc1 463268892 WBSZGPLWHRACOM-LJQANCHMSA-N 338.382 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH]c(C)c(C)c2c1 476789593 OGLOYFRJBSGZDE-UHFFFAOYSA-N 346.474 5.889 30 20 EKED CCC[C@H](CC)SCC(=O)c1cn(CCC#N)c2ccccc12 477068121 NUVNQFHAFIWTRL-HNNXBMFYSA-N 328.481 5.050 30 20 EKED CCC(CC)[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1ccccc1 503348269 SRILSBCIFIRABN-IERDGZPVSA-N 349.478 5.096 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCCC(C)(C)C 518169320 RBHISMFGZQRSDU-OAHLLOKOSA-N 347.528 5.276 30 20 EKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cccc2ccccc12 609387079 JSEIWCWECRSRCE-SJORKVTESA-N 346.499 6.265 30 20 EKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)C(C)C 729891662 LULPBCOHTLRRCF-AAEUAGOBSA-N 334.872 5.198 30 20 EKED O=C1/C(=C/c2ccsc2)CCc2nc(-c3ccccc3F)sc21 731939353 WKZPTANJGXDVHG-FMIVXFBMSA-N 341.432 5.223 30 20 EKED CC[C@H](N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccc(C#N)cc1 774224247 NVYSNUWNHJGQTE-VQTJNVASSA-N 332.447 5.045 30 20 EKED CC(C)C[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccs1 776157564 CMGZCVQIRXGVOY-MAUKXSAKSA-N 328.481 5.088 30 20 EKED O=C1/C(=C\c2scnc2C2CC2)Cc2cc(Cl)cc(Cl)c21 782347177 JBCWACPKQMUNIY-YHYXMXQVSA-N 336.243 5.150 30 20 EKED N#CCCC[C@@H](NC(=O)OCc1ccc(Cl)cc1)c1ccccc1 859168732 OLBPHZCQLAZPBB-GOSISDBHSA-N 342.826 5.001 30 20 EKED Cc1cc(Br)cc(C)c1N[C@H](C)c1cccc(C#N)c1 37772376 KWEVSZZVCLKEJF-CYBMUJFWSA-N 329.241 5.111 30 20 EKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Br)c1 90664481 VSYSXZGPYQORBP-KSSFIOAISA-N 343.268 5.145 30 20 EKED N#CCC[C@@H](NCc1csc(-c2cccs2)n1)c1ccccc1 130416969 YVLCIPSXEOOSOD-MRXNPFEDSA-N 339.489 5.006 30 20 EKED C=C(C)CN(CC)[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 152529881 PDCPRFDHADWSCL-NSHDSACASA-N 340.254 5.002 30 20 EKED C[C@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(OCC#N)cc1 181623158 XBJQNQPSPNJGED-JTSKRJEESA-N 334.463 5.171 30 20 EKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(OCC#N)cc3)c2)oc1C 183020166 YXCXTCVLFDZPMX-HNNXBMFYSA-N 347.418 5.034 30 20 EKED CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 185198247 FVUCHSYLLCSJAT-HZPDHXFCSA-N 345.512 5.125 30 20 EKED Cc1c(C(=O)/C=C/C=C/c2ccccc2[N+](=O)[O-])oc2ccccc12 303099923 HDEIYPZHYPKKGD-XCCLWPCOSA-N 333.343 5.102 30 20 EKED Cc1nnc([C@@H](C)/N=C(/O)C2(C3CCCCC3)CCCCC2)s1 329558346 HZJNJZRXPZZFDK-CYBMUJFWSA-N 335.517 5.395 30 20 EKED Cc1cc2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2[nH]1 432788217 XDLKCBCHXJCRGF-LJQANCHMSA-N 346.434 5.033 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@]12CCc1ccccc12 476151395 NZXDFDZHQUAIKV-XUZZJYLKSA-N 345.486 5.381 30 20 EKED CC[C@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccccc1 504401280 LXIOSJVFVBIJHW-OAQYLSRUSA-N 348.490 5.127 30 20 EKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)cc1OCCC 510089625 NJCCVWJNRCXJJX-UHFFFAOYSA-N 338.451 5.004 30 20 EKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536816409 MGSHNFUZMLUJCC-YJBOKZPZSA-N 349.434 5.145 30 20 EKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC(CC#N)CC2)c(C)c1 543830098 RLDVTRWUUBLSGR-HNNXBMFYSA-N 345.512 5.043 30 20 EKED Cc1ccccc1C(NCc1ccc(C#N)cc1F)c1ccccc1C 544840377 QJFDHGQMEQYCFP-UHFFFAOYSA-N 344.433 5.193 30 20 EKED C=CCCO[C@@H](C)c1nc(C(C)(C)c2cccc3ccccc23)no1 551121187 ZVYXLIUPZWJCNP-HNNXBMFYSA-N 336.435 5.202 30 20 EKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCC(C)(C)CCC#N 588231661 WTYMGYGWDNAEQP-CQSZACIVSA-N 327.497 5.099 30 20 EKED C[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)CC(C)(C)C 609427766 JJSLKIZKGDLIQZ-LSDHHAIUSA-N 332.513 5.482 30 20 EKED C=CCN(C(=O)c1ccc(C)cc1C)c1nc(-c2ccccc2)cs1 641902183 CLPZBLSNLZGRCZ-UHFFFAOYSA-N 348.471 5.260 30 20 EKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C1CCCCCCC1 741536795 ZWUONRZUWGYYDH-UHFFFAOYSA-N 336.435 5.045 30 20 EKED N#C[C@@H](C(=O)CCCC1CCCC1)c1nc2cc(Cl)ccc2s1 744036416 YNYMJPSOWPQLHX-AWEZNQCLSA-N 346.883 5.486 30 20 EKED C=CC[C@H](N[C@H](C)c1ccc(SC(C)C)cc1)c1ccncc1 766022569 XECVEJWIMBMODN-UZLBHIALSA-N 326.509 5.550 30 20 EKED C[C@H](N[C@@H](C)c1csc2ccccc12)c1ccc(OCC#N)cc1 776157087 PEXPVKQOLVHWAK-GJZGRUSLSA-N 336.460 5.215 30 20 EKED CCC[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1 797570782 KKIVYXSMSVQREY-HZPDHXFCSA-N 340.492 5.201 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(C(C)C)nc1C 890165645 IMTZRECDQRJLOP-UHFFFAOYSA-N 337.467 5.013 30 20 EKED C=CCCCCC[C@H](C)N[C@@H](C(=O)O)c1cccc2ccccc12 902565140 JSCJEUUXKPGDKJ-OXJNMPFZSA-N 325.452 5.080 30 20 EKED CC(CC[C@H]1[C@@H](C)CCCC1(C)C)=NNc1cccc(C(=O)O)c1 1776038052 POLHIFRSLOCQJC-KSSFIOAISA-N 330.472 5.415 30 20 EKED Cc1cc(C)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 90560336 OKRIFNWLWVEDEY-AWEZNQCLSA-N 338.476 5.116 30 20 EKED COc1cc2c(cc1NC(=O)C1(C#N)CCCCC1)oc1ccccc12 98111383 VSEKYSAAYKTZAA-UHFFFAOYSA-N 348.402 5.007 30 20 EKED N#Cc1ccc(CSc2nnc(-c3cccc4ccccc34)o2)cc1 126943744 YQRVVAPRKMXYDO-UHFFFAOYSA-N 343.411 5.054 30 20 EKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ncc(-c2ccccc2)o1 173968824 GOWPZRCFXREKGX-MRXNPFEDSA-N 347.418 5.197 30 20 EKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1ccc(C(F)(F)F)cc1 182241851 WQAWPKPODIBANB-CHWSQXEVSA-N 334.341 5.169 30 20 EKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1nc(C(C)(C)C)cs1 184507171 ULADILQZNBGPMR-AWEZNQCLSA-N 341.524 5.093 30 20 EKED C=C(C)[C@H](NCc1cc(F)cc2cccnc12)c1ccc(F)c(F)c1 187776285 MCIFSJFSTQBHCM-IBGZPJMESA-N 342.364 5.059 30 20 EKED Cc1cc(CCCC(=O)Nc2ccc(Cl)cc2CC#N)c(C)s1 410969718 PZCNCCNYCPDSDY-UHFFFAOYSA-N 346.883 5.046 30 20 EKED C=CC[C@@H](CC)NCc1cccc(NC(=O)c2ccccc2Cl)c1 466400527 DITFEOBLPVLGGQ-MRXNPFEDSA-N 342.870 5.037 30 20 EKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 480584555 JKJLZTWXCLZALI-YWZLYKJASA-N 349.434 5.003 30 20 EKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1C(F)(F)F 481990225 PILLWTKVFGDJHO-UHFFFAOYSA-N 340.389 5.306 30 20 EKED C[C@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1F 512618900 KLHCTDUXXQHPQS-NEPJUHHUSA-N 336.332 5.128 30 20 EKED C=C[C@@H](CC(=O)Nc1cnccc1-c1cccc(F)c1)c1ccccc1 536280482 OHPJASYGSJEJOM-INIZCTEOSA-N 346.405 5.186 30 20 EKED N#C[C@@H]1CC[C@H](N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 559149870 OYZBJNSFSJASAI-HICWGWBUSA-N 342.792 5.092 30 20 EKED C[C@H](CC#N)Sc1ccccc1NCc1c(F)cccc1Cl 561403863 PQWHCTUEAKHIDU-GFCCVEGCSA-N 334.847 5.485 30 20 EKED Cc1nc(S[C@H](C#N)Cc2ccccc2)n(C2CCCCC2)c1C 604084888 JRYCVOBSYUYHNS-IBGZPJMESA-N 339.508 5.232 30 20 EKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)C1(C)C 609428700 UXZITXCLZGWVFN-RKVPGOIHSA-N 342.508 5.258 30 20 EKED CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609438603 MFFANHVHYMOKHM-XHSDSOJGSA-N 345.512 5.171 30 20 EKED N#Cc1ccc(CN[C@@H](c2cccs2)C2CCCC2)cc1Cl 619754525 CGJDJFSNTJKUKL-GOSISDBHSA-N 330.884 5.294 30 20 EKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCC(C)(C)C)cc1 729070373 UUIGWUMDPGFKOM-CRAIPNDOSA-N 342.483 5.064 30 20 EKED C[C@@](C#N)(NC(=O)c1sc2ccccc2c1Cl)C1CCCCC1 734238990 VYCALUFLGFAWRL-SFHVURJKSA-N 346.883 5.147 30 20 EKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2cccc(C#N)c2)o1 734304602 PLYYUGBHOHRXIO-CSKARUKUSA-N 331.346 5.162 30 20 EKED O=C(/C=C\c1nccc2ccccc12)c1c[nH]c2cc(Cl)ccc12 740764639 AVYNOYLWERIFFF-FPLPWBNLSA-N 332.790 5.266 30 20 EKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744037574 YLLDGHVZPKPBEU-NVXWUHKLSA-N 340.492 5.593 30 20 EKED O=C(/C=C/c1cc2ccccc2o1)c1sccc1Br 750903751 DFBTZZXJLIDMPZ-AATRIKPKSA-N 333.206 5.153 30 20 EKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)OCC2CCC(C#N)CC2)C1 755974883 MGPKUYSFEGVWFM-YNIZLOQISA-N 349.515 5.015 30 20 EKED C=CC[C@@H](N[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 766018395 HHSFNUWJRQNWEA-WZONZLPQSA-N 328.459 5.717 30 20 EKED Cc1cccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)C(C)(C)C)c1 776163484 RZTPYDCPSSRVIO-UTKZUKDTSA-N 336.479 5.335 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(C#N)c(F)c3)cs2)cc1 776725793 GDZITKZQJBXJLM-HJWRWDBZSA-N 348.402 5.025 30 20 EKED COc1ccc(NCCCC(C)(C)C#N)c(OCc2ccccc2)c1 783960310 LZRIPOYCSBHFGF-UHFFFAOYSA-N 338.451 5.016 30 20 EKED Cc1cc(NN=C2CCC3(CCCO3)CC2)nc2ccc(Cl)cc12 788015777 OEZOSEPHUBPJMO-UHFFFAOYSA-N 343.858 5.088 30 20 EKED C[C@H](C=NOCc1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 789036956 KQHYIPYDJXRJHI-GFCCVEGCSA-N 325.305 5.151 30 20 EKED C#CCN(Cc1ccccc1)C(=O)Nc1c(CCC)cccc1C(C)C 806449167 ATXBELCALNPINB-UHFFFAOYSA-N 348.490 5.430 30 20 EKED CCCCCC(C)=Nn1cnnc1SCc1ccc(Cl)cc1 818267460 ZRSAFWZUYMORTP-UHFFFAOYSA-N 336.892 5.028 30 20 EKED N#C[C@H](C(=O)C1CCC2(CC1)CC2)c1nc2cc(Cl)ccc2s1 850771472 OZXAPXHVMHPQAK-CYBMUJFWSA-N 344.867 5.096 30 20 EKED C=CCCC[C@H](NCc1cnc([C@H]2CCCO2)s1)c1ccccc1 883325038 MXLSYAMMNNTIAE-RBUKOAKNSA-N 342.508 5.182 30 20 EKED CC(Cc1ccc(-c2ccccc2)cc1)=NNc1ccc(C(=O)O)cc1 1776011928 AETLDYSFZBKGRK-UHFFFAOYSA-N 344.414 5.082 30 20 EKED COc1cc(/C=C\C(=O)c2ccc(C)o2)ccc1OCc1ccccc1 210542070 ZKPJYFSIEJKJKS-LUAWRHEFSA-N 348.398 5.072 30 20 EKED Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 303182723 UTIFVZYLHRQIKH-UHFFFAOYSA-N 346.361 5.050 30 20 EKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 424356114 UWJUMWCKNOHIBV-YWZLYKJASA-N 342.870 5.434 30 20 EKED CCN(Cc1ccc2nc(C)sc2c1)[C@@H](C)c1ccc(C#N)cc1 426028463 LTACWHDKLNTTPT-AWEZNQCLSA-N 335.476 5.060 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 455388994 WABNAGQWYFGMAT-OAQYLSRUSA-N 347.462 5.362 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 466588248 VEMPCJSAUTUKAL-UHFFFAOYSA-N 332.513 5.460 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CC/C=C/c1ccccc1 476162716 UYKUACWLCBNYCL-RIYZIHGNSA-N 333.475 5.971 30 20 EKED C=CCOc1ccccc1CN[C@@H](C)c1ccc(-c2ccncc2)cc1 482887883 LPBAGZMJDOTLOC-SFHVURJKSA-N 344.458 5.164 30 20 EKED CCCCN(C(=O)c1cccc(CC#N)c1)[C@@H](CC)c1ccccc1 513284466 NPNZMCAZONTTOR-NRFANRHFSA-N 334.463 5.146 30 20 EKED Cc1cc2cc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)oc2cc1C 525859834 OOPGAQKNOLXYJX-CQSZACIVSA-N 346.411 5.149 30 20 EKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(C(F)(F)F)c1 557518212 WHHFBYOIXDZDJS-ORAYPTAESA-N 344.380 5.305 30 20 EKED C=CCC[C@@H](C)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560264633 CHFLMIRDWSUUKL-KDOFPFPSSA-N 341.417 5.117 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccccc1OC1CCCC1 561139608 FDJAXFPGNFSJCA-JOCHJYFZSA-N 346.474 5.047 30 20 EKED CC[C@@H](N[C@H](C)c1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1 564039499 IAFDPVLOAYBHEA-CZUORRHYSA-N 327.497 5.114 30 20 EKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(F)cc1C(F)(F)F 599029147 CVSZYRANSPGEGF-NEPJUHHUSA-N 336.332 5.128 30 20 EKED C[C@H](Nc1ccccc1N(C)Cc1ccccc1)c1cccc(C#N)c1 600848883 YCULKZBZRSORJH-SFHVURJKSA-N 341.458 5.368 30 20 EKED CCc1cc(C#N)c(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)s1 609407966 KLAVFNTUEKXDPB-MOPGFXCFSA-N 346.455 5.078 30 20 EKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccsc1 609969119 HUEPHMCYICAUMK-CQSZACIVSA-N 348.427 5.154 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)NCCCCC#N)sc2c1 732638977 DTKMKVJHGCMZRF-UHFFFAOYSA-N 334.872 5.102 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(Cl)s3)co2)cc1 748442207 XQJVYCOLSVOQOU-VOTSOKGWSA-N 329.808 5.261 30 20 EKED O=C(/C=C\c1cccnc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750911029 WXMMOOQKMOGYKF-ARJAWSKDSA-N 345.242 5.015 30 20 EKED Cc1ccoc1C(=O)/C=C\c1ccc(/C=C\C(=O)c2occc2C)cc1 769784488 XDJVGVPSIVCUDN-XOHWUJONSA-N 346.382 5.282 30 20 EKED C[C@H](c1ccccc1)N(CCCC(C)(C)C#N)Cc1ccccc1O 776012016 WAQNATAMSCQHQF-GOSISDBHSA-N 336.479 5.285 30 20 EKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1cccc2cnccc12 782889748 LKSMQZBRFIAGQT-HJWRWDBZSA-N 336.460 5.193 30 20 EKED CC1(C)CC(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796796683 ILVUSQAUDJBTOQ-AWEZNQCLSA-N 344.867 5.076 30 20 EKED C=C[C@@](C)(CCOC)c1nc(-c2ccc(SC(C)(C)C)cc2)no1 809440216 MKKFAVVQCGEFJV-IBGZPJMESA-N 346.496 5.107 30 20 EKED N#CCc1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1 904549942 KMSKFBCAZXVICO-UHFFFAOYSA-N 337.382 5.137 30 20 EKED O=[N+]([O-])c1cc(Cl)ccc1NN=Cc1c(Cl)cccc1Cl 915976213 QAFXUTBIOLYGTD-UHFFFAOYSA-N 344.585 5.001 30 20 EKED CCCCCCCC(=O)N(Cc1cccnc1)Cc1ccccc1C 918666442 TUGQGKHBJFKOSF-UHFFFAOYSA-N 338.495 5.279 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc2ccccc2c1F 1776784724 NNEFYBKSQMDKJS-GOSISDBHSA-N 345.458 5.272 30 20 EKED Cc1ccc(-c2csc(/C=C/c3ccc(O[C@H](C)C#N)cc3)n2)cc1 110657039 CLMOJWUWLJYOBR-NYUWMOHMSA-N 346.455 5.580 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)N[C@H](CCC#N)c1ccccc1 159724127 JURVOJOLMARNPU-LJQANCHMSA-N 335.451 5.285 30 20 EKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1c(F)cccc1Cl 177714278 YKNJRNFNEHNUEG-CQSZACIVSA-N 346.833 5.012 30 20 EKED C[C@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(OCC#N)cc1 181265046 KBHZFVWFRMBMDP-JTSKRJEESA-N 334.463 5.171 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(C(C)(C)C)nc1C 188064484 UFCGJUGRLNCLMF-UHFFFAOYSA-N 339.483 5.051 30 20 EKED CCCCCCCC[S@](=O)Cc1csc(-c2ccco2)n1 190742158 DWTIFKRUSZRHGE-NRFANRHFSA-N 325.499 5.012 30 20 EKED CC(O)=Nc1cc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)ccc1F 328975029 BECOLEZLGNVYAH-CWRNSKLLSA-N 332.419 5.628 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc(SC)ccc1Cl 410345072 OCHJYIMCJYFOFX-UHFFFAOYSA-N 331.868 5.433 30 20 EKED CSc1ccc(NC(=O)c2sc3ccc(C#N)cc3c2C)cc1 427994180 GSXHYJAYVITAKB-UHFFFAOYSA-N 338.457 5.056 30 20 EKED Cc1cc(CNc2ccc(COCc3ccccc3)cc2)ccc1C#N 444002263 JKGSPMSLCAIAPL-UHFFFAOYSA-N 342.442 5.196 30 20 EKED N#C[C@@H](C(=O)c1ccc2sccc2c1)c1nc2ccccc2s1 473076918 KQTJJQIKWOPGCU-ZDUSSCGKSA-N 334.425 5.001 30 20 EKED CC[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 487449974 SIYWYMRIILDIJZ-KNQAVFIVSA-N 348.490 5.430 30 20 EKED C=CCCc1ccccc1NC(=O)c1cc2cc(Cl)sc2[nH]1 488560913 KXQRDKBWNCOULK-UHFFFAOYSA-N 330.840 5.254 30 20 EKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1c(F)cccc1F 505022535 FDUZZECYRLUOJA-CQSZACIVSA-N 344.405 5.308 30 20 EKED Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(C)c1 520918155 YUFZYMLBZZASGP-UHFFFAOYSA-N 342.398 5.220 30 20 EKED N#CCc1ccc(C[S@@](=O)c2ccc(C3CCCCC3)cc2)cc1 541268151 BOBDNWBICWFFPH-XMMPIXPASA-N 337.488 5.108 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)NCc2cc3ccccc3s2)cc1 552993522 DTAZSWQAXIIAAF-UHFFFAOYSA-N 349.459 5.024 30 20 EKED CCSc1ccccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 565764203 XUXMEBNRVDUHEC-FXAWDEMLSA-N 338.520 5.884 30 20 EKED CCSc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)cc1 578556288 RUDOPXGHUSJOEK-QGZVFWFLSA-N 349.459 5.089 30 20 EKED N#Cc1cc(CN[C@@H](c2cccc(Cl)c2)C2CCCCC2)ccn1 610956825 MFJOKLFHCUUFDU-HXUWFJFHSA-N 339.870 5.018 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cccc(OC)c2o1 682803685 MJWWOBUUNQQNJH-UHFFFAOYSA-N 349.430 5.546 30 20 EKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)CC(C)(C)C)n2)cc1 773982392 IEHJATGVAPHJBP-GDBMZVCRSA-N 340.492 5.367 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)CC(C)(C)C)n2)cc1 773982394 IEHJATGVAPHJBP-HOCLYGCPSA-N 340.492 5.367 30 20 EKED CC(C)Oc1c(F)cc(NCc2ccc(C(C)(C)C#N)cc2)cc1F 774300017 ZUECMVHCJGFGAN-UHFFFAOYSA-N 344.405 5.165 30 20 EKED CC(C)C[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccs1 776157567 CMGZCVQIRXGVOY-YJBOKZPZSA-N 328.481 5.088 30 20 EKED C[C@H](C(=O)OCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 798784440 ARIMNCYRVLWTBH-ZDUSSCGKSA-N 341.373 5.072 30 20 EKED CCC[C@H](N[C@H](C)c1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1 902786757 SJQSACAFLHWKLQ-DYVFJYSZSA-N 347.384 5.164 30 20 EKED CCCCCCCOc1ccc(CNCCCC(C)(C)C(=O)O)cc1 1776787148 YCOYTJDWEIMIHO-UHFFFAOYSA-N 349.515 5.016 30 20 EKED CC(C)c1ccc(C(=O)Nc2ccccc2SCCC#N)s1 185898934 IZTCNFADIUZUTM-UHFFFAOYSA-N 330.478 5.130 30 20 EKED C=C(C)[C@@H](N[C@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 186454711 BHTSBLDGJHTERO-SJKOYZFVSA-N 336.451 5.260 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1ccc2ccccc21 189905744 GMFQOAHOEKBGQX-UHFFFAOYSA-N 332.447 5.132 30 20 EKED Cc1cc2nc(/C=C\c3ccc(O[C@H](C)C#N)cc3)sc2cc1C 208009043 HSHKDJCLEPELLI-WUKHSURWSA-N 334.444 5.374 30 20 EKED C[C@H](Nc1cc(Cl)cc(Br)c1)c1cccc(C#N)c1 308321280 VPRLCSCKZLNZSQ-JTQLQIEISA-N 335.632 5.147 30 20 EKED C[C@H]1Sc2ccc(/C(O)=N/[C@@H]3C[C@H]3C3CCCCC3)cc2N=C1O 329892019 IRNLBZWADDFMTM-BYCMXARLSA-N 344.480 5.042 30 20 EKED N#CCCCOc1cccc(NC(=O)c2ccc(C3=CCCC3)cc2)c1 353039173 HYZDFYOUEZIEDC-UHFFFAOYSA-N 346.430 5.189 30 20 EKED C[C@H](N[C@@H](C)c1cncc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 367799520 GLCDURRJABVGET-HOTGVXAUSA-N 345.421 5.171 30 20 EKED Cc1cnc([C@@H](C)SCc2ccc(-c3ccccc3C#N)cc2)cn1 427681393 XEMGGSGVSMRIHM-MRXNPFEDSA-N 345.471 5.318 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1cc(F)c(Cl)cc1Cl 442867235 KWABJVZTNCKCMZ-VOMCLLRMSA-N 329.246 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CCC[C@H]1C 475549332 LKMJRAIQPNHUKU-DLBZAZTESA-N 328.500 5.581 30 20 EKED Cc1cccnc1[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(C)C 481670564 PDBCGNVDUCVXRM-LEWJYISDSA-N 333.479 5.016 30 20 EKED CCC(CC)[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1 503386895 UTLPBMRVKFEZQW-HXUWFJFHSA-N 335.451 5.052 30 20 EKED C[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1F 512626102 RYNNZIVRJQGFJV-WDEREUQCSA-N 337.225 5.416 30 20 EKED C[C@H](CC(C)(C)c1c[nH]c2ccccc12)NCC1CCC(C#N)CC1 550933306 ISEPDHGOVSOFIF-WWDZGPRUSA-N 337.511 5.144 30 20 EKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1 559865971 XEPKPTXFJIRDLX-LIRRHRJNSA-N 347.289 6.079 30 20 EKED N#Cc1ccc(Cl)c(C(=O)N(c2ccsc2)C2CCCCC2)c1 577142353 ZIFOKPGOHYJFMX-UHFFFAOYSA-N 344.867 5.253 30 20 EKED C=CCc1cc(/C=C(\Cl)c2nc3ccccc3o2)cc(OC)c1O 747064448 WFWAAEWZJLSIBP-UVTDQMKNSA-N 341.794 5.007 30 20 EKED CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccc2ccccc2c1 754205388 WKLQNFRHZJZGHG-UHFFFAOYSA-N 334.806 5.032 30 20 EKED C#CCCCC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 758154334 JOLNRPMSIQJEGE-UHFFFAOYSA-N 347.336 5.240 30 20 EKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2cnn(C(C)C)c2)cc1 765948041 YJYUIQXREUOLDZ-CVEARBPZSA-N 347.890 5.007 30 20 EKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792094767 GQIFIDOISAKPGO-IERDGZPVSA-N 342.442 5.167 30 20 EKED CC(CC(C)(C)c1ccccc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033349 MXICSZBRLPWZHB-UHFFFAOYSA-N 344.842 5.194 30 20 EKED C[C@@H](Nc1ccc(Br)cc1Cl)c1cccc(C#N)c1 37252961 UEEZQHQNMUANBD-SNVBAGLBSA-N 335.632 5.147 30 20 EKED CC[C@@H](c1ccccc1)c1nnc(S[C@H](C)c2ccc(C#N)cc2)o1 118176879 CEDRRVYLKSVTHF-KDOFPFPSSA-N 349.459 5.336 30 20 EKED CCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 180541560 SDCDLJXFVPSIGH-JKSUJKDBSA-N 340.492 5.113 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)[nH]c2ccccc12 189904651 AXIISFBIYRDOLL-UHFFFAOYSA-N 346.474 5.509 30 20 EKED CC(C)N(C(=O)c1cccc(CC#N)c1)c1ccc(Cl)c(Cl)c1 194770128 BPFNWLDQWNAUAN-UHFFFAOYSA-N 347.245 5.115 30 20 EKED CC[C@H](C)Oc1ccc(NCc2cccc(OCCCC#N)c2)cc1 237022592 RRFZQBAQUVYBKE-KRWDZBQOSA-N 338.451 5.159 30 20 EKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cc2ccccc2s1 237501865 GZCGQTZPRXNEKZ-MRXNPFEDSA-N 349.503 5.102 30 20 EKED C[C@@H](c1ccc(CNC2(c3cccc(C#N)c3)CC2)cc1)C(F)(F)F 295075737 WYZRRDHGOUYWED-AWEZNQCLSA-N 344.380 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CSC)C1 297964770 YGXYERYKEXOYAB-MRXNPFEDSA-N 346.540 5.145 30 20 EKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)C1(CC)CCCC1)C(O)=N2 329816328 OCMHIMMKRSBRKM-HNNXBMFYSA-N 328.456 5.251 30 20 EKED CC(C)(C)[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 440209666 ASKBWKKIMWRRCS-WOJBJXKFSA-N 349.478 5.118 30 20 EKED Cc1cccc(C)c1[C@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 458643179 DOVCXGJBLRAIGP-AZUAARDMSA-N 349.478 5.099 30 20 EKED N#CC[C@@H](CC(=O)N1CCCCC[C@@H]1c1ccccc1)c1ccccc1 474956050 UMEGNVFVCRYIET-FCHUYYIVSA-N 346.474 5.218 30 20 EKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 480584552 JKJLZTWXCLZALI-MGPUTAFESA-N 349.434 5.003 30 20 EKED C=C[C@H](CC(=O)Nc1cnn(CCCC)c1C(C)C)c1ccccc1 482719767 YKKNWIFAXHSVEY-QGZVFWFLSA-N 339.483 5.105 30 20 EKED CCCCc1noc([C@@H](C)SCc2ccccc2C(C)(C)C#N)n1 486748188 VZVQCBZAWDVTOT-CQSZACIVSA-N 343.496 5.208 30 20 EKED CC[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 487519362 ZIMNTFRGTUTFHZ-NQIIRXRSSA-N 334.463 5.122 30 20 EKED CC[C@H](C)[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Cl)cc1 498012556 BHERQVXBNDNBOX-WMLDXEAASA-N 349.906 5.056 30 20 EKED C[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 509704575 PUCHZLOHXHWSBJ-HZPDHXFCSA-N 349.434 5.003 30 20 EKED N#Cc1cccc(/C=C\c2nc(-c3c(Cl)cccc3Cl)no2)c1 520273017 YUOWEIIPLHACIP-FPLPWBNLSA-N 342.185 5.085 30 20 EKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(OC(C)(C)C)cc1 551817580 PSNKHNTVQZXICI-INIZCTEOSA-N 334.463 5.075 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C3=CCCC3)cc2)n1 570491433 QZRRNFIQQRAOKN-KRWDZBQOSA-N 336.460 5.324 30 20 EKED N#CC1(NC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CCCCC1 585717457 HMQGUDAUTGXLDE-UHFFFAOYSA-N 344.867 5.025 30 20 EKED CC(C)CN(C(=O)CC/C=C\c1ccccc1)c1ccc(C#N)cc1 609967764 FEXDNQITNBCDGT-POHAHGRESA-N 332.447 5.041 30 20 EKED Cc1cc(/C=C/C(=O)c2ccc(F)cc2)ccc1Oc1cccnc1 732713853 MSYOPEZJFHYIEK-ONNFQVAWSA-N 333.362 5.218 30 20 EKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036524 BAZASYABAILDRS-RDJZCZTQSA-N 340.492 5.593 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3coc4ccccc34)co2)cc1 747705421 NVJNQFBPAKUWOL-ZHACJKMWSA-N 329.355 5.292 30 20 EKED C[C@@H](C=NNc1c(Cl)cc(Br)cc1Cl)CCC#N 766025246 JPHJSZILQDGCQI-MRVPVSSYSA-N 349.059 5.093 30 20 EKED C=CCCN(OCc1ccccc1)C(=O)Nc1cccc(C(F)F)c1 782756414 ONHLEYLKQAWBBP-UHFFFAOYSA-N 346.377 5.166 30 20 EKED N#CC1CCC(CNC(=O)Nc2ccc3c(c2)oc2ccccc23)CC1 799386432 XLRONKHDODUYGY-UHFFFAOYSA-N 347.418 5.037 30 20 EKED CC[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(Cl)c1O 841760465 FNKDLJLFUMLADJ-MOPGFXCFSA-N 340.854 5.036 30 20 EKED C=CCC[C@@H](NCc1cccc(F)n1)c1ccc(C(F)(F)F)cc1 851905105 HWFIFHDRENOMQL-MRXNPFEDSA-N 338.348 5.037 30 20 EKED Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc([N+](=O)[O-])c3)s2)o1 912859487 YADAZTCUSBTRDN-SOFGYWHQSA-N 339.372 5.121 30 20 EKED CCCCCCCOc1cccc(CN[C@@H](CC(C)(C)C)C(=O)O)c1 1776787917 FTEITHAVKODRCS-IBGZPJMESA-N 349.515 5.015 30 20 EKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)cn1 208118029 SZWOUIZQZLWVCC-CLFYSBASSA-N 340.423 5.228 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccsc1 303164408 HRBIRDBFTJPURH-VOTSOKGWSA-N 329.421 5.215 30 20 EKED N#CCC[C@H](NCc1ccc(-c2ccccc2F)o1)c1ccccc1 344862163 WQFIKTFJGMBFEB-FQEVSTJZSA-N 334.394 5.220 30 20 EKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 464567129 GRMFLOWWQZDPET-IRXDYDNUSA-N 327.493 5.440 30 20 EKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C(C)(C)C1 472701282 UZNHMSGIGNXZLV-OAHLLOKOSA-N 349.434 5.003 30 20 EKED C=C(C)COc1cc(CN[C@H](C)c2cc(C)cc(C)c2)ccc1OC 500560388 DHGFGGSHXFBDES-GOSISDBHSA-N 339.479 5.118 30 20 EKED CC(C)c1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c(C(C)C)c1 505358156 UEDOGYLTZCAYKC-MRXNPFEDSA-N 349.478 5.688 30 20 EKED C[C@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(Cl)cc1 521608173 OWMNMKCUMYZGIM-ZDUSSCGKSA-N 344.867 5.035 30 20 EKED CCN(Cc1ncc(-c2ccccc2)s1)[C@@H](C)c1ccc(C#N)cc1 538308057 KASFNSXFDJABHS-INIZCTEOSA-N 347.487 5.265 30 20 EKED Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(Cl)c1C 592273936 JBSDZDJSQPMVGK-AWEZNQCLSA-N 341.842 5.053 30 20 EKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CC1(C#N)CCCCC1 598809270 XMNIEVOABRGMRZ-UHFFFAOYSA-N 349.459 5.089 30 20 EKED Cc1ccc2c(Cl)c(C(=O)Nc3sccc3C#N)sc2c1 609148983 LHLTVBLDTHCYPV-UHFFFAOYSA-N 332.837 5.049 30 20 EKED C#Cc1cccc(NC(=S)Nc2cccc(C(F)F)c2Cl)c1 757935518 HECVBOJQBOIRIJ-UHFFFAOYSA-N 336.794 5.068 30 20 EKED C[C@@H](NCc1cccc(SC(F)(F)F)c1)c1cccc(C#N)c1 781339541 NUEPOLBYVNZSEE-GFCCVEGCSA-N 336.382 5.021 30 20 EKED CSc1ccc(C(=O)/C=C\c2cn(C(C)C)nc2C)c(Cl)c1 798370716 VPRBPUFWLBZERA-YVMONPNESA-N 334.872 5.044 30 20 EKED Cc1c(NN=C2CCCC[C@@H]2C2=CCCCC2)cccc1C(=O)O 1776088011 KHDUADHJSDMVQW-QGZVFWFLSA-N 326.440 5.152 30 20 EKED Cc1ccc([C@@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)cc1 105844497 BGNCIXQEDVBYBV-QGZVFWFLSA-N 340.426 5.025 30 20 EKED CC[C@H](NCc1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 180549198 QERALBVJDJTYHI-SFHVURJKSA-N 349.261 5.137 30 20 EKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccc(C#N)cc1 303227199 XGPLACSWQTTYAB-ZHACJKMWSA-N 348.402 5.025 30 20 EKED N#Cc1ccc(NCc2ccc(-c3nc4ccccc4s3)o2)cc1 324817752 FRHCDOVPMUOSGG-UHFFFAOYSA-N 331.400 5.040 30 20 EKED O/C(Cc1coc(-c2ccccc2)n1)=N/[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329176784 LVQURMRWLQRGAX-RYQLBKOJSA-N 338.451 5.200 30 20 EKED CCC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340444711 IPEZLPXSGSIXNJ-FCHUYYIVSA-N 336.479 5.561 30 20 EKED N#CCCCOc1cccc(NCc2cscc2C(F)(F)F)c1 352841878 SYUATMZYFUBGER-UHFFFAOYSA-N 340.370 5.062 30 20 EKED CSc1cccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 427988397 CYMMFMISMGOWFW-UHFFFAOYSA-N 338.457 5.056 30 20 EKED CCC(CC)(CC)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 438060894 IUNMVFOTBPBOQS-AWEZNQCLSA-N 333.501 5.029 30 20 EKED CC[C@H](Nc1cccc(OCc2cscn2)c1)c1ccc(C#N)cc1 447594716 HUEYMROJPQCIFC-FQEVSTJZSA-N 349.459 5.157 30 20 EKED CC[C@@H]1CC[C@H](C)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 454775978 YKBOHAYUDFQMJV-ARFHVFGLSA-N 345.512 5.123 30 20 EKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1C(F)(F)F 462890805 YCVNZZGGKIWRDQ-VIFPVBQESA-N 326.268 5.028 30 20 EKED C=C[C@H](CC(=O)Nc1c(CCC)cccc1C(C)C)c1ccccc1 472835457 XZJUCEAAZPHRFQ-GOSISDBHSA-N 335.491 6.061 30 20 EKED C=CCC[C@@H](NCc1cn(-c2ccccc2)nc1C(C)C)c1ccco1 513654173 HJUMQDHJGQJHQJ-HXUWFJFHSA-N 349.478 5.386 30 20 EKED Cc1sc(NC(=O)[C@H](CC(C)C)c2ccccc2)c(C#N)c1C 524818398 TUFWFMBINLOOSN-MRXNPFEDSA-N 326.465 5.005 30 20 EKED Cc1c(C#N)cccc1NC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 535465615 BTEXEVHKZWSGDK-NRFANRHFSA-N 347.462 5.359 30 20 EKED Cc1ccccc1Oc1ccccc1CNCc1ccc(C#N)s1 538410028 NFBRZMDSDNESNG-UHFFFAOYSA-N 334.444 5.010 30 20 EKED CCC[C@@H](NCc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 541324244 BURKRGPBOFEEDV-LJQANCHMSA-N 346.396 5.402 30 20 EKED N#CCc1ccc(CN[C@H]2CC3(CCCCC3)Oc3ccccc32)cc1 576279468 XDTOQHJASCDKJL-NRFANRHFSA-N 346.474 5.069 30 20 EKED CC(C)CN(C(=O)CCCCCC#N)[C@H](C)c1ccccc1Cl 588990304 PNYFCAITGUEOTF-MRXNPFEDSA-N 334.891 5.360 30 20 EKED N#CC1(c2ccc(-c3ccccc3CC(F)(F)F)cc2)CCOCC1 598929507 HSRRYUMFOVPNNJ-UHFFFAOYSA-N 345.364 5.030 30 20 EKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2ccccc2F)n1 603748185 DMNBPQCOTQBNFK-SNVBAGLBSA-N 340.345 5.273 30 20 EKED C=CCCCCCN(C)C(=O)Nc1c(C(C)C)cccc1C(C)C 606934060 WPGOBUDXMVSBJK-UHFFFAOYSA-N 330.516 6.144 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1cccc(-c2ccccc2)c1 610812784 QVQYQFJMBDFYPN-INIZCTEOSA-N 330.406 5.215 30 20 EKED C=CCC[C@@H](N[C@@H](C)c1cnc(OC)c(Cl)c1)c1ccccc1 671298257 LMLNIIMMVASBLU-KBXCAEBGSA-N 330.859 5.102 30 20 EKED C=CCOc1ccc(C(=O)Nc2cc(C(F)F)ccc2Cl)cc1 676108928 YEYNGKSRGCULCD-UHFFFAOYSA-N 337.753 5.095 30 20 EKED Cc1ccc(-c2nc(/C=C/C(=O)c3sccc3C)cs2)cc1 733749740 WOMHOHZJOLIVFW-BQYQJAHWSA-N 325.458 5.385 30 20 EKED CC(C)=C(C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 751378942 YWEKBQMXIQVPTE-UHFFFAOYSA-N 342.386 5.006 30 20 EKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC2CCC2)c2ccccc2)c1 776165060 NVCGIJBALRLOKZ-FYYLOGMGSA-N 348.490 5.389 30 20 EKED CCc1cccc(Cl)c1C=NNCc1ccc(C(F)(F)F)cc1 788712442 UYBZHJNSPHXCBB-UHFFFAOYSA-N 340.776 5.045 30 20 EKED CCN(C(=O)c1cc(C#N)ccc1Cl)c1ccc2ccccc2c1 795854812 GYQFKBQADAOUJU-UHFFFAOYSA-N 334.806 5.032 30 20 EKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccccc1Cl 796967320 DHQPTWSOLCHIHF-KTKRTIGZSA-N 343.810 5.499 30 20 EKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1O 806142803 QXPPZHSWPJTRNA-APPDUMDISA-N 349.261 5.373 30 20 EKED CCCC[C@@](C)(F)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 850762863 PRHFJDOFPUTXNH-HNAYVOBHSA-N 344.455 5.213 30 20 EKED CCCOc1ccc(/C=C\C(=O)c2ccccc2Cl)cc1OC 916135166 CBRQEOSDHFPVGK-NTMALXAHSA-N 330.811 5.034 30 20 EKED CCn1cc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)cn1 60108476 KCGWVQAEWCGZCX-VQHVLOKHSA-N 342.851 5.181 30 20 EKED CCO[C@H](C)c1nc(CS[C@@H](C)c2ccc(C#N)cc2)cs1 76861215 KNAAIVCBDHFLQW-OLZOCXBDSA-N 332.494 5.107 30 20 EKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc(C#N)cs1 177025467 KKLCAHAHIQOYSW-UHFFFAOYSA-N 330.478 5.071 30 20 EKED Cc1c(F)cccc1-c1ccc(CN[C@@H](C)c2cccc(C#N)c2)o1 237574622 ICSCZIODNMUFIT-HNNXBMFYSA-N 334.394 5.117 30 20 EKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1c[nH]c2ccccc12 302960703 QCGAOSNHDMHTCL-MDZDMXLPSA-N 348.402 5.327 30 20 EKED C=CCN(C(=O)CC1=CCCCC1)c1nc(-c2ccccc2)cs1 303341309 WEBABFJTQPJTQK-UHFFFAOYSA-N 338.476 5.220 30 20 EKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CC1CCCCC1 303525634 FZOSQDSYLBXWHM-HZPDHXFCSA-N 344.524 5.483 30 20 EKED CC1(/N=C(/O)[C@H]2CC[C@H](/C(O)=N\C3(C)CCCC3)CC2)CCCC1 329417816 DMLBGULTJCIAOT-WKILWMFISA-N 334.504 5.371 30 20 EKED C/N=C(/O)C[C@H](/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1 330129775 OONDLLYWKJFZAT-AITUJVMLSA-N 342.483 5.267 30 20 EKED CC(C)(C)[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 440209662 ASKBWKKIMWRRCS-UXHICEINSA-N 349.478 5.118 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccccc1C 476123668 WPJKUNXPZGRRBW-SFHVURJKSA-N 335.491 5.979 30 20 EKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)s1 480809586 CWILVVIXDWGXBK-CQSZACIVSA-N 336.435 5.277 30 20 EKED Cc1ccnc(Oc2cc(NCc3cc(C#N)ccc3F)ccc2C)c1 487376558 NFUUUGKXYVCLGK-UHFFFAOYSA-N 347.393 5.114 30 20 EKED COc1ccc([C@@H](Nc2cccc(OCCCC#N)c2)C(C)C)cc1 514623526 OHDNCTALLOSDBQ-NRFANRHFSA-N 338.451 5.187 30 20 EKED Cc1ccc(-c2nc(C)c([C@H](C)NCC(C)(C)CCC#N)s2)cc1 515343989 OAEWWKPYYAREME-HNNXBMFYSA-N 341.524 5.408 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1c(C)n[nH]c1C 522051758 OHYLKIBQDKSXNG-CQSZACIVSA-N 339.483 5.011 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 537408059 UKAPZCXLCACXST-CABCVRRESA-N 342.483 5.610 30 20 EKED Cc1nc(-c2ccc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 540597421 NSJQKAMWUFVISQ-GJZGRUSLSA-N 347.487 5.402 30 20 EKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCC(C)(C)CCC#N 554066349 GLIKFPLHNGENJA-OAHLLOKOSA-N 341.524 5.023 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccccc2)C2CCC2)c(C(F)(F)F)c1 573651939 QWQYJQOQDXEYJF-IBGZPJMESA-N 344.380 5.208 30 20 EKED CSCc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 577250363 WJPDTTXYZRIQPZ-UHFFFAOYSA-N 336.382 5.052 30 20 EKED Cc1cc(Cl)cc2cc(-c3noc(CCCCCC#N)n3)oc12 589150435 APSFUKTXNJQMKJ-UHFFFAOYSA-N 329.787 5.071 30 20 EKED N#Cc1ccc(N2CCC[C@@H]2c2ccc(F)c(C(F)(F)F)c2)cc1 600852320 KAQGQQKEUCEEPF-QGZVFWFLSA-N 334.316 5.058 30 20 EKED COc1cc(CS[C@H](C)c2ccc(C#N)cc2)ccc1SC 609825512 CCVDXRLLBCGSBC-CYBMUJFWSA-N 329.490 5.283 30 20 EKED CCC(C)(C)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 619594612 PPPJNQNZSNDUEV-MRXNPFEDSA-N 349.478 5.116 30 20 EKED C#CC(C)(C)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 733978488 CGNUNAAHBUHYGU-UHFFFAOYSA-N 346.666 5.003 30 20 EKED Oc1ccc(Cl)cc1C=Nc1cccc(C2SCCS2)c1 743334063 JLBFSMADHABCSV-UHFFFAOYSA-N 335.881 5.275 30 20 EKED CCC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 757306217 PWYNQLTVIAHBOT-LBPRGKRZSA-N 332.856 5.096 30 20 EKED CCCC(=CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)CCC 771260655 JJEAYRBVBFNJLS-IBGZPJMESA-N 348.446 5.014 30 20 EKED O=C(/C=C\c1scnc1C1CC1)c1nc(-c2ccccc2)cs1 782324624 FPXFGTYKJBSGTB-HJWRWDBZSA-N 338.457 5.040 30 20 EKED CCc1cnc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)s1 783707555 QXRCYXVAXGZEQF-KTKRTIGZSA-N 340.473 5.034 30 20 EKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1 792103597 LJLIZOQKWKNMPZ-LEWJYISDSA-N 342.442 5.241 30 20 EKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(Cl)c1 794996140 SXPKWUICVLNNAZ-UHFFFAOYSA-N 330.884 5.115 30 20 EKED O=C(/C=C/c1csc(Br)c1)c1c(F)cccc1Cl 809158956 GEPBYNSQYAYABH-SNAWJCMRSA-N 345.620 5.199 30 20 EKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 25438222 QCBFGUHWRTYUKA-UHFFFAOYSA-N 333.218 5.047 30 20 EKED C=CCC[C@H](C(=O)Nc1cc(C(C)=O)ccc1Cl)c1ccccc1 188593852 RAMNVSHJLGEIQS-KRWDZBQOSA-N 341.838 5.231 30 20 EKED CC[C@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccc(C#N)cc1 278804225 RMEJGWNHRJWGIL-IBGZPJMESA-N 349.478 5.415 30 20 EKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/[C@@H]2CC23CCCCC3)CC1 329910551 VWXMKHDDVBXINF-UYSNPLJNSA-N 334.504 5.227 30 20 EKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2cccc(CC#N)c2)cc1 455917892 KGBJUDUTHTZZAC-UWJYYQICSA-N 347.462 5.066 30 20 EKED C=C(C)[C@@H](NCc1csc(C(C)(C)C)n1)c1ccc(F)c(F)c1 479404086 CGWCYTVUDCAKQO-MRXNPFEDSA-N 336.451 5.126 30 20 EKED C=CCC[C@@H](C(=O)Nc1ccc(-c2cnco2)cc1)c1ccccc1 488680660 BOSHCSNEYBOSDQ-LJQANCHMSA-N 332.403 5.030 30 20 EKED CC(C)(CCC#N)CNC(=O)N1CCC[C@@H]1c1cccc2ccccc12 513129741 MQQVABLMUMXBKE-HXUWFJFHSA-N 349.478 5.016 30 20 EKED C=CCN(Cc1ccccc1)C(=O)CCCCCc1cccs1 521842573 LJERPEWJQUEGHE-UHFFFAOYSA-N 327.493 5.066 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cc(C)cc(C)c1 530560206 ZAZILFITTGQJBZ-UHFFFAOYSA-N 337.463 5.173 30 20 EKED Cc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 531070844 LIBYJGYWHLBPBH-ZDUSSCGKSA-N 346.352 5.018 30 20 EKED C[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 535654417 FFLGMJCHLIBPAR-CVEARBPZSA-N 349.434 5.003 30 20 EKED CC(C)(C#N)CCSCc1nc(-c2c(F)cccc2F)cs1 572877866 FRHPFBPROPKRCA-UHFFFAOYSA-N 338.448 5.261 30 20 EKED COc1ccc(-c2ccc(C)c(N[C@H](C)c3cccc(C#N)c3)c2)cn1 600853628 LQCCZEABVYVFSJ-MRXNPFEDSA-N 343.430 5.110 30 20 EKED N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc(C2CC2)cs1 647379649 ATQQSTZCCYMXNG-KRWDZBQOSA-N 334.444 5.078 30 20 EKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(C(F)(F)F)cc1Cl 666044227 NXKQKTUYVFYICM-TXEJJXNPSA-N 344.764 5.074 30 20 EKED C#CCCOc1ccc(CN[C@H](CC(C)C)c2cccs2)cc1 733325560 QYTHLHUEZXPNBE-LJQANCHMSA-N 327.493 5.027 30 20 EKED CC(C)[C@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)CC1 753551501 XWKKMKBEFPJSKW-UMVBOHGHSA-N 344.455 5.074 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(Cl)c(C(F)(F)F)c1 754690368 SJTKUSFFYDEUQI-GQCTYLIASA-N 346.135 5.303 30 20 EKED COc1ccc(NN=CC2CCC(C(F)(F)F)CC2)cc1Cl 767392889 ARAUCVXBGFVCHZ-UHFFFAOYSA-N 334.769 5.115 30 20 EKED FC(F)(F)c1ccccc1ON=Cc1ccc(Oc2ccccc2)o1 779785474 VYANIUDRPJFDRP-UHFFFAOYSA-N 347.292 5.504 30 20 EKED FC(F)Sc1ccc(C=NOc2ccccc2C(F)(F)F)cc1 781597717 XBHXMNBYDRLCFK-UHFFFAOYSA-N 347.308 5.433 30 20 EKED C#CCN(C(=O)Nc1c(CCC)cccc1C(C)C)C1CCCC1 810211900 JEFHKWDZFVRNBJ-UHFFFAOYSA-N 326.484 5.172 30 20 EKED C#Cc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1 819402051 UBBCCPWPKJHXQX-UHFFFAOYSA-N 349.480 5.274 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cscc1C(F)F 890165847 OTFCVBIWYDXXDD-UHFFFAOYSA-N 335.419 5.790 30 20 EKED C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 915304302 XNZQEIDFTCWZDY-INIZCTEOSA-N 341.414 5.108 30 20 EKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3ccncc3)ccc21 916136172 IRGKXFDNDDWKOY-CSKARUKUSA-N 326.399 5.106 30 20 EKED CCCCCCCCCC(=O)N1CC=C(c2ccc(O)cc2)CC1 916733345 GHRGPUNIWXCGGX-UHFFFAOYSA-N 329.484 5.149 30 20 EKED O=C(/C=C\c1ccc(C(=O)O)s1)c1ccc(-c2ccccc2)cc1 1776131311 OAPLPBKOJSODTQ-BENRWUELSA-N 334.396 5.009 30 20 EKED C[C@H]1Cc2ccccc2C(=O)/C1=C\c1csc2ccc(C(=O)O)cc12 1776666065 WHEMUCBTMZVQEM-NJPLLEPOSA-N 348.423 5.058 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)nc1Cl 289496200 SZUIUSCVKDFTQE-UHFFFAOYSA-N 342.870 5.077 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1cccc(Cl)c1 303196194 YAXQTAKKQMRHOC-MDZDMXLPSA-N 325.820 5.360 30 20 EKED C[C@@H]1Sc2ccc(/C(O)=N/[C@@H]3C[C@H]3C3CCCCC3)cc2N=C1O 329892020 IRNLBZWADDFMTM-TUKIKUTGSA-N 344.480 5.042 30 20 EKED CCc1ccc(CC)c(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c1 330016512 PQVZVULGDVBZHN-UHFFFAOYSA-N 342.483 5.325 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccc(C#N)cc2Cl)cc1 439445374 CMMOPZRRDIIRPN-CYBMUJFWSA-N 330.884 5.174 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 446827415 OAWZJKSOBAYDDJ-XFKAJCMBSA-N 336.401 5.013 30 20 EKED COc1cc2ccccc2cc1CN[C@@H](CCCC#N)c1ccccc1 449338668 GZWKJLGIQAIBHF-QFIPXVFZSA-N 344.458 5.373 30 20 EKED C=C(C)[C@H](N[C@H](C)c1nc2c(s1)CCCC2)c1ccc(F)c(F)c1 480679731 JNIPTYBNIBPCRJ-XIKOKIGWSA-N 348.462 5.268 30 20 EKED Cc1ccc(C)c(N(C(=O)c2ccc(C(C)(C)C#N)cc2)C(C)C)c1 483457778 AZMDEKRXCNTZAT-UHFFFAOYSA-N 334.463 5.160 30 20 EKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(C)(C)C)cc1 514511442 MFIRSMFYYDELPL-UHFFFAOYSA-N 328.481 5.266 30 20 EKED Cc1ccnc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 519559032 KVBUQAFNMXLTIH-ROUUACIJSA-N 341.458 5.341 30 20 EKED C[C@H](c1cccs1)N(Cc1ccccc1)Cc1ccc(C#N)cc1 519905063 QMFKTQHEZZGSBY-QGZVFWFLSA-N 332.472 5.383 30 20 EKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)c(F)c1 537400192 NIOWIUKONFPHQS-BUXKBTBVSA-N 328.818 5.153 30 20 EKED C[C@H]1CCCCN1Cc1ccc(N[C@H]2CCc3ccc(C#N)cc32)cc1 571333805 KPJKFDXPGIINKR-SBUREZEXSA-N 345.490 5.032 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(C2CC2)cc1)c1ccccc1 590824812 HHDAFNQVDKJMNW-FQEVSTJZSA-N 333.435 5.121 30 20 EKED C=CCN(C(=O)[C@@H](C)c1ccccc1C(F)(F)F)c1ccccc1 607780720 JBRPQNUUTABBLU-AWEZNQCLSA-N 333.353 5.028 30 20 EKED COc1ccc([C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 611438519 AHEUIQSXYYUUCS-GAJHUEQPSA-N 342.442 5.007 30 20 EKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C)c(C)c3)n2)cc1 612894748 OPYWRGBQEVTHGU-SFHVURJKSA-N 346.455 5.225 30 20 EKED CC(C)(C#N)c1ccc(CNc2cccc(OCC(F)(F)F)c2)cc1 614057216 VJOSQPRXIDDLQB-UHFFFAOYSA-N 348.368 5.041 30 20 EKED C=CCN(C(=O)Nc1cc(Cl)ccc1SC(C)C)C(C)C 729575538 IZVPAGFEICAIIH-UHFFFAOYSA-N 326.893 5.269 30 20 EKED C#Cc1cccc(NC(=O)Nc2cccc(CSC(C)C)c2C)c1 743084962 TVOOFEPEVYKQFI-UHFFFAOYSA-N 338.476 5.262 30 20 EKED O=C1/C(=C/c2ccc(Cl)nc2)CCSc2ccc(Cl)cc21 749005511 KVXSDCDTBLJMLW-YRNVUSSQSA-N 336.243 5.151 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(Cl)c(F)c2)c1 765612348 GMVWZZHFKPWWAI-TWGQIWQCSA-N 343.785 5.058 30 20 EKED O=C(/C=C\c1cc(Cl)cs1)c1sccc1Br 782331741 XNGGJGHWTSWACA-UPHRSURJSA-N 333.659 5.122 30 20 EKED C[C@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792101815 HCVNTSQTAFDVTI-DYESRHJHSA-N 342.442 5.070 30 20 EKED N#C[C@@H](C(=O)/C(F)=C\C1CCCCC1)c1nc2cc(F)ccc2s1 815941693 KVMBISYJCSRXFO-JGWKKKPCSA-N 346.402 5.045 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccccc1O 879353270 GERGQWSGUXBPSE-HNNXBMFYSA-N 338.451 5.127 30 20 EKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccccc2F)cc1OC 916545881 ZLSYZQOURCYCKO-CMDGGOBGSA-N 348.801 5.173 30 20 EKED N#Cc1ccc(-c2csc(-c3cc(Br)cs3)n2)cc1 70213211 QUPGDCLNVRRGKA-UHFFFAOYSA-N 347.262 5.173 30 20 EKED CC(C)(CCC#N)CNc1cccc(C[S@](=O)C2CCCCC2)c1 133275803 ZGTCBGDSONKMAH-XMMPIXPASA-N 346.540 5.010 30 20 EKED Cc1cccc([C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 151866675 VLNIWYHEKCNTNH-CVEARBPZSA-N 338.476 5.132 30 20 EKED Cc1cccc(C)c1NC(=O)CCCSCCCC(C)(C)C#N 161056286 KHXPJQYCHMAGQE-UHFFFAOYSA-N 332.513 5.085 30 20 EKED C[C@@H](CC#N)Sc1ccccc1N=Cc1cc2ccccc2nc1O 255647418 FRLXJOKHRVZSMP-AWEZNQCLSA-N 347.443 5.085 30 20 EKED Cc1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)ccc1C1CC1 360821933 NQWNZFXIVZOHQY-HXUWFJFHSA-N 333.435 5.039 30 20 EKED C=CCC1(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCC1 410460844 YGNVNDJNSISLEY-HNNXBMFYSA-N 328.481 5.013 30 20 EKED N#CCCC[C@H](NCCCc1ccc(Cl)cc1)c1ccccc1 433023130 ZISYRLDSHLQHNT-FQEVSTJZSA-N 326.871 5.297 30 20 EKED C[C@H](N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1(C)CC1 438694802 QLIICDQTEZILCJ-HNNXBMFYSA-N 349.434 5.003 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(Cl)c1F 447590817 AUCLLMLXYHYZRV-UHFFFAOYSA-N 345.845 5.892 30 20 EKED C=CCCc1ccccc1NC(=O)c1c(C)cccc1Br 464500799 XEKFZOZHEMZFFO-UHFFFAOYSA-N 344.252 5.128 30 20 EKED C=C(C)C[C@H](C)C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F 466426944 UKFPRICSSIHUQR-SMDDNHRTSA-N 333.781 5.004 30 20 EKED C=CCCN(C)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 466551684 QHOUBUCBYXESPJ-MRXNPFEDSA-N 340.492 5.580 30 20 EKED C[C@@H]1CC(C)(C)N(C(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc21 479273483 DIZXJDQRIHFMTA-MRXNPFEDSA-N 344.458 5.174 30 20 EKED CC(C)N(CCCCC#N)Cc1ccc(-c2ccccc2F)s1 524370320 DNQZQJPNAUGDNQ-UHFFFAOYSA-N 330.472 5.458 30 20 EKED C=C[C@@H](CC(=O)N1CCC[C@H](c2ccccc2)CC1)c1ccccc1 535340025 MAHHRHRGWNNLDI-UGKGYDQZSA-N 333.475 5.143 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)s1 540604546 XNRQYMYBUUGPSG-GOSISDBHSA-N 330.884 5.294 30 20 EKED N#CCc1ccccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 550099900 CEXKSSHBLGUWAV-UHFFFAOYSA-N 346.817 5.325 30 20 EKED CC[C@](C)(C#N)C(=O)Nc1ccc(SC2CCCCC2)cc1C 578734653 LLMSQLIXWZNVAT-LJQANCHMSA-N 330.497 5.298 30 20 EKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2ccccc2Cl)o1 618742733 QSTAFYSOZFRCLI-HXUWFJFHSA-N 348.833 5.249 30 20 EKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(F)c(Cl)cc1Cl 618801420 AUUZEYDVTVLJOU-MLCYQJTMSA-N 349.236 5.342 30 20 EKED CCc1cccc(NC(=S)Nc2ccccc2SCCC#N)c1 730953120 OKUAWLKDFMXLNK-UHFFFAOYSA-N 341.505 5.064 30 20 EKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1ccccc1F 735232801 CJOAPPOTQPIDAA-GFCCVEGCSA-N 335.831 5.376 30 20 EKED CCOc1cccc2cc(C(=O)/C=C\c3nccc4ccccc34)oc12 740764621 ADTVEFQPAHKMQD-KHPPLWFESA-N 343.382 5.276 30 20 EKED CCCCCCCC(=O)Nc1ccccc1OCc1cscn1 749549046 FBLUZTYVQQSHOO-UHFFFAOYSA-N 332.469 5.021 30 20 EKED C#Cc1cccc(NC(=S)N(CC(C)C)c2ccc(Cl)cc2)c1 761824593 NDEYVPUWKQVWSL-UHFFFAOYSA-N 342.895 5.181 30 20 EKED Cc1cc(NCc2cccc(OCCCC#N)c2)ccc1OC(C)C 770593340 QAQRQRYGRYDWPV-UHFFFAOYSA-N 338.451 5.077 30 20 EKED C#CC[C@H](N[C@H](C)c1cc2cccc(OCC)c2o1)c1ccccc1 776170262 IZFVBUXJULXWAU-APWZRJJASA-N 333.431 5.247 30 20 EKED C#CC[C@H](N[C@H](c1cccc(OC(C)C)c1)C(F)F)c1ccccc1 788684386 CVYCUKHMAVAVLC-VQTJNVASSA-N 343.417 5.134 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1O 815597743 FEFVAGARSPHOHT-CXAGYDPISA-N 348.368 5.107 30 20 EKED C=C(Cl)CSCc1csc(COc2ccc(C)cc2)n1 917953318 YYXWXMJGUDCBEZ-UHFFFAOYSA-N 325.886 5.016 30 20 EKED Cc1c(NN=C2CCC[C@@H](C3CCCCC3)C2)cccc1C(=O)O 1776090038 RKBZTBNWTCRCOY-MRXNPFEDSA-N 328.456 5.232 30 20 EKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776699965 KYXMFWVPGBSKMQ-TYBABMIJSA-N 348.851 5.509 30 20 EKED CCCCc1ccc(CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 29151020 WPVXUAAUDGCUQE-UHFFFAOYSA-N 334.463 5.012 30 20 EKED C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(OCC#N)cc1 192938867 YPPOXQFKBMRHTG-STQMWFEESA-N 349.261 5.308 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)cc1 192985544 DWLBDGXVAVEDBK-LIRRHRJNSA-N 328.843 5.044 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc([C@@H]2CCOC2)c1 276500326 WWPBTOQFXBGLFC-HXUWFJFHSA-N 349.474 5.295 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC(=O)c2ccccc21 284565461 FIKKOYCFLMSSNP-HXUWFJFHSA-N 347.458 5.237 30 20 EKED C=CCCCN(C)C(=O)Nc1ccc(-c2cccc(Cl)c2)cc1C 303861872 PCKZGCWCJUUQES-UHFFFAOYSA-N 342.870 5.745 30 20 EKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1nccc2ccccc12 340429716 CYITULBYJAWFLQ-UTKZUKDTSA-N 329.447 5.321 30 20 EKED N#CC[C@H](CC(=O)N[C@H](CC1CCC1)c1ccccc1)c1ccccc1 356650080 HPWJIMDUYBXYCL-FGZHOGPDSA-N 346.474 5.122 30 20 EKED N#Cc1ccc(NC(=O)c2ccccc2Cc2ccccc2)c(Cl)c1 430373434 UYNZJBWJWJVOLZ-UHFFFAOYSA-N 346.817 5.055 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2CC2)nc1C 451329320 JUSPXULDGKSUPD-UHFFFAOYSA-N 334.463 5.372 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCC[C@@H]1SCC 475559075 BSPYQMKWMSIUBY-ROUUACIJSA-N 346.540 5.334 30 20 EKED C[C@@H](SCCCC1(C#N)CCOCC1)c1cccc(Cl)c1F 512383426 YMVAFKCOGSFJHK-CYBMUJFWSA-N 341.879 5.374 30 20 EKED C[C@H](SCc1ncc(-c2cccs2)o1)c1ccc(C#N)cc1 522840557 RHIRQDYGNVXBMB-LBPRGKRZSA-N 326.446 5.269 30 20 EKED CC(C)c1ccc(-c2nc(CN3CCC(CC#N)CC3)cs2)cc1 542881613 SJVSGJJLVBUGMS-UHFFFAOYSA-N 339.508 5.059 30 20 EKED C=CCSc1ccccc1C(=O)N[C@@H]1CCc2sc(Cl)cc21 563488195 JKWZSFCYUPVAAL-CYBMUJFWSA-N 349.908 5.097 30 20 EKED CC(C)Sc1ccc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)cc1 582211090 VZYMURJDQMNHFY-QVKFZJNVSA-N 336.504 5.397 30 20 EKED C[C@H](Nc1ccc(NC(=O)[C@H](C)CC#N)cc1Cl)c1ccccc1 597132722 VBFHHFSWGLZWNK-KGLIPLIRSA-N 341.842 5.001 30 20 EKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(CCC(F)(F)F)cc1 611480973 PFQVQCDFEVODBN-LJQANCHMSA-N 344.380 5.543 30 20 EKED C[C@H](c1ccccc1)c1ccc(OCCCC2(C#N)CCOCC2)cc1 619622557 IEZFBDFZRHSFNH-LJQANCHMSA-N 349.474 5.318 30 20 EKED CCCC[C@H](CC)CNC(=S)Nc1ccccc1SCCC#N 730953353 VVKWKSOQICAJBR-HNNXBMFYSA-N 349.569 5.195 30 20 EKED C[C@H](CC1CCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733921919 YXYVEEILCIQOID-VGOFRKELSA-N 346.474 5.497 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc2c3c(cccc13)CC2 740765442 ZYKKQKIUQQOZST-OUKQBFOZSA-N 335.406 5.383 30 20 EKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1c[nH]c2cc(Cl)ccc12 742433098 OTDBGJBZYCANBL-VQHVLOKHSA-N 347.805 5.108 30 20 EKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2ccc(F)c(F)c2)ccc1OC 749453123 RDHVJVRGTLIFOL-QGOGUYACSA-N 346.373 5.047 30 20 EKED C=CC[C@H](N[C@@H](CC)c1ccccc1OC(F)F)c1ccncc1 766021920 VMGVOCBJEZKTQD-IRXDYDNUSA-N 332.394 5.041 30 20 EKED C=CC[C@@H](N[C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1 766022956 SZYCFFUQUNNPGH-PGRDOPGGSA-N 335.495 5.040 30 20 EKED Cc1ccccc1[C@@H](OC(=O)CCCCCC#N)c1cccs1 805872527 TXURTQMHGQZALO-LJQANCHMSA-N 327.449 5.163 30 20 EKED CC1(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 808979184 SZCKSMWSLSOIIU-GFCCVEGCSA-N 332.856 5.096 30 20 EKED C[C@H](CC1(C#N)CCOCC1)Nc1ccc(SC(C)(C)C)cc1 876857446 RMCQVFXLSPVHME-OAHLLOKOSA-N 332.513 5.088 30 20 EKED C=CCC[C@H](N[C@H]1CCC[C@@H](CCCC(=O)O)C1)c1ccccc1 902325813 MTMCTYNHMNBMNP-IHPCNDPISA-N 329.484 5.097 30 20 EKED CCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 915087329 SHTJEPCIMAVGIX-IBGZPJMESA-N 346.455 5.218 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCc2cccnc21 931061868 MOHSAZPHNDCIIU-IBGZPJMESA-N 349.478 5.133 30 20 EKED CC(C)C1CCC(/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CC1 330020346 WJQZPCRSKSWTRB-UHFFFAOYSA-N 334.504 5.083 30 20 EKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc(C#N)cs1)C1CC1 437549101 RQKIZRMVVFFPFT-AWEZNQCLSA-N 346.455 5.139 30 20 EKED CC[C@H]1CC[C@H](C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 473581904 JMUWPGRMSGALDT-BZUAXINKSA-N 330.497 5.093 30 20 EKED C[C@H](S[C@@H](C)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 476156910 QSFLAGVKBPDOQA-KBPBESRZSA-N 335.432 5.164 30 20 EKED C[C@@H](CCCc1ccccc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487486637 PNIVOMBZGUWGGU-SIKLNZKXSA-N 348.490 5.197 30 20 EKED CC(C)[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 497798868 IWCOSKGVKGTYOP-KDOFPFPSSA-N 340.854 5.226 30 20 EKED Cc1ccc(C#N)cc1NC(=O)c1cc(C)n(C2CCCCC2)c1C 531321416 NWUANXQVCXXGHW-UHFFFAOYSA-N 335.451 5.043 30 20 EKED C=C[C@H](CC(=O)N1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C)c1ccccc1 537692591 JKRNICNKYBWPTH-YESZJQIVSA-N 337.438 5.020 30 20 EKED CC(C)(CCC#N)CNC(=O)CC1(CCc2ccccc2)CCCC1 557440936 GOBGKYGDEYVCOR-UHFFFAOYSA-N 340.511 5.016 30 20 EKED CC(C)Oc1cccc([C@@H](N[C@H](C)c2cccc(C#N)c2)C(F)F)c1 585725926 FMORWLQLECFYBN-AUUYWEPGSA-N 344.405 5.002 30 20 EKED N#CCCCCCC(=O)Nc1ccc(Cl)cc1Nc1ccccc1 589852778 QZLNSXWOCVPBBZ-UHFFFAOYSA-N 341.842 5.496 30 20 EKED N#CCCCCC(=O)Nc1ccc(CSc2ccc(F)cc2)cc1 594047372 GHTYRYUCRGUWEW-UHFFFAOYSA-N 342.439 5.140 30 20 EKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccc(C#N)c(Cl)c2)c1 604500829 LLTUTTLZWNUDCD-CQSZACIVSA-N 341.842 5.053 30 20 EKED C[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1F 612204212 OLNYTHSZIFXTHW-CQSZACIVSA-N 336.435 5.277 30 20 EKED CC(=NNc1cnnc2ccccc12)c1ccc(-c2ccccc2)s1 733747990 AQBHCJAGWMXROH-UHFFFAOYSA-N 344.443 5.194 30 20 EKED C=CCN(C(=O)Nc1ccccc1O[C@H](C)c1ccccc1)C(C)C 734655233 DHIPDVBXEORZHE-QGZVFWFLSA-N 338.451 5.255 30 20 EKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1cncc(F)c1 737417031 WNARGQSEAKMOGP-UHFFFAOYSA-N 332.593 5.017 30 20 EKED C=CC[C@H](N[C@@H](C)c1ccc(OC)c2ccccc12)c1ccncc1 766022564 XDJPHWHFJGPXFC-KKSFZXQISA-N 332.447 5.211 30 20 EKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1c[nH]c2ccccc12 770574141 WIANKYHGKATKDU-KHPPLWFESA-N 330.412 5.188 30 20 EKED C#CC[C@H](N[C@@H](C)c1oc2ccc(OC)cc2c1C)c1ccccc1 773116344 RIORVXIUZWSBBQ-JXFKEZNVSA-N 333.431 5.165 30 20 EKED N#Cc1cc(Cl)ccc1CSc1nnc(-c2ccccc2)s1 775202708 VNJKHAFXTGMUFU-UHFFFAOYSA-N 343.864 5.022 30 20 EKED O=C1/C(=C/c2cnc(-c3ccco3)s2)[C@@H]2CCCc3cccc1c32 789143689 QFZARKTYQQVWSR-KNGSKEOJSA-N 333.412 5.103 30 20 EKED C[C@@H](C=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)CCC#N 814948751 DCYVQKKMWNCXQQ-SECBINFHSA-N 337.267 5.062 30 20 EKED C=CCN(C(=O)Nc1ccccc1SCc1ccccc1)C(C)C 916707548 SNQUAVSFCYPKHR-UHFFFAOYSA-N 340.492 5.407 30 20 EKED C[C@@H](CC(C)(C)C#N)Nc1cccc(C[S@](=O)C2CCCCC2)c1 926091815 OSHNPYHMTBHWCE-FYSMJZIKSA-N 346.540 5.008 30 20 EKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc2ccccc2c1F 1776784725 NNEFYBKSQMDKJS-SFHVURJKSA-N 345.458 5.272 30 20 EKED Cc1ccc(SCC(=O)c2cn(CCC#N)c3ccccc23)c(C)c1 6533124 APCKAJPUQCKHSI-UHFFFAOYSA-N 348.471 5.147 30 20 EKED Cc1ccc(-c2ccsc2C(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 33179642 PKZVSAIUYPIQET-HNNXBMFYSA-N 346.455 5.086 30 20 EKED C=CCC[C@H](N[C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1 90580681 NYVYCLWSGNGDHK-UZLBHIALSA-N 348.490 5.274 30 20 EKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(OCC#N)cc3)c2)oc1C 183020187 YXCXTCVLFDZPMX-OAHLLOKOSA-N 347.418 5.034 30 20 EKED COc1cccc(-c2nc(/C=C/C(=O)c3cccc(C)c3)cs2)c1 301578247 BXFQTXKWDFRXJF-MDZDMXLPSA-N 335.428 5.023 30 20 EKED C=CCCCN(C)C(=O)Nc1cccc(CO[C@@H]2CCC[C@H](C)C2)c1 303840279 LYHUGEYAPAQYME-FXAWDEMLSA-N 344.499 5.212 30 20 EKED Cc1nc(C2CC2)oc1/C(O)=N/[C@H](c1ccccc1F)C1CCCC1 329510693 KESCNNKFMSKNSW-KRWDZBQOSA-N 342.414 5.236 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(C#N)cc1 471874941 HZCJJXFOWCCFRD-MRXNPFEDSA-N 349.478 5.517 30 20 EKED CC(C)c1ccc([C@@H](NCCCC2(C#N)CCOCC2)C(C)C)cc1 499597794 BEXMTDNDXGGJHK-NRFANRHFSA-N 342.527 5.197 30 20 EKED COc1ccccc1-c1ccc([C@H](C)N(C)Cc2ccc(C#N)o2)cc1 536679283 ZOATZQAWEPNQCW-INIZCTEOSA-N 346.430 5.020 30 20 EKED C[C@@H](NCc1ccc(OC2CCCCC2)cc1)c1ccc(C#N)cc1 538395209 GTZBHMJFINODPX-QGZVFWFLSA-N 334.463 5.121 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCCCC(C)(C)C#N)cc1 539359667 YIGFZBWHIGGFNE-QGZVFWFLSA-N 336.479 5.343 30 20 EKED C=CCCC[C@@H](C)NC(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549372747 QRDKFFUFVYAINV-OAHLLOKOSA-N 341.430 5.062 30 20 EKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 571786623 VHYOIVDZYUVMAQ-UHFFFAOYSA-N 343.386 5.019 30 20 EKED CC(C)Oc1cccc([C@H](N[C@H](C)c2ccc(C#N)cc2)C(F)F)c1 577395589 MBDJHPYECIMAOA-KUHUBIRLSA-N 344.405 5.002 30 20 EKED Cc1cc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)sc1Br 586778355 ZYXVJUWMRMXYQN-RYUDHWBXSA-N 349.297 5.103 30 20 EKED N#Cc1ccccc1NC(=O)c1ccc(SCc2ccccc2)cc1 609092287 HFSZSJCBKKDCCN-UHFFFAOYSA-N 344.439 5.103 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1OCc2ccccc21 653760290 PVWYEAALTBXRKO-FQEVSTJZSA-N 335.447 5.139 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCc2ccccc21 682803866 WDGAFIWQKYEKSE-IBGZPJMESA-N 333.475 5.597 30 20 EKED C#Cc1cccc(NC(=S)N[C@H](C)c2cccc(Cl)c2Cl)c1 735422792 CQDIXYPLSWBRJS-LLVKDONJSA-N 349.286 5.022 30 20 EKED CC[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(C)cc1 739142841 LGMPBVSFBSQZHD-PXNSSMCTSA-N 342.442 5.303 30 20 EKED O=C(/C=C/c1ccc2cnccc2c1)c1cccc(Cl)c1Cl 782326731 PWPLTNZLUGAYTK-FNORWQNLSA-N 328.198 5.438 30 20 EKED CC[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 784834112 URYIEFWKQMDXKC-ZIAGYGMSSA-N 347.409 5.214 30 20 EKED Cc1cc(NC(=O)NCC(C)(C)CCC#N)ccc1-c1ccccc1 806421234 ZMENDFPJHWSIED-UHFFFAOYSA-N 335.451 5.114 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1O 815636621 XZAGJJNQYDNDCS-RTBURBONSA-N 342.870 5.521 30 20 EKED C=CCC[C@@H](NCc1cn(C2CC2)cn1)c1ccc(C(F)(F)F)cc1 865509083 ONFQJAIJKNALHN-GOSISDBHSA-N 349.400 5.034 30 20 EKED CC(C)CN(CCC#N)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 920446426 XCRNQOMXVLGBTI-UHFFFAOYSA-N 346.883 5.080 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1sccc1C 189884350 HTSNQEVUSUZQLE-MSOLQXFVSA-N 339.504 5.651 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1cccc(OC)c1 189894359 LAZSVANCTHYRLZ-NHCUHLMSSA-N 349.474 5.289 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1cccnc1 191470965 SMVSFLBGEVGDIC-MRXNPFEDSA-N 337.467 5.158 30 20 EKED C=CC[C@@H](C(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccccc1 427529439 WIFXGZFFDRFGNZ-CRAIPNDOSA-N 337.467 5.030 30 20 EKED N#CCCC[C@@H](NCc1ncc(-c2ccccc2F)o1)c1ccccc1 433032395 LVTPBOBWZBRZMT-LJQANCHMSA-N 349.409 5.005 30 20 EKED C=CCC[C@@H](NC(=O)N(C)Cc1ccc(Cl)s1)c1ccccc1 435103947 CSSOYIDBBUFBJK-MRXNPFEDSA-N 348.899 5.250 30 20 EKED Cc1oc(C#N)cc1C(=O)N(c1ccc2[nH]ccc2c1)[C@H](C)CC(C)C 439089935 JXQHVVXYWDFRJC-CQSZACIVSA-N 349.434 5.022 30 20 EKED C=C[C@@](C)(CC)C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 467979772 MGTRZDGMOLOLSO-SFHVURJKSA-N 339.401 5.014 30 20 EKED N#Cc1csc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 471452031 PVYFBPIBQKJZCH-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=C[C@@H](CC(=O)Nc1cccnc1-c1csc(C)c1)c1ccccc1 474328919 PRKWNYFLGYFQLS-INIZCTEOSA-N 348.471 5.417 30 20 EKED C[C@@H](NC(=O)Nc1ccccc1-c1cccs1)c1ccc(C#N)cc1 505319400 RBXNERBKZFOFGZ-CQSZACIVSA-N 347.443 5.169 30 20 EKED CCCc1cc(C(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)sc1C 509597379 AHGCAQUYTUUWEL-CQSZACIVSA-N 340.492 5.104 30 20 EKED C[C@H](N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc(C#N)cc1F 512630892 ORXHWCHAEHPHKT-NYHFZMIOSA-N 348.396 5.277 30 20 EKED C=CCN(C(=O)c1cccc2ccccc12)c1nc2c(s1)CCCC2 514596589 IOUBAVRDBWPYQR-UHFFFAOYSA-N 348.471 5.008 30 20 EKED COc1ccccc1-c1ccc([C@@H](C)NCc2cc(C#N)cs2)cc1 530879472 PYIUDENBPZKIGK-OAHLLOKOSA-N 348.471 5.146 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc2ncccc2c1 546729179 MGAIEAFQWKJHFY-HNNXBMFYSA-N 333.460 5.241 30 20 EKED CSc1ccccc1C[C@@H](C)N[C@H](CCCC#N)c1ccccc1 556202896 UDUJAVZVQGHTJJ-YLJYHZDGSA-N 338.520 5.364 30 20 EKED C[C@H]1CCC[C@@H](C)N(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 610184750 HVEMZRAHUZAXCY-DLBZAZTESA-N 348.446 5.001 30 20 EKED CCCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@H](C)c1ccccc1 610356036 HWXTWBAZWHAUDL-ZWKOTPCHSA-N 349.478 5.192 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccc(C)cc2C1 666866493 RLIBGZDTUTYLCH-UHFFFAOYSA-N 348.490 5.437 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)CNc1ccccc1Cl 682822773 SDROXYRNEVWZMV-UHFFFAOYSA-N 342.870 5.243 30 20 EKED C[C@@H](SCc1c(F)c(F)c(F)c(F)c1F)c1ccc(C#N)cc1 735676377 WTHYEGSGWBSFNO-MRVPVSSYSA-N 343.320 5.248 30 20 EKED COc1ccc2c(c1)C(=O)/C(=C\c1nc(-c3ccccc3)cs1)CC2 741848168 MOUIJXNDBBAXSO-WJDWOHSUSA-N 347.439 5.031 30 20 EKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744037839 FJBJJGKPZQUHQW-ZIAGYGMSSA-N 347.409 5.214 30 20 EKED Cc1cccc(C)c1NC(=S)N(CC(C)C)c1ccc(C#N)cc1 745689279 WQNGAESBEYLRBY-UHFFFAOYSA-N 337.492 5.035 30 20 EKED CCCCCCOc1cccc(CN[C@@H](C)c2ccc(C#N)cc2)c1 747094195 FBKVRBXSVFEXTL-SFHVURJKSA-N 336.479 5.368 30 20 EKED C=CCNC(=S)Nc1ccc([C@H](C)Sc2ccccc2)cc1 752238966 CLKSQFXMYNPGDH-AWEZNQCLSA-N 328.506 5.012 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccsc2)cc1 790302176 HXXNTXFIEZOJBB-SFHVURJKSA-N 349.484 5.212 30 20 EKED CC(C)[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1cnc2ccccc2n1 792102498 FJOOMJXVVCTBQJ-QZTJIDSGSA-N 349.478 5.049 30 20 EKED CCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 796651007 NXMYBKHNIIMJNH-SJKOYZFVSA-N 334.872 5.342 30 20 EKED Cc1cc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)c(C)s1 797109669 MRNRYKMMGYPTPE-BQYQJAHWSA-N 343.448 5.524 30 20 EKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCC2CCCC2)cc1 915087787 XPNMGVKSPFIMBK-NRFANRHFSA-N 332.447 5.251 30 20 EKED CC(=NNc1ccccc1C(=O)O)c1ccc(Oc2ccccc2)cc1 1776030094 YPBIUIDWSCBQTQ-UHFFFAOYSA-N 346.386 5.013 30 20 EKED Cc1c(NN=C2CCCC[C@H]2C2CCCCC2)cccc1C(=O)O 1776088047 MIIJOJQYZHMMEQ-KRWDZBQOSA-N 328.456 5.232 30 20 EKED Cc1ccc(C#N)cc1NC(=O)Nc1ccccc1CCC(F)(F)F 121605607 AIRNBVLLXMETRU-UHFFFAOYSA-N 347.340 5.006 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 160596482 HRHDLASSNHQNIU-SFTDATJTSA-N 349.478 5.070 30 20 EKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)sc1C 303343218 LXXWXLSHFNBRPF-UHFFFAOYSA-N 348.427 5.281 30 20 EKED C[C@H]1C[C@@H](C(O)=Nc2ccc3nc(C(C)(C)C)sc3c2)CCC1=O 328897375 CQMQIBAHFUZNSU-RYUDHWBXSA-N 344.480 5.187 30 20 EKED C=CCCc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F 410349434 AIEHDWBSKCKNMR-UHFFFAOYSA-N 333.353 5.005 30 20 EKED C[C@H](Sc1nnc(CCC2CCCCC2)o1)c1cccc(C#N)c1 442915393 WVQJQTAYTBOEMP-AWEZNQCLSA-N 341.480 5.307 30 20 EKED CCc1ccsc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 463466643 NOMOWVLEAUIBRJ-UHFFFAOYSA-N 338.457 5.163 30 20 EKED Cc1sc(NC(=O)C[C@@H](c2ccccc2)C(C)C)c(C#N)c1C 482267727 OQBTTZWTAVDKGV-MRXNPFEDSA-N 326.465 5.005 30 20 EKED CC(C)[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(F)cc1F 512643755 YDXYQNLQVUIHFG-HXPMCKFVSA-N 332.369 5.023 30 20 EKED N#Cc1ccccc1CN[C@H](c1ccccc1)c1ccc2ccccc2c1 521884443 SNEMRUOEDMNEIL-RUZDIDTESA-N 348.449 5.591 30 20 EKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(C(F)F)ccc2Cl)c1 556948456 GLGKTCZWRNVLRN-UHFFFAOYSA-N 341.144 5.055 30 20 EKED Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3N[C@H](CCC#N)c1ccccc1 572916483 FNJXTJHSMPBNDR-IFMALSPDSA-N 343.474 5.488 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1 594924721 LBUOVVCLAKYVKQ-MRXNPFEDSA-N 336.504 5.205 30 20 EKED CC1=CC[C@@](C)(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 598810428 GNMJEROGWLYWFB-HNAYVOBHSA-N 328.481 5.013 30 20 EKED C[C@@H](NC(=O)N[C@H](CC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 610356812 APPPDTUPTJJRQY-OXQOHEQNSA-N 349.478 5.096 30 20 EKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1cccc(CC(F)(F)F)c1 611483205 KGNIFCVMXTXVNH-SFHVURJKSA-N 330.353 5.153 30 20 EKED C[C@H](CC1CCOCC1)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611871373 ATGLLHQIOQKOQV-QZTJIDSGSA-N 348.490 5.081 30 20 EKED FC(F)(F)CCC(CCC(F)(F)F)NC1CCC(F)(F)CC1 658251731 AIVKRMGXUAKCIC-UHFFFAOYSA-N 341.286 5.208 30 20 EKED C#Cc1cccc(NC(=O)N2CCCCC[C@@H]2c2cccc(C)c2)c1 735566047 UUYTXIKKMPLYBK-OAQYLSRUSA-N 332.447 5.126 30 20 EKED CCn1c(C(C)=NNc2cccc3ccccc23)nc2ccccc21 741460847 UAIXAQCGYRKMSR-UHFFFAOYSA-N 328.419 5.046 30 20 EKED N#Cc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741845040 XTIZQWPNTWFHAK-YHYXMXQVSA-N 347.361 5.109 30 20 EKED CCCCCCCCC(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 747786306 ZWDGKINYEJDQLA-RBBKRZOGSA-N 345.527 5.363 30 20 EKED Cc1csc(-c2ccc(N=Cc3cc4ccccc4nc3O)cc2)n1 750949451 DZTXYWDUOOPDCV-UHFFFAOYSA-N 345.427 5.123 30 20 EKED N#Cc1ccc(C(=O)/C=C/c2ccc(F)c(Cl)c2Cl)c(F)c1 761487451 SXUPCEJJJCBATP-ZZXKWVIFSA-N 338.140 5.039 30 20 EKED Cc1ccc(N(Cc2cccs2)C(=O)CCCCCC#N)cc1 808177051 NUNCBGVYXZFGPP-UHFFFAOYSA-N 326.465 5.064 30 20 EKED O=C(/C=C\c1csc(-c2cccs2)n1)c1nccc2ccccc12 811699753 XCOHBYMMMBFURI-FPLPWBNLSA-N 348.452 5.316 30 20 EKED CC(=NNc1nccc2sccc12)c1cccc(C(F)(F)F)c1 915979605 IKXODXPSTJCKPX-UHFFFAOYSA-N 335.354 5.151 30 20 EKED CC(C)[C@H]1/C(=C\c2ccc(C(=O)O)cc2Cl)C(=O)c2ccccc21 1776308862 RVLCJAUGBVREAE-QJKHOBJASA-N 340.806 5.058 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(SCC(F)F)cc1 154319898 DUNFRRNRLFFCTQ-KGLIPLIRSA-N 346.446 5.327 30 20 EKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccccc1C#N 172679307 YEFFWQWGZCRIMP-OAHLLOKOSA-N 338.476 5.109 30 20 EKED Cc1ccccc1-c1cccc(CN[C@@H](C)c2cccc(C#N)c2)c1 237605030 HYUJQTYCKOOUQX-SFHVURJKSA-N 326.443 5.385 30 20 EKED CCC(CC)n1ccc(CNc2ccccc2S[C@@H](C)CC#N)n1 269348253 RAYJNJCBJHAAGV-HNNXBMFYSA-N 342.512 5.251 30 20 EKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c(Cl)c1 427111845 WLZLKBWRHFTIFF-UHFFFAOYSA-N 344.867 5.103 30 20 EKED CN(CCC1CCCCC1)C(=O)N[C@H](CCCC#N)c1ccccc1 458800963 MILHYAUJZSIXIL-HXUWFJFHSA-N 341.499 5.033 30 20 EKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(Cl)c2ccccc12 462479050 WFHOBMDHMBMPNB-ZDUSSCGKSA-N 338.813 5.355 30 20 EKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C(C)(C)C1 472736035 GTQIRRRACTZNRX-OAHLLOKOSA-N 349.434 5.003 30 20 EKED CCCOCc1ccccc1CN[C@@H]1CCCCc2cc(C#N)ccc21 481913473 FZLVIFMPVVLEJD-HSZRJFAPSA-N 348.490 5.042 30 20 EKED COc1ccc(/C=C\c2ccc3ccccc3n2)cc1OCCCC#N 494084214 XXBJAORKQDNIKS-FLIBITNWSA-N 344.414 5.096 30 20 EKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCC1CCCCC1 501004095 WZYAFJZQQYLDGX-UHFFFAOYSA-N 336.435 5.045 30 20 EKED CCN(C(=O)CCCC1CCCCC1)[C@H](C)c1ccc(C#N)cc1 509616094 HVOXHMMNDGLVJL-QGZVFWFLSA-N 326.484 5.218 30 20 EKED C=CCC[C@@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccccc1 515149646 GDYNVEAHMHQFQK-RTBURBONSA-N 325.427 5.119 30 20 EKED C[C@H](N[C@H](C)c1cscn1)c1ccc(-c2cccc(C#N)c2)cc1 543961459 KGPGDZXNLFKCCX-LSDHHAIUSA-N 333.460 5.094 30 20 EKED C[C@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccsc2S1 551205753 MDNRCZHJYVSMCT-BMGDILEWSA-N 342.533 5.698 30 20 EKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)C1CCCCCC1 571464788 JLNFOEKFXADKNU-UHFFFAOYSA-N 332.447 5.062 30 20 EKED Cc1sc(C(C)(C)NC[C@@H](C)CCC#N)nc1-c1ccccc1F 602675147 RLTIFBOOJHHXHZ-ZDUSSCGKSA-N 345.487 5.022 30 20 EKED N#Cc1ccc(Cl)cc1N1CCC(c2c[nH]c3ccccc23)CC1 609495197 OXPBWYUOQQWCBF-UHFFFAOYSA-N 335.838 5.077 30 20 EKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc3c(c2)CCCC3)c1 726743454 IMCUNZHXGQFDDE-RAXLEYEMSA-N 345.442 5.144 30 20 EKED CC(C)(C)c1ncc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)s1 741470832 WMXLKKNOWXFRDB-BQYQJAHWSA-N 348.471 5.399 30 20 EKED C=CC[C@@H](N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 766020430 PJDDHELVAXUQSY-DNVCBOLYSA-N 349.503 5.482 30 20 EKED C=CCC[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1 778597981 HHULOCSKPXNHOD-IRXDYDNUSA-N 346.455 5.223 30 20 EKED C=CC[C@@H](OC(=O)CCc1ncc(-c2ccccc2)o1)c1ccccc1 778737666 CXWZJCNMGCPDGM-LJQANCHMSA-N 347.414 5.135 30 20 EKED C#CCCCCCC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C 779982256 AKVMTOCVEFMRRD-ZDUSSCGKSA-N 338.278 5.023 30 20 EKED O=C(/C=C\c1sccc1Cl)c1cccc(-c2ccncc2)c1 782341443 JVXSLBAZCIKSGU-PLNGDYQASA-N 325.820 5.360 30 20 EKED C=CC[C@@H](OC(=O)c1ncoc1CC)c1ccc(Cl)c(Cl)c1 797553931 CSYOJYHITDRQQO-CQSZACIVSA-N 340.206 5.018 30 20 EKED N#Cc1ccc(F)c(CNc2nc(-c3ccccc3Cl)cs2)c1 864009842 YVWCFJZPSCKUTQ-UHFFFAOYSA-N 343.814 5.086 30 20 EKED N#CCCCOC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 914963803 HYVJYHJOWKXQOH-UHFFFAOYSA-N 347.745 5.034 30 20 EKED CC(C)[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)C(F)(F)F 926251992 ANCNHNPIQDSSCL-VIFPVBQESA-N 347.265 5.217 30 20 EKED CCCCCCCOc1ccc(/C=C/c2ncc(C(=O)O)s2)cc1 1776788257 VBKGVAHFTQVYEC-FMIVXFBMSA-N 345.464 5.361 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2ccc(Cl)cc2)n1 80455688 LXLWUQCSKSAEEP-AWEZNQCLSA-N 346.883 5.074 30 20 EKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(OC(F)(F)F)c1 90665567 TUCYPINVBYCWPJ-KBXCAEBGSA-N 348.368 5.281 30 20 EKED CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 159277912 UMERCLMQMHAJDH-HZPDHXFCSA-N 345.512 5.125 30 20 EKED C[C@H](Cc1nnc(SCCCCC(C)(C)C#N)o1)c1ccccc1 277502019 DRERFNYUOJVVAY-OAHLLOKOSA-N 343.496 5.228 30 20 EKED O/C(=N/[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1coc(C2CCCCC2)n1 328711584 BFRRYCRCXGQDPH-CHWSQXEVSA-N 344.377 5.148 30 20 EKED CC[C@]1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 467898073 KJWAJTJGIXLADI-OAQYLSRUSA-N 349.434 5.004 30 20 EKED CCC1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCC1 473816955 IXAVQSKRUREYJH-HNNXBMFYSA-N 345.512 5.030 30 20 EKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474695487 CPUNBUPXLCPSHG-SJLPKXTDSA-N 346.430 5.040 30 20 EKED C=CCCC1(C(=O)N2CC=C(c3cccc4ccccc34)CC2)CC1 475382345 UYALZWRSFLORKH-UHFFFAOYSA-N 331.459 5.202 30 20 EKED CCOc1cccc([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)c1 481927508 YDCFBTUKLHJXNT-ZHRRBRCNSA-N 334.463 5.075 30 20 EKED C[C@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1cc2ccccc2o1 488140904 FUKCVEDPEAHGRL-NSHDSACASA-N 349.340 5.304 30 20 EKED CSc1cccc([C@H](NCCCCC#N)c2ccc(F)c(F)c2)c1 491060122 MVJVMQHOBFHZLR-IBGZPJMESA-N 346.446 5.060 30 20 EKED C=CCCc1ccccc1NC(=O)N1CC[C@H](C)C[C@H]1c1ccco1 505029095 LFGOXYRBHJENKO-LPHOPBHVSA-N 338.451 5.403 30 20 EKED CC[C@@H](C)Oc1cc(C)ccc1CN[C@H](C)c1ccc(C#N)cc1F 512628102 CWRXRCRKGVUNSD-HZPDHXFCSA-N 340.442 5.034 30 20 EKED CC(C)(C#N)c1ccccc1CNC(C)(C)c1nc2ccccc2s1 528605909 XVICEIKSJZFILB-UHFFFAOYSA-N 349.503 5.122 30 20 EKED C[C@H](NCc1ccc(Oc2ccccc2)c(F)c1)c1ccc(C#N)cc1 549172741 IWUNLYRYSDYHIP-INIZCTEOSA-N 346.405 5.340 30 20 EKED Cc1csc(NC(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)c1C#N 554774491 NBDDSUJENRKZMH-GDBMZVCRSA-N 348.512 5.022 30 20 EKED C[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1 558863223 NDGFKQUUYCAHTB-ORAYPTAESA-N 344.380 5.379 30 20 EKED CCOc1ccc(CN[C@H](C)c2ccc(C#N)cc2Cl)cc1Cl 565765288 XVSSLNFNBKUGSZ-GFCCVEGCSA-N 349.261 5.115 30 20 EKED CCC(CC)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 569168528 STBARCMKGBGUPI-CQSZACIVSA-N 333.501 5.123 30 20 EKED C[C@@H](NCc1ccc(CC#N)cc1)c1ccc(-c2ccccc2)cc1 570316954 WBIJYDNZTXEIPD-GOSISDBHSA-N 326.443 5.270 30 20 EKED C=C(C)[C@@H](Cc1nc([C@H](c2ccc(Cl)cc2)C(C)C)no1)OCC 578099272 LQLHFLIQQWNGCD-AEFFLSMTSA-N 348.874 5.035 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccccc1C#N 588564760 YVJOPCATTNQMFI-YPKPFQOOSA-N 332.447 5.286 30 20 EKED CC[C@H](C)Oc1cc(/C=C2\CCc3sccc3C2=O)ccc1OC 726892074 LCXNRRWBMAELKN-JMRXEAOASA-N 342.460 5.147 30 20 EKED C=C(C)COc1cccc(NC(=S)Nc2cccc(CC)c2)c1 727282839 FHNCSQKLHGVKET-UHFFFAOYSA-N 326.465 5.013 30 20 EKED CC(=NNc1ccc(F)cn1)c1ccc(SC2CCCC2)cc1 731321476 JXRRECOMUGJTCX-UHFFFAOYSA-N 329.444 5.092 30 20 EKED CN(CCC#N)c1ccc(CN[C@@H](CC(C)(C)C)c2ccccc2)cc1 731449677 YUAZKBHFBJQTJG-QFIPXVFZSA-N 349.522 5.304 30 20 EKED CSc1ccc(CSCc2cc(Cl)ccc2OCC#N)cc1 735317778 FNPAXFIPKCRCTC-UHFFFAOYSA-N 349.908 5.398 30 20 EKED CCCCCC[C@@H](CC)C(=O)N(Cc1ccc(C#N)cc1)C1CC1 740922416 DZKBSLYNKCKMLM-LJQANCHMSA-N 326.484 5.046 30 20 EKED CC(C)CN(C(=S)Nc1ccccc1Cl)c1ccc(C#N)cc1 745686505 COCBNKAXNSDBBQ-UHFFFAOYSA-N 343.883 5.071 30 20 EKED CCc1ccc(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)o1 752237626 HQJKVSOQEHUAHR-CLFYSBASSA-N 327.380 5.001 30 20 EKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc(Cl)c(F)c1 765612221 DYNHHZKRWSSGRB-VQHVLOKHSA-N 327.742 5.030 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc2[nH]ccc2c1 789719384 OVZTXLHGXFEHMW-BENRWUELSA-N 344.458 5.672 30 20 EKED CCCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 792109048 FKUXIHUQRZULTO-KKSFZXQISA-N 337.467 5.193 30 20 EKED N#CC[C@H](CC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccccc1 792774471 APQIOCNVNNKIFO-OAQYLSRUSA-N 340.426 5.380 30 20 EKED C[C@@H](OC(=O)CCCCCC#N)c1ccc(SC(F)(F)F)cc1 805916199 SSZOJMYSFJSINU-GFCCVEGCSA-N 345.386 5.377 30 20 EKED Cc1c(CNCc2ccc(C#N)cc2)sc2c(Cl)cccc12 815115731 MHIJFTKPVFHTPB-UHFFFAOYSA-N 326.852 5.025 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1O 815597744 FEFVAGARSPHOHT-DYVFJYSZSA-N 348.368 5.107 30 20 EKED O=C(/C=C\c1ccc(Cl)s1)c1ccc(Br)s1 834676139 OJTZNYIGWCPRIE-IWQZZHSRSA-N 333.659 5.122 30 20 EKED N#Cc1ccccc1NC(=S)Nc1ccc(-c2ccccc2)cc1F 915999769 SWSBYQCIKQVYFT-UHFFFAOYSA-N 347.418 5.173 30 20 EKED COc1cc(C(=O)/C=C/c2cccc(C)c2)ccc1SC(F)F 63874743 RPCLSZACHNPFBE-SOFGYWHQSA-N 334.387 5.214 30 20 EKED CC(O)=Nc1ccc(Cl)c(N/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1 329819751 XWBUSACQOPWQPA-BFHYXJOUSA-N 349.862 5.243 30 20 EKED C[C@H]1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)c2ccccc21 356760953 GJSWZEPWTSSDAJ-HKUYNNGSSA-N 332.447 5.004 30 20 EKED N#Cc1ccc(CSCc2ncccc2C(F)(F)F)c(Cl)c1 432261457 CNXJGVHTXBIQAS-UHFFFAOYSA-N 342.773 5.059 30 20 EKED N#CCCC[C@H](NC(=O)Nc1ccc(Cl)c(F)c1)c1ccccc1 432662790 BBBSXKLXKMLQPV-KRWDZBQOSA-N 345.805 5.036 30 20 EKED N#CCCC[C@@H](NCc1c(Cl)cccc1Cl)c1ccccc1 433014377 DJMPLCIXSMEGEV-GOSISDBHSA-N 333.262 5.518 30 20 EKED N#CCCC[C@@H](NCCOc1ccc2ccccc2c1)c1ccccc1 433017726 CZNOJYUKDQIGLB-HSZRJFAPSA-N 344.458 5.243 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC2(CC1)CC2 434180280 AQIYEPGSZRGZNA-UHFFFAOYSA-N 326.484 5.383 30 20 EKED CC(C)c1oc([C@H]2CCCN2CC2(C#N)CCC2)nc1-c1ccccc1 450562048 HIXXSKICDQZWQI-GOSISDBHSA-N 349.478 5.296 30 20 EKED N#CCCSc1ccccc1NCCCOc1cccc(Cl)c1 462224003 JSTVLFRYXPRPDF-UHFFFAOYSA-N 346.883 5.227 30 20 EKED CCCCSc1ccc(Cl)cc1-c1noc(CCCC#N)n1 463057795 RJYQSGQBYBHTDW-UHFFFAOYSA-N 335.860 5.128 30 20 EKED CC[C@H](C(=O)Nc1cc(C(C)(C)C)sc1C#N)c1ccccc1 464407494 QZXSBOOAYWVYEQ-AWEZNQCLSA-N 326.465 5.050 30 20 EKED CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C 477356916 CAIDRDKSFKVEEU-PZJWPPBQSA-N 347.462 5.057 30 20 EKED C=C(C)[C@@H](NCc1cc(C)c2ncccc2c1)c1ccc(F)c(F)c1 479424212 NTEZMAPLVDLETA-HXUWFJFHSA-N 338.401 5.228 30 20 EKED Cc1ccc([C@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccccc2)cc1 512669339 ZONDXMYHDPWSCW-UZUQRXQVSA-N 344.433 5.446 30 20 EKED C=CCC[C@H](N[C@@H]1CCc2c1ccc(OC)c2F)c1ccccc1 515149645 GDYNVEAHMHQFQK-RBUKOAKNSA-N 325.427 5.119 30 20 EKED C=CCC[C@@H](NCc1nc(-c2ccccc2)oc1C)c1ccccc1 538192429 YPDKXTPOTMCTPC-HXUWFJFHSA-N 332.447 5.447 30 20 EKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(Oc2ccccc2)cc1 538396366 STCCWTHMBDFVDF-OAHLLOKOSA-N 334.444 5.263 30 20 EKED C=CCCCN(C)C(=O)c1csc(-c2cccc3ccccc23)n1 538671141 OMMSLMAFEKVFGO-UHFFFAOYSA-N 336.460 5.002 30 20 EKED CCSc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 561129978 DPIJIKYHQOQEBV-YCRPNKLZSA-N 336.504 5.398 30 20 EKED CC(C)(CCC#N)CN[C@H]1CC2(CCCCC2)Oc2ccccc21 562044724 NKQZMZXTBDXKTQ-SFHVURJKSA-N 326.484 5.133 30 20 EKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(C(F)(F)F)cc1 563575067 ZCIOHPPMOZNRLE-NWDGAFQWSA-N 336.332 5.128 30 20 EKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cc(F)c(Cl)cc1Cl 571008608 AYBMKJRUGHDRGC-MLCYQJTMSA-N 349.236 5.342 30 20 EKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 609824825 ABWRUPMYXDLDMV-HXOBKFHXSA-N 342.442 5.007 30 20 EKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cccc(Cl)c1Cl 746345555 GZNAKVZUYUBFRV-HJWRWDBZSA-N 337.250 5.284 30 20 EKED C[C@@H](C#N)Oc1ccc(CNc2cccc(C(F)F)c2Cl)cc1 757936433 NESLJFXYPREGMW-NSHDSACASA-N 336.769 5.181 30 20 EKED C=CCCCCC[C@H](C)Nc1ccc(Cl)c(C[S@@](C)=O)c1 793586579 JPMCWGAFOPMRIH-LHSJRXKWSA-N 327.921 5.155 30 20 EKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1ccc(Cl)s1 818245902 TVMFINAFVLEQHG-FECSTBLZSA-N 345.807 5.140 30 20 EKED Oc1ccc2ccccc2c1C=Nc1ccc2oc(C3CC3)nc2c1 914702346 BEDUQCZYCHDATH-UHFFFAOYSA-N 328.371 5.315 30 20 EKED CCOc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1 916152210 QVCYHYIWADNQIE-RAXLEYEMSA-N 335.428 5.105 30 20 EKED O=C1/C(=C/c2csc(-c3ccsc3)n2)Cc2c(Cl)cccc21 921263925 LBMBXTXKEFUXIN-IZZDOVSWSA-N 343.860 5.347 30 20 EKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 90665550 OBJWDESEPBQLPD-RDTXWAMCSA-N 332.369 5.401 30 20 EKED N#Cc1ccsc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 110166205 LQYGXFLKATZXBW-UHFFFAOYSA-N 338.819 5.192 30 20 EKED C=CCOc1cccc(NC(=O)N(C)[C@@H](c2ccccc2)C(C)C)c1 303497093 LTHCFNNKXPNAAU-HXUWFJFHSA-N 338.451 5.112 30 20 EKED C[C@H](C/C(O)=N/[C@@H]1CCCCC12CCCC2)/N=C(/O)C1CCCC1 329746595 RVFJZRRATHMTHD-NVXWUHKLSA-N 334.504 5.371 30 20 EKED C=CCC[C@H](N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 467737633 MFZCXLRPOXEOGJ-JSGCOSHPSA-N 340.414 5.520 30 20 EKED C=CCCC1(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2C)CC1 476342677 ZAFINYWNOQHFNV-QGZVFWFLSA-N 326.484 5.059 30 20 EKED CC[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 487449975 SIYWYMRIILDIJZ-SIKLNZKXSA-N 348.490 5.430 30 20 EKED C=CCCc1ccccc1NC(=O)Nc1cc(-c2ncco2)ccc1C 505024774 WOOHJAXDSNLRRW-UHFFFAOYSA-N 347.418 5.413 30 20 EKED CCc1c(C)sc(NC(=O)c2cc3cc(Cl)ccc3o2)c1C#N 524331379 IGINJCJEYCVZSX-UHFFFAOYSA-N 344.823 5.143 30 20 EKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1sccc1Br 537948837 HGCHLDLDOBASHL-DOMZBBRYSA-N 349.297 5.206 30 20 EKED CC(C)Sc1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551802972 AVRCPVQDFRQDJN-INIZCTEOSA-N 336.504 5.399 30 20 EKED C[C@H](NCc1ccc([C@@H](C)C(F)(F)F)cc1)c1cccc(C#N)c1 590712591 PTENCIHFHMYTBZ-KGLIPLIRSA-N 332.369 5.075 30 20 EKED Cc1sc(NC(=O)c2oc3c(Cl)cccc3c2C)c(C#N)c1C 603445765 ZCDPEIXAPLQECZ-UHFFFAOYSA-N 344.823 5.197 30 20 EKED N#Cc1nnc2ccccc2c1SCc1c(Cl)cccc1Cl 610130769 DKXRUCLFOJKPHG-UHFFFAOYSA-N 346.242 5.101 30 20 EKED C#Cc1cccc(NC(=S)Nc2c(Cl)ccc(C)c2Cl)c1 728446114 SYJIFUNFXSPYKD-UHFFFAOYSA-N 335.259 5.092 30 20 EKED O=C(/C=C/c1cccnc1Cl)c1ccc(-c2cccs2)cc1 728698534 KUMATEHQTPDEMA-MDZDMXLPSA-N 325.820 5.360 30 20 EKED CC/C(=C\C(=O)Nc1ccccc1SCCC#N)c1ccccc1 730982324 OLMCHMOSIHVRSE-FOCLMDBBSA-N 336.460 5.124 30 20 EKED O=C(/C=C/c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 740764699 CAWUBHYUXLUCLC-MDZDMXLPSA-N 327.305 5.150 30 20 EKED C=C[C@H](CC(=O)O[C@@H](c1ccccc1)c1nccs1)c1ccccc1 770183249 JUFMUZLIKQJBQF-UZLBHIALSA-N 349.455 5.136 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](F)Cc1ccccc1 789720704 WZIMKCXUZYRFLZ-LJQANCHMSA-N 325.427 5.058 30 20 EKED Cc1cc(Cl)ccc1CNc1ccccc1S[C@@H](C)CC#N 864006576 VWQIJPVKCZYKOO-AWEZNQCLSA-N 330.884 5.655 30 20 EKED N#Cc1ccc(F)c(CNc2ncc(-c3ccc(Cl)cc3)s2)c1 864009262 IEFQCIDYYMWGTP-UHFFFAOYSA-N 343.814 5.086 30 20 EKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(C)s3)cs2)cc1 918714159 ZABUKFXCWNNYBD-HJWRWDBZSA-N 325.458 5.385 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C)c1cc(C)c(C(=O)O)o1 1776784634 ZPIBKOGPHMKTAW-KRWDZBQOSA-N 337.504 5.810 30 20 EKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 47376207 ZNRCUZOZYPUDQN-OAHLLOKOSA-N 341.197 5.032 30 20 EKED CCC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 72591329 VNWQBCOAHWJNIW-RISCZKNCSA-N 332.856 5.076 30 20 EKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 112735195 IXROJZNZISSTFW-FQEVSTJZSA-N 349.478 5.349 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCC(F)(F)F 276458495 WAWBZCLFHYDYQA-UHFFFAOYSA-N 328.378 5.003 30 20 EKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc([N+](=O)[O-])c1 340451044 ZIBRONUASFSQFZ-WOJBJXKFSA-N 337.423 5.071 30 20 EKED Cc1nc(C(F)(F)F)c(CSCCCCC(C)(C)C#N)s1 435893581 QPSCJTNEQZRNGR-UHFFFAOYSA-N 336.448 5.424 30 20 EKED C[C@H](NCCCCC(C)(C)C#N)[C@H](C)c1ccccc1C(F)(F)F 444677162 VWDFTLPUVHABST-GJZGRUSLSA-N 340.433 5.507 30 20 EKED C=CCC1(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)CCCC1 449856957 QMZSSCCBFIHATK-UHFFFAOYSA-N 342.483 5.055 30 20 EKED C=CCC1(NC(=O)Nc2cccc(-c3ncco3)c2C)CCCCC1 455536738 QKZUTQKKVMKLAF-UHFFFAOYSA-N 339.439 5.051 30 20 EKED CC(C)C[C@]1(C)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458857029 ZJDNMRJKYRGDBA-CTNGQTDRSA-N 341.499 5.032 30 20 EKED CCN(C(=O)C[C@@H](c1ccccc1)C(C)C)[C@H](C)c1ccc(C#N)cc1 482411358 XCLQLLLRTDNMRN-XMSQKQJNSA-N 348.490 5.298 30 20 EKED CC(C)Oc1cc(F)ccc1NCc1ccccc1C(C)(C)C#N 486151706 VKHAJICRXPUUQZ-UHFFFAOYSA-N 326.415 5.026 30 20 EKED C=CCOc1cccc(NC(=O)N(C)Cc2ccc(C(C)C)cc2)c1 510980350 BJXBMSLTJHZFCQ-UHFFFAOYSA-N 338.451 5.039 30 20 EKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 512668546 VPCFNPZYGIOORK-RYUDHWBXSA-N 336.332 5.128 30 20 EKED C[C@@H](N[C@H]1C[C@@H]1C(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 554086294 UTQUIADOFZJEFV-DADVEIPYSA-N 347.249 5.028 30 20 EKED C=CC[C@H](C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 574603007 KKMMNYBBYNIRON-AWEZNQCLSA-N 335.781 5.576 30 20 EKED C=C(CNC(=O)c1occc1CSc1ccccc1)c1ccccc1 673342658 RRRXNXSTYJZUGN-UHFFFAOYSA-N 349.455 5.015 30 20 EKED C=CCN(C(=O)N[C@@H](C)c1ccccc1Oc1ccccc1)C(C)C 726272275 IFHLOSUSVVYMNQ-KRWDZBQOSA-N 338.451 5.146 30 20 EKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2cnn(C(C)C)c2)cc1 765948042 YJYUIQXREUOLDZ-HOTGVXAUSA-N 347.890 5.007 30 20 EKED O=C(/C=C\c1ccsc1Cl)c1cccc(-c2ccncc2)c1 790220913 YCORSIJIXLGDBK-PLNGDYQASA-N 325.820 5.360 30 20 EKED CCCC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 800386507 JAWUICWKOXIWCL-RYUDHWBXSA-N 348.418 5.091 30 20 EKED Cc1cc(Cl)cc([C@@H](C)N[C@H](CCC#N)c2ccccc2)c1O 808709632 YHIGRFMGCCIVMB-RDTXWAMCSA-N 328.843 5.050 30 20 EKED Cc1cccc(C(NCc2cc(C#N)cs2)c2cccc(C)c2)c1 237923873 BMKUMHKVYVVYCD-UHFFFAOYSA-N 332.472 5.116 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1CCC(C)(C)CC1 426377768 DVHWXXKQWIWCKK-AWEZNQCLSA-N 330.497 5.236 30 20 EKED Cc1ccc([C@@H](C)N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1 438855116 ILUYQIPQHKBYJD-NQIIRXRSSA-N 349.478 5.051 30 20 EKED CC[C@H](N[C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccc(C#N)cc1 447561363 HZPDSSZQWCCGIJ-SBUREZEXSA-N 341.458 5.422 30 20 EKED C[C@@H](C(=O)Nc1ccccc1-c1cccs1)c1cccc(C#N)c1 463236563 LTLSDZSFXSBLIF-CQSZACIVSA-N 332.428 5.029 30 20 EKED Cc1nc(CSc2ccccc2C#N)oc1-c1ccc(Cl)cc1 464894619 OQCNJNDSVGWKLN-UHFFFAOYSA-N 340.835 5.467 30 20 EKED C=CCCC(=O)N1CCCCC[C@H]1c1ccc(C(F)(F)F)cc1 471337235 PUUKQSLXUZNDEE-INIZCTEOSA-N 325.374 5.115 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2ccccc12 476149415 NKAPORMFZFKCRQ-UHFFFAOYSA-N 329.443 5.944 30 20 EKED CCCCN(C(=O)Nc1cc(C#N)ccc1C)[C@H](C)c1ccccc1 476816832 OFQWMJQQNZAPMK-QGZVFWFLSA-N 335.451 5.262 30 20 EKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(F)cc1F 507596795 PQBHUSVCGOEASO-AZOSJMHDSA-N 340.417 5.020 30 20 EKED C[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 509704574 PUCHZLOHXHWSBJ-HOTGVXAUSA-N 349.434 5.003 30 20 EKED N#CC1(C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)CCCC1 512861137 PENRWNUFFTYEAS-UHFFFAOYSA-N 330.387 5.122 30 20 EKED Cc1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)sc1C 542942165 KMXDDNUHGWWTDG-OAHLLOKOSA-N 347.487 5.149 30 20 EKED CCCC(C)(C)N(CCCC1(C#N)CCOCC1)Cc1cccs1 549414364 RNWJZJWMJYYVLB-UHFFFAOYSA-N 348.556 5.229 30 20 EKED CCC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550836523 RFTYXZOJXMCAJD-LEWJYISDSA-N 340.898 6.206 30 20 EKED N#C[C@@H](Cc1ccccc1)Sc1ncc(-c2ccc(Cl)cc2)o1 590690443 HPDWFVQEXKRYSW-MRXNPFEDSA-N 340.835 5.222 30 20 EKED CCCCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1ccc(C)o1 604499792 AEEIKALSCBSGFJ-MRXNPFEDSA-N 339.439 5.049 30 20 EKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2cnn(C(C)C)c2)o1 734304879 ZPIXEGGIKZZFSJ-YVMONPNESA-N 338.382 5.068 30 20 EKED Cc1ccc(-c2ncc(/C=C3/Cc4cc(F)ccc4C3=O)s2)cc1 734305502 WGSCHUMFWVPZGC-GDNBJRDFSA-N 335.403 5.080 30 20 EKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccsc1 749101715 IKUZDXZAOFTLOZ-ALCCZGGFSA-N 337.425 5.514 30 20 EKED CC(C)c1ccc(-c2nc(C(=O)O[C@H](C)C(C)(C)C#N)cs2)cc1 753628565 JHCLVDUHBWOFNL-CYBMUJFWSA-N 342.464 5.029 30 20 EKED C=CC[C@H](N[C@H](CC)c1ccc(Cl)cc1Cl)c1ccncc1 766021467 TYGVHYJFZUZZJF-MSOLQXFVSA-N 335.278 5.747 30 20 EKED CC1CCN(c2cccc(N[C@H](C)c3ccc(C#N)c(F)c3)c2)CC1 777697482 SUMIJFWEIGHCLL-MRXNPFEDSA-N 337.442 5.107 30 20 EKED Cc1ccsc1CCCC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567122 DJEVEEFJXIVYQS-CYBMUJFWSA-N 346.521 5.010 30 20 EKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813218061 SAYGBYMPFDSMFN-WBMJQRKESA-N 346.352 5.104 30 20 EKED CC[C@@H](C#N)[C@H](OC(=O)c1sccc1C(F)F)c1cccs1 873550518 CGNJZNXZFJGJCN-CABZTGNLSA-N 341.404 5.195 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)c1sccc1CC#N 874983831 AYGKWEJWKCAAEW-UHFFFAOYSA-N 326.465 5.313 30 20 EKED C=C(Cl)CSc1nc(O)c2c(C[C@H](C)CC)c(C)sc2n1 1643608406 LYPPQYKKGZLLET-MRVPVSSYSA-N 342.917 5.139 30 20 EKED CC(C)c1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1 1776370217 HHMJSXOVSHPUHT-ZHACJKMWSA-N 328.795 5.058 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCC)c(C)c1 1776784797 XVTHABIWFFZAAG-LJQANCHMSA-N 349.515 5.077 30 20 EKED N#CCC[C@H](N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 90665736 XAJZXECRQWUOMU-ROUUACIJSA-N 342.895 5.512 30 20 EKED N#Cc1csc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 177692342 MSCPXHBBJKXAAQ-IBGZPJMESA-N 338.863 5.152 30 20 EKED CC[C@@H](C)Sc1ccc(NC(=O)CCCC#N)c(C(F)(F)F)c1 291439713 YOVBJWITFDRVCX-LLVKDONJSA-N 344.402 5.228 30 20 EKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1Cl 426123035 LIPWVKVNNQCBEV-AWEZNQCLSA-N 341.842 5.044 30 20 EKED N#C[C@@H]1CC[C@@H](Nc2cc(Cl)ccc2SCC(F)(F)F)C1 442856634 OLSZTQQJPSNNCX-MWLCHTKSSA-N 334.794 5.099 30 20 EKED CCCc1cccc(C(C)C)c1NC(=O)C[C@H](CC#N)c1ccccc1 476975603 SOCFQTHRDLPGAY-FQEVSTJZSA-N 348.490 5.789 30 20 EKED N#Cc1ccccc1-c1ccc(CNCc2cc(Cl)cs2)cc1 487564846 USHXBSZLCFHTCC-UHFFFAOYSA-N 338.863 5.230 30 20 EKED CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1SCCC#N 513437549 NULDDFUKPXOVQW-MRXNPFEDSA-N 330.497 5.237 30 20 EKED C=CCC[C@@H](NCc1ccc(OC)cc1C(F)(F)F)c1ccco1 552252713 UNIUUIIASIGBAH-MRXNPFEDSA-N 339.357 5.104 30 20 EKED CC(C)CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 609209513 AFSRJWNQTHBGEZ-UHFFFAOYSA-N 349.434 5.003 30 20 EKED COc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)c2ccccc12 610830031 YRIJLTLQRYHCMG-CVEARBPZSA-N 330.431 5.132 30 20 EKED C=CCC[C@H](NCc1cccc(COC(C)(C)C)c1)c1ccco1 671745582 MXYKAZSFEUSYQI-IBGZPJMESA-N 327.468 5.392 30 20 EKED C#Cc1cccc(NC(=S)N(CCC)[C@@H](CC)c2ccccc2)c1 726484047 BCRHXFAILDNBGE-FQEVSTJZSA-N 336.504 5.228 30 20 EKED O=C(/C=C\c1cccnc1Cl)c1ccc(-c2ccccc2)s1 728700045 LFFXATMFLTWNDO-HJWRWDBZSA-N 325.820 5.360 30 20 EKED CCCCCCCC(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 744722691 OZDAWICQZXDICO-NSHDSACASA-N 336.423 5.090 30 20 EKED C=CCCCC(=O)O[C@@H](c1cccnc1)c1cccc(C(F)(F)F)c1 759600630 XIKCWEKGLQBASF-GOSISDBHSA-N 349.352 5.089 30 20 EKED C#CC[C@@H](N[C@@H](CC)c1ccc(OC(F)F)cc1)c1ccccc1 773113888 GQGBHZVZESVSCE-RBUKOAKNSA-N 329.390 5.093 30 20 EKED C=C(C)[C@H](NCc1ccnc(Cl)c1Cl)c1ccc(F)c(F)c1 811490244 NKAHITQQFKITDH-HNNXBMFYSA-N 343.204 5.074 30 20 EKED COCc1ccccc1/C=C(\C)C=NOc1ccccc1C(F)(F)F 814225710 VNYPJQSZGJUUOZ-VYXMHMSKSA-N 349.352 5.320 30 20 EKED CCSCc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1 834899387 KAJNPESVVYTULO-OAHLLOKOSA-N 326.465 5.015 30 20 EKED CC(=NOCc1coc(-c2ccccc2)n1)c1cc2ccccc2o1 852754968 RHSQGWFYMQRRDK-UHFFFAOYSA-N 332.359 5.029 30 20 EKED CSc1ccc(C(=O)/C=C/c2csc(Br)c2)cc1 913617527 HOHBPUMLNCZRMR-FARCUNLSSA-N 339.279 5.129 30 20 EKED C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352223 IWIYRNBDBIJFNF-TYCQWZJGSA-N 347.462 5.042 30 20 EKED CC(=NNc1cccc(Cl)c1F)c1sc(C(C)(C)C)nc1C 921137941 VBDDZXMEYUFNQX-UHFFFAOYSA-N 339.867 5.378 30 20 EKED CCCCCCCCC[C@H](C)CCN1CCC[C@](CC)(C(=O)O)C1 1776785094 CEJPQKUSLFIKNC-FPOVZHCZSA-N 339.564 5.730 30 20 EKED N#Cc1cccnc1Oc1ccccc1NCc1ccccc1Cl 55844421 XFBTVNLTHAANJL-UHFFFAOYSA-N 335.794 5.011 30 20 EKED CC(C)c1csc([C@@H](C#N)C(=O)CCC(C)(C)c2ccccc2)n1 155618869 SZNDVWGEEFFQPL-INIZCTEOSA-N 340.492 5.201 30 20 EKED CCCCCCCCC(=O)Nc1ccccc1-c1nncn1C(C)C 177490193 PRHMHKBIVIRZBB-UHFFFAOYSA-N 342.487 5.215 30 20 EKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cccc1SC 184938960 WOKUSEQAFGGAIN-UHFFFAOYSA-N 344.455 5.076 30 20 EKED Cc1ccc(C)c(SCC(=O)c2cn(CCC#N)c3ccccc23)c1 253599033 ZEKVKMCDDQUXFZ-UHFFFAOYSA-N 348.471 5.147 30 20 EKED Cc1cccc(C2(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CCCC2)c1 303139104 LSLUPZKLTGGBNH-UHFFFAOYSA-N 346.474 5.247 30 20 EKED CCc1ccc2c(c1)[C@@H](CC/N=C(/O)C1CCCCCC1)C(O)=N2 329379038 PFDHVODGBUAKLG-MRXNPFEDSA-N 328.456 5.251 30 20 EKED N#CCCC[C@H](NC(=O)c1ccc(-c2ccccc2)o1)c1ccccc1 352179713 AYBGIEDCABGERA-IBGZPJMESA-N 344.414 5.112 30 20 EKED C=CCCc1ccccc1NC(=O)N[C@@H](CC(F)F)c1ccccc1 421115479 HLBCVDRIUYYIOQ-SFHVURJKSA-N 344.405 5.323 30 20 EKED C[C@H](Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cccc(C#N)c1 429423116 IGRHSMUYCQHDJS-ZDUSSCGKSA-N 332.369 5.571 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)NC/C=C\c1ccccc1 475553606 YYQSFGUVKIENDJ-LCYFTJDESA-N 334.463 5.373 30 20 EKED C=C(C)[C@@H](N[C@@H](C)c1cc(F)c(F)c(F)c1)c1ccc(F)c(F)c1 480667168 FXTZRYFKQJFATF-XTZNXHDOSA-N 341.323 5.350 30 20 EKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nccc2ccccc12 483198964 MQUSZENEPVVDFF-MRXNPFEDSA-N 341.197 5.032 30 20 EKED C[C@H]1C[C@@H](C)C[C@H](C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 503139605 MOWNPJOCGLHOHT-QXSJWSMHSA-N 330.497 5.092 30 20 EKED CCN(C(=O)c1oc2c(C)cccc2c1C)[C@@H](C)c1ccc(C#N)cc1 509574089 INVXJISHIQXJGQ-INIZCTEOSA-N 346.430 5.145 30 20 EKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccccc2F)cc1 517717111 RKKVHUAZAIONRC-UHFFFAOYSA-N 347.349 5.134 30 20 EKED Cc1nc(-c2ccc(CNc3ccc(C#N)c(Cl)c3)s2)cs1 520309350 WYBMMYARVKFKIQ-UHFFFAOYSA-N 345.880 5.317 30 20 EKED C=CCCO[C@H](C)C(=O)Nc1ccccc1Oc1c(C)cccc1C 520722459 ABRRUSARDWHPDZ-QGZVFWFLSA-N 339.435 5.015 30 20 EKED CC[C@@H](CC(=O)Nc1sc(C)c(C)c1C#N)c1ccc(C)cc1 523102634 UOSILDQIXJANMF-HNNXBMFYSA-N 326.465 5.067 30 20 EKED CC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 538114920 VCYLUYIFRQCXET-FQEVSTJZSA-N 332.472 5.528 30 20 EKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CCC(C)(C)C 542551726 UYDJUEYRMBIAHQ-CABCVRRESA-N 332.513 5.482 30 20 EKED N#C[C@@H]1CC[C@H](N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 559149862 OYZBJNSFSJASAI-AKWBHNSASA-N 342.792 5.092 30 20 EKED CCCOc1ccc(CN[C@@H](CCCC#N)c2ccccc2)c(C)c1 594944890 SEKOVQMGAJAIQW-QFIPXVFZSA-N 336.479 5.309 30 20 EKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1 741110601 JHFOXZZHWFQJTI-UXHICEINSA-N 342.442 5.241 30 20 EKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2scnc2C)cc1 742434660 MHCVNTIFVCGTIJ-QXMHVHEDSA-N 349.455 5.235 30 20 EKED CC(=NN[C@H](C)c1ccc(C(C)C)cc1)c1c(C)nn(C(C)C)c1C 746489600 DWELDYDMTXZMJK-OAHLLOKOSA-N 340.515 5.279 30 20 EKED O=C(/C=C/c1nc(Cl)cs1)c1ccc(SCC(F)F)cc1 759085197 SOWLUOYVBWYELR-AATRIKPKSA-N 345.823 5.050 30 20 EKED C#CCCCCCC(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 779861097 NPRGKKSPMWMYJS-UHFFFAOYSA-N 345.446 5.061 30 20 EKED CCC(=NNc1cccc(C(=O)O)c1C)c1cccc2ccccc12 1776087478 FBOJTTFJYTXPPP-UHFFFAOYSA-N 332.403 5.073 30 20 EKED COc1ccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cc1OC 83193103 NTZTZUFRNDCUEQ-VZUCSPMQSA-N 342.460 5.100 30 20 EKED C[C@](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)(C(=N)O)c1ccccc1 329084804 UABQOTINBJBXNO-UJAMICLKSA-N 328.456 5.000 30 20 EKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329298748 UNWBWAJILWUOSZ-CWIFOLKKSA-N 334.504 5.083 30 20 EKED C=CCOc1ccc(CN[C@H]2CCCc3ccccc32)cc1Cl 409469244 HBKKQTBPCXNVMZ-IBGZPJMESA-N 327.855 5.072 30 20 EKED CC(C)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H](C)c1ccccc1 410894869 WGBXMCTZWFWOJA-WIYYLYMNSA-N 334.463 5.072 30 20 EKED COc1cc(Cl)ccc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 421839430 XMQJAQUYRBWUFQ-KSSFIOAISA-N 328.843 5.044 30 20 EKED CCC[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 431768094 CMEHPNFQBNVEAJ-RTWAWAEBSA-N 349.478 5.262 30 20 EKED N#CC[C@@H]1CC[C@H](N[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 449447160 WMYIWDNVNKUQKI-MGHWNKPDSA-N 336.401 5.013 30 20 EKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C(C)(C)C1 472706315 CJUTWZQCGWOPPT-HNNXBMFYSA-N 349.434 5.003 30 20 EKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480807784 XIJXGENTZLCXRO-MGPUTAFESA-N 349.434 5.003 30 20 EKED N#Cc1cccc(NC(=O)c2ccc(-c3cccc4cccnc34)cc2)c1 504536042 KNLXAORUWIKYFG-UHFFFAOYSA-N 349.393 5.026 30 20 EKED CCN(C(=O)[C@H](C)CC1CCCCC1)[C@H](C)c1ccc(C#N)cc1 510303931 AXHHCHRIUZDCNF-IAGOWNOFSA-N 326.484 5.074 30 20 EKED CCc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)sc1C 520827487 GMHGDZJQSCQPJW-LBPRGKRZSA-N 344.505 5.123 30 20 EKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)(C)C 521812581 YXZPOXYAYKQFLY-CJNGLKHVSA-N 333.501 5.027 30 20 EKED CSc1ccc(C)c(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 539443549 XYEAGFHAZNRZFB-UHFFFAOYSA-N 339.464 5.162 30 20 EKED CC(C)COc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 540148537 SASNIUDWLLJKDW-XMSQKQJNSA-N 336.479 5.417 30 20 EKED N#CCCC[C@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1 552083567 MVCDQBASVPTZGE-SFHVURJKSA-N 333.262 5.518 30 20 EKED CC(C)COc1cccc(CN[C@H](CCCC#N)c2ccccc2)c1 552311854 FGFHERFHEDEWRA-JOCHJYFZSA-N 336.479 5.246 30 20 EKED CC[C@@](C)(C#N)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 552343085 ZKFWDHJQGMOUKR-YWZLYKJASA-N 338.476 5.418 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 559859153 BNVMHPDBYLDIAF-RDTXWAMCSA-N 347.289 6.079 30 20 EKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC(CCC#N)CC1 565715281 UBKOTXFGTRLYHE-UHFFFAOYSA-N 341.499 5.481 30 20 EKED CC[C@H](C)c1ccc([C@H](NCc2nc(C#N)cs2)C(C)C)cc1 571845043 NGWZQDUVRFDTRM-IFXJQAMLSA-N 327.497 5.015 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccsc1 619788239 BVYWSEJQPCAOON-CHWSQXEVSA-N 345.493 5.025 30 20 EKED C=C(C)[C@H](N[C@@H](C)c1ccc(C(F)F)nc1)c1ccc(F)c(F)c1 657980321 AZNVVYGXKQDLPT-GTNSWQLSSA-N 338.348 5.265 30 20 EKED COc1cccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)c1OC 728441840 RMUMQQVGBQYZJY-JLHYYAGUSA-N 342.460 5.100 30 20 EKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1 741110603 JHFOXZZHWFQJTI-WOJBJXKFSA-N 342.442 5.241 30 20 EKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1C 747193096 FCCJIHKMKTXZMW-DKRLNXSXSA-N 338.476 5.081 30 20 EKED C=CCN(C(=O)Nc1ccc(Br)cc1C(C)C)C(C)C 760808798 RPWINICVRLCYMJ-UHFFFAOYSA-N 339.277 5.001 30 20 EKED CC(C)Sc1ccccc1NCc1ccc(N(C)CCC#N)cc1 770590192 WZFABIDHRQFJGP-UHFFFAOYSA-N 339.508 5.149 30 20 EKED CC(C)(C)c1cnc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)s1 790600287 JNQXNBAUSGEOMZ-BQYQJAHWSA-N 348.471 5.399 30 20 EKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 805858678 UEDDVYCVBRNFFO-ZDUSSCGKSA-N 347.409 5.214 30 20 EKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)cc(Cl)c1O 806133170 IMIJCWWZUPRTCO-PIGZYNQJSA-N 349.261 5.373 30 20 EKED CCCC[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)C(C)C 857010644 STMMMGWTVRPBET-UONOGXRCSA-N 347.409 5.070 30 20 EKED Cc1c(C(=O)/C=C\c2csc(-c3ccccn3)n2)oc2ccccc12 915987629 JDEMMGCPJNWFLR-KTKRTIGZSA-N 346.411 5.156 30 20 EKED CCc1ccc(C=NOCc2csc(-c3ccc(F)cc3)n2)cc1 920760048 OETHZKDNMSBJAO-UHFFFAOYSA-N 340.423 5.062 30 20 EKED CCCCCCCOc1ccc(CN[C@@H](C)CCCCC(=O)O)cc1 1776788252 UMAAHVYSJLIILW-SFHVURJKSA-N 349.515 5.159 30 20 EKED CC(C)c1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66157692 OOWKVSVFUITOIC-UHFFFAOYSA-N 335.451 5.124 30 20 EKED N#Cc1csc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)c1 177686495 JEESLZIRKAEDEG-QGZVFWFLSA-N 344.892 5.214 30 20 EKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cc(C#N)cs1 177704156 AUIHKQGLHRBVKC-GOSISDBHSA-N 338.501 5.063 30 20 EKED COc1ccc2c(c1)CC/C(=C/c1nc(-c3ccccc3)cs1)C2=O 206846825 UWZOUQBRKJFAMY-VBKFSLOCSA-N 347.439 5.031 30 20 EKED CC(C)c1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)c(C(C)C)c1 463394479 IGIARZANLDVETI-MRXNPFEDSA-N 334.463 5.547 30 20 EKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc2ccccc12 474205561 KBFOGOVJXQSTDO-YLJYHZDGSA-N 342.442 5.105 30 20 EKED CCN(C(=O)c1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 509589311 VYKNYUDEZQAHBU-LBPRGKRZSA-N 347.245 5.088 30 20 EKED CCCCOc1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551790124 WFCGIDVTCRBALL-QGZVFWFLSA-N 334.463 5.077 30 20 EKED Cc1nnc(S[C@H](C)c2ccc(Cl)c(Cl)c2)c(C#N)c1C 553403110 ZBFDEGYOMLECOU-SNVBAGLBSA-N 338.263 5.125 30 20 EKED C=C(C)COc1cccc(NC(=O)N2C[C@@]3(C)C[C@H]2CC(C)(C)C3)c1 589740800 AEDLVMOQINILFZ-UTKZUKDTSA-N 342.483 5.074 30 20 EKED CCCOc1ccc(CN[C@H](CCCC#N)c2ccccc2)c(C)c1 594944889 SEKOVQMGAJAIQW-JOCHJYFZSA-N 336.479 5.309 30 20 EKED Cc1ccc2c(Cl)c(C(=O)N(CC#N)c3ccccc3)sc2c1 609149708 DXURGNSPKDLFJS-UHFFFAOYSA-N 340.835 5.034 30 20 EKED CCCc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609377929 RUXOPHGHJZKNRV-HNNXBMFYSA-N 338.476 5.143 30 20 EKED CCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 749057005 TUZHPXMZAROHTG-NWDGAFQWSA-N 348.418 5.091 30 20 EKED COc1cccc(NN=Cc2c(Cl)cccc2SC(C)C)c1 786039670 XJWGZCDSFWJSHB-UHFFFAOYSA-N 334.872 5.295 30 20 EKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](F)CC1CCCCC1 793469334 SJIZQVZZSKSSAU-GDBMZVCRSA-N 348.487 5.328 30 20 EKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(N2CCCCCC2)cc1 799727020 VHQYSZVBOVSMQV-XEVCZEQESA-N 339.527 5.048 30 20 EKED C[C@H](N[C@H](C)c1ccc2ccccc2c1)c1ccc(OCC#N)cc1 171982321 AXAUIYMVDKTZBG-DLBZAZTESA-N 330.431 5.154 30 20 EKED CCOc1cccc2cc([C@H](C)N[C@@H](CCC#N)c3ccccc3)oc12 182052418 VNXNFFBDINLCHS-LPHOPBHVSA-N 348.446 5.527 30 20 EKED C=C(C)[C@@H](N[C@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 186448070 RZYUNLVCIUNREG-DLBZAZTESA-N 334.435 5.014 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(O)nc(C(C)C)c1 189907913 SOLRIBGEYPIZGH-UHFFFAOYSA-N 338.451 5.015 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(C(F)(F)F)c1 289363603 HPOCKSZWDHOCPA-UHFFFAOYSA-N 348.368 5.205 30 20 EKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SCCC(C)(C)C#N 289391550 LUGUPVZETBKRSA-CABCVRRESA-N 332.513 5.200 30 20 EKED Cc1ncc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 367803890 SXIRPRLWEXCKGM-GJZGRUSLSA-N 347.487 5.402 30 20 EKED C=CCC[C@@H](NC(=O)N(C)[C@@H]1CCc2ccccc21)c1ccccc1 435762000 RMBKGTUCWKWSPW-NHCUHLMSSA-N 334.463 5.023 30 20 EKED N#CCCCOc1cccc(CNc2ncccc2-c2ccccc2)c1 466638987 IUELAPPAMHWZPG-UHFFFAOYSA-N 343.430 5.043 30 20 EKED C=CCC[C@H](N[C@H]1CCc2cc(F)c(OC)cc21)c1ccccc1 467373146 JTGGKWAJFOGXFJ-PMACEKPBSA-N 325.427 5.119 30 20 EKED Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1C(F)(F)F 474428947 VLFIAEKFBMUFIZ-HNNXBMFYSA-N 346.352 5.040 30 20 EKED C=CCC[C@H](C(=O)Nc1cccc(Cl)c1OC)c1ccccc1 488690131 SOCNCPGYQFGGMF-HNNXBMFYSA-N 329.827 5.037 30 20 EKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC1(C)CCCC1 503273742 WDJQBDDMDCNZMY-UHFFFAOYSA-N 349.434 5.113 30 20 EKED C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1C 509703392 BKNGYDOPONFUMU-HOTGVXAUSA-N 349.434 5.003 30 20 EKED C=C(C)CN(CC)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 517752036 SWGOCNFLSQLQOH-QGZVFWFLSA-N 348.899 5.099 30 20 EKED C[C@H](NCc1ccc(C#N)s1)c1ccc(-c2ccc(F)cc2)cc1 537327273 KIBMWMZCQIGTSF-AWEZNQCLSA-N 336.435 5.277 30 20 EKED CCc1ccc2occ(C(=O)[C@H](C#N)c3nccc4ccccc34)c2c1 552360766 QPJJADXDLNCTCH-GOSISDBHSA-N 340.382 5.033 30 20 EKED Cc1c([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 570590211 HWPNZJGNTYVWRS-FOIQADDNSA-N 330.431 5.341 30 20 EKED N#CC1(c2ccccc2)CCC(Nc2ccc([C@@H]3CCOC3)cc2)CC1 573629250 DASKIBBEMXMUSK-YUVSOPLDSA-N 346.474 5.007 30 20 EKED N#CCC1(CNc2ccccc2Oc2ncc(Cl)cc2Cl)CC1 594702851 YHTLGQNFJOVBQG-UHFFFAOYSA-N 348.233 5.286 30 20 EKED C=CCOc1cccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)c1 620514363 SOTPHWFWNDEJLR-HSZRJFAPSA-N 347.433 5.270 30 20 EKED CC(C)c1ccc2c(Cl)c(C(=O)N(C)C3(C#N)CCC3)sc2c1 732658059 ZULWKAMVZWEUHF-UHFFFAOYSA-N 346.883 5.196 30 20 EKED C[C@@H](C#N)Oc1ccccc1NC(=O)CC1CCC(C(C)(C)C)CC1 780159204 OCDSYWVKENBQRS-GTPINHCMSA-N 342.483 5.159 30 20 EKED CCCCCCC[C@H](CC(=O)O)NCc1ccc([C@@H](C)CC)cc1 1776784303 STISTECVKFCCFS-FXAWDEMLSA-N 333.516 5.494 30 20 EKED C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1cccc(C#N)c1 62698530 FAQHLLFVLKYWRO-CHWSQXEVSA-N 344.867 5.033 30 20 EKED O=C(/C(=C\c1cccs1)c1nc2ccccc2s1)c1ccccc1 96767020 WFUMVGQWMDJKHZ-DTQAZKPQSA-N 347.464 5.781 30 20 EKED C=CCCC[C@H](C)NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C 181398377 ANDUMSJYBKCSIP-DZGCQCFKSA-N 337.533 5.022 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([C@H](C)CC)no1 189889721 QYPKOKIHGZGKOS-CQSZACIVSA-N 326.440 5.292 30 20 EKED CC(C)(C)C1CCC(C/C(O)=N/[C@@H]2CCC(O)=NC23CCC3)CC1 328711953 BIHASXSVZDTEOZ-UYSNPLJNSA-N 334.504 5.227 30 20 EKED CC(O)=Nc1ccc(C/C(O)=N/[C@@H]2CCCCC23CCCC3)cc1 329645669 ZNHXJKLNNMHBQD-GOSISDBHSA-N 328.456 5.297 30 20 EKED O/C(CCc1nc2ccccc2o1)=N/[C@H]1CCCCC12CCCC2 329695050 BEPVPSXHCILEJZ-KRWDZBQOSA-N 326.440 5.220 30 20 EKED Cc1coc2ccc(N=C(O)[C@H](C)/N=C(/O)C3CCCCC3)cc12 330071218 XWXNVMQCSAHLGT-ZDUSSCGKSA-N 328.412 5.255 30 20 EKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)s1 421866711 BLKJOSSZYXSBKD-MRXNPFEDSA-N 337.275 5.167 30 20 EKED C[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 429463205 BELZSZICGJOPLJ-CRAIPNDOSA-N 349.434 5.003 30 20 EKED C[C@H](c1cccc(C#N)c1)N1CCC[C@H]1c1nc2ccccc2s1 442683565 VRKFPFGITVAGOD-KDOFPFPSSA-N 333.460 5.066 30 20 EKED CC[C@H](NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1)c1ccc(C#N)cc1 447526229 BZEROMZQVUGHBR-RJGXRXQPSA-N 348.490 5.075 30 20 EKED C=CCCN(C)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 466391295 YIPZHDINNKLFEB-UHFFFAOYSA-N 330.815 5.172 30 20 EKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCCC)c1 476137459 HWNQGJRNAKIDMT-UHFFFAOYSA-N 337.463 5.580 30 20 EKED C=CCC[C@@H](C(=O)N(C)Cc1ccc(Cl)s1)c1ccccc1 487762807 RMCOPKRBGRYLEJ-MRXNPFEDSA-N 333.884 5.110 30 20 EKED CCCCN(C(=O)NCc1ccc(C#N)cc1)[C@H](CC)c1ccccc1 526985049 KSHOMHPZKOATBS-OAQYLSRUSA-N 349.478 5.021 30 20 EKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CCC(C)(C)C 541624019 NGNHWMQZBGQRTM-LSDHHAIUSA-N 332.513 5.339 30 20 EKED N#Cc1ccc(SCc2nc(-c3ccc4sccc4c3)no2)cc1 545688426 MAYOHZQLXQAXHR-UHFFFAOYSA-N 349.440 5.115 30 20 EKED CSC[C@H](NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 554079526 VXRRGHIOGPGBJJ-HNNXBMFYSA-N 344.446 5.029 30 20 EKED CC(C)OCc1ccccc1CN[C@H]1CCCCc2cc(C#N)ccc21 573657004 ODPSQGGFABUJNG-QHCPKHFHSA-N 348.490 5.041 30 20 EKED N#CCCCCCC(=O)N(Cc1ccccc1Cl)C1CCCC1 588753717 VRDKPAUDMMKIQE-UHFFFAOYSA-N 332.875 5.085 30 20 EKED C=CCCCCCN(C)C(=O)c1ccccc1COc1ccccc1 606816447 YRQNFQKOEGYSBB-UHFFFAOYSA-N 337.463 5.084 30 20 EKED Cc1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 609297625 VEQJNXBHAYRUFW-UHFFFAOYSA-N 346.361 5.050 30 20 EKED CCC(C)(C)OCc1cccc(N[C@H](C#N)Cc2ccccc2)c1C 610538609 RIRBGDOIVMILBF-FQEVSTJZSA-N 336.479 5.247 30 20 EKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1cccc([N+](=O)[O-])c1 727490250 HDVBVILAYSQHKM-ZDUSSCGKSA-N 338.363 5.015 30 20 EKED C[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 734080535 UXOIOUTUVUIKNR-YOEHRIQHSA-N 338.476 5.203 30 20 EKED CC(C)c1ccc(C=NO[C@@H](C)c2nc(-c3cccs3)no2)cc1 744445607 SSZMJQCHAVGCBV-ZDUSSCGKSA-N 341.436 5.033 30 20 EKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 746015089 NWAKEWRWLHKNRF-CLFYSBASSA-N 339.372 5.121 30 20 EKED Fc1ccc(/C=C/C=NOc2ccccc2C(F)(F)F)c(F)c1 758128883 LEWVTNKBCBRHKR-PAZVYRNFSA-N 327.252 5.062 30 20 EKED C#CC[C@H](N[C@@H](C)c1ccc(Br)c(F)c1)c1ccccc1 773114979 LMGWCKDSJFHUAK-UGSOOPFHSA-N 346.243 5.003 30 20 EKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1cccc(C(F)(F)F)c1 788100939 YIDJJUKYCHRNIZ-VOTSOKGWSA-N 349.333 5.318 30 20 EKED O=C(/C=C/c1ccc(-c2ccc(Cl)cc2)cc1)c1ccnc(O)c1 806556712 YAJGTQTZPQOEBT-XCVCLJGOSA-N 335.790 5.004 30 20 EKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1csc2ccccc12 850123192 LJYDICNFHWXXNK-HNNXBMFYSA-N 332.472 5.307 30 20 EKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cccc(OC)c1 1776785103 CQWRFGHMVVZEEN-HXUWFJFHSA-N 349.515 5.284 30 20 EKED COc1c(O)cccc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 11331496 NQWFLDLOGMUTDV-PKNBQFBNSA-N 344.366 5.196 30 20 EKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(-c2cccnc2)cc1 181850991 VXKYZGPYZRSBED-IRXDYDNUSA-N 327.431 5.032 30 20 EKED C[C@H](C#N)Oc1ccc(/C=C\c2nc(-c3ccccc3)cs2)cc1 208261993 NMTUTOMKAJHALP-HMVFGEFZSA-N 332.428 5.271 30 20 EKED CC(C)(CCC#N)CNCC1(c2cccc(C(F)(F)F)c2)CCC1 236817450 KNVLWKIGZRIFOH-UHFFFAOYSA-N 338.417 5.047 30 20 EKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(C#N)cc1 237793976 BQKCHWGRYPPHKU-FQEVSTJZSA-N 332.472 5.002 30 20 EKED Cc1coc2ccc(N/C(O)=N/C3CCC(C(F)(F)F)CC3)cc12 330074891 LLEWVVBHFJSCDQ-UHFFFAOYSA-N 340.345 5.188 30 20 EKED C=CCC[C@@H](NC(=O)N1CCC[C@H]1c1cccs1)c1ccccc1 435110293 ILYICAZCLAAONY-MSOLQXFVSA-N 340.492 5.302 30 20 EKED C=C[C@H](CC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccccc1 437451723 KHLCGTQRRRLUSG-XFQXTVEOSA-N 339.866 5.062 30 20 EKED CC[C@@H](NCc1cc(C)cc2c(C)c(C)[nH]c12)c1ccc(C#N)cc1 447540860 KNVDVINWKQZDOU-OAQYLSRUSA-N 331.463 5.206 30 20 EKED N#CCCCC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 461921861 WIXUMILUEYBVEA-UHFFFAOYSA-N 348.324 5.130 30 20 EKED N#C[C@@H]1CCC[C@H](N[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)C1 463237697 WYVGNRAHQRSSOK-CXHZTBPHSA-N 336.401 5.013 30 20 EKED C=CCN(C(=O)C[C@H](C)CCC)c1nc(-c2ccccc2)cs1 499307297 MANOONCNMIHVEW-OAHLLOKOSA-N 328.481 5.155 30 20 EKED CCC(CC)CN(CCC#N)C(=O)c1sc2cccc(F)c2c1C 517092711 PJBCANRMCHCHJA-UHFFFAOYSA-N 346.471 5.141 30 20 EKED N#Cc1cc(C(=O)N(c2ccsc2)C2CCCCC2)ccc1Cl 519679036 FQJDLHMZUGDKKC-UHFFFAOYSA-N 344.867 5.253 30 20 EKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sccc1C1CC1 520496382 HNAREIOSOKAAHT-UHFFFAOYSA-N 337.897 5.169 30 20 EKED C=CCn1c(S[C@@H](CC)c2ccc(Cl)cc2)nnc1C1CC1 520558879 UOUJFIGBCWOMRL-HNNXBMFYSA-N 333.888 5.238 30 20 EKED C=CCCC(=O)N(Cc1ccc(-c2ccccc2C)s1)C(C)C 523280159 IMYISHLUTKUXJG-UHFFFAOYSA-N 327.493 5.427 30 20 EKED Cc1c([C@@H](NCc2ccc(F)c(C#N)c2)C(C)C)oc2ccccc12 539259813 YFHZYGKTSZCDLX-FQEVSTJZSA-N 336.410 5.239 30 20 EKED CCSc1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619755210 CRXFIWIUYCCBAU-CYBMUJFWSA-N 330.884 5.174 30 20 EKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc3c(c2)CCCC3)c1 772982152 FTONXEDSLZAIPS-JTSKRJEESA-N 348.490 5.097 30 20 EKED O=C1/C(=C\c2ccc(Cl)s2)CCc2ncc(C(F)(F)F)cc21 777469307 BAUSFPGFJUYQHK-YVMONPNESA-N 343.757 5.028 30 20 EKED N#CCOc1cccc(NCc2ccc(-c3cccc(F)c3)s2)c1 779586094 NQUHOWKTPKKUEH-UHFFFAOYSA-N 338.407 5.069 30 20 EKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cn1 903001658 WRWJGBGBYVMBFI-RDTXWAMCSA-N 347.384 5.186 30 20 EKED Cc1noc(C)c1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 914773523 LYKCYEOKLRMALZ-FPLPWBNLSA-N 327.380 5.055 30 20 EKED CC(=NNc1ncccc1C(F)(F)F)c1cc(Cl)ccc1Cl 915051298 OVGSCHFELXXMHL-UHFFFAOYSA-N 348.155 5.243 30 20 EKED