smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2ccccc2o1 90665432 FPROJCJMDUVDPD-CRAIPNDOSA-N 304.393 5.128 30 20 DKED CC(C)(C#N)CCCNC1(c2cccc(C(F)(F)F)c2)CCC1 179997240 KRCQPSJSHBPOON-UHFFFAOYSA-N 324.390 5.004 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1csc(Cl)c1 191388390 JZJNLTXRUDQPOU-IUODEOHRSA-N 304.846 5.097 30 20 DKED N#CCCCSc1nc2c(Cl)c(Cl)cc(Cl)c2o1 440586009 VILMDSMJQMZOLT-UHFFFAOYSA-N 321.616 5.184 30 20 DKED C=CCCCCNC(=O)Nc1c(C(C)C)cccc1C(C)C 473492355 OEGBHFHNAPAQFC-UHFFFAOYSA-N 302.462 5.411 30 20 DKED C[C@H](c1ccc2ccccc2c1)N(Cc1ccc(C#N)o1)C1CC1 511776491 LDJAOMHIPNMHGG-OAHLLOKOSA-N 316.404 5.030 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2)s1 541744325 FDPUXQDBLIRWRY-OAHLLOKOSA-N 318.445 5.138 30 20 DKED CC(C)(C#N)CCSCc1nc(C2CCCCC2)cs1 554716608 WOKYBNGZQXTGEB-UHFFFAOYSA-N 308.516 5.364 30 20 DKED CCC[C@@H](NCc1ccc(CC#N)cc1)c1ccc(Cl)cc1 558158302 UQHOJLIXZJMVID-LJQANCHMSA-N 312.844 5.037 30 20 DKED CCC(C)(C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744462430 KDMFURGJFKXOPY-LJQANCHMSA-N 320.436 5.107 30 20 DKED Cc1nc(-c2ccc([C@H](C)/N=C/c3ccccc3O)cc2)cs1 783254895 OFVDWVZEOIZCKT-HSWQHBDASA-N 322.433 5.004 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H](C)c1ccc(Cl)s1 410355716 VAHLFLQVIPFFNR-LBPRGKRZSA-N 319.857 5.262 30 20 DKED CC(C)(C#N)CCCSCc1cc(Cl)cc2cccnc12 480357951 CEUWKFACAWTRMV-UHFFFAOYSA-N 318.873 5.451 30 20 DKED C=C(C)[C@H](N[C@H](C)CCCC(F)(F)F)c1ccc(F)c(F)c1 480669013 NXADLOAJXOAQQM-ABAIWWIYSA-N 321.333 5.293 30 20 DKED CCCCCCCCCC(=O)N1C[C@H](C)C[C@H]1c1cccnc1 754503649 VPNQKJZYWRYUQN-MJGOQNOKSA-N 316.489 5.132 30 20 DKED CC(=NNc1cc(F)cc(F)c1)c1cc(Cl)sc1Cl 920374524 FEJGATOEBCCLOL-UHFFFAOYSA-N 321.179 5.169 30 20 DKED CCCCCCCCOC(=O)c1sc2cscc2c1F 200567039 VSBDVZTUSDFBDX-UHFFFAOYSA-N 314.447 5.619 30 20 DKED C[C@@H](Nc1snc(Cl)c1C#N)c1cc2ccccc2s1 301188707 LGLPWNBECAKDGV-MRVPVSSYSA-N 319.842 5.056 30 20 DKED Cc1cc2cc([C@H](C)NCC3CCC(C#N)CC3)oc2cc1C 442864601 GJXOJMMCTRIFEA-GTPINHCMSA-N 310.441 5.030 30 20 DKED CC[C@H](NCCCCC(C)(C)C#N)C(C)(C)c1ccccc1 444691520 ZSTSJPKCDAMDQF-SFHVURJKSA-N 300.490 5.052 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(Cl)c1F 461089972 RYIZLNIWXIVLOW-SJKOYZFVSA-N 316.807 5.153 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)nc1 476143869 KHJGQHLMXLIVNW-UHFFFAOYSA-N 322.452 5.309 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccc2c(c1)CCC2 486202121 YOLOILSTMCRRQY-OAHLLOKOSA-N 322.477 5.039 30 20 DKED CCCC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1 537293557 WXHKVZCGFAAPMN-IERDGZPVSA-N 322.452 5.149 30 20 DKED C[C@@H](N[C@H](C)c1ccc(C(F)(F)F)s1)c1ccc(C#N)cc1 902766425 KIRAHFKFFYKGQY-GHMZBOCLSA-N 324.371 5.050 30 20 DKED N#CCCCCSc1nnc(-c2ccccc2)c2ccccc12 159991759 ORNCTMOAXQFSTH-UHFFFAOYSA-N 319.433 5.083 30 20 DKED N#CCC[C@H](NCc1ccc(C2CCC2)cc1)c1ccccc1 339313996 BUQONGMYRGSMDT-NRFANRHFSA-N 304.437 5.089 30 20 DKED N#Cc1csc(CNc2ccc(Oc3ccccc3)cc2)c1 387796697 NAMYBUBMOQCTGN-UHFFFAOYSA-N 306.390 5.024 30 20 DKED Cc1ccccc1[C@H](N[C@@H](C)c1ccc(C#N)cc1)C(C)(C)C 539494775 PCOKRCRCGKKAIL-JXFKEZNVSA-N 306.453 5.305 30 20 DKED N#CCCC[C@@H](NCc1ccc2c(c1)CCCC2)c1ccccc1 552083454 GEIMEOWCZMVIGP-JOCHJYFZSA-N 318.464 5.090 30 20 DKED C#CCCCCC(=O)N1CCCC[C@H]1c1ccc(C(C)C)cc1 773569153 VBNKEOZIXMAQIG-FQEVSTJZSA-N 311.469 5.057 30 20 DKED CC1(C)CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nccc2ccccc12 792108099 XPPBFVCRUQHDTA-SJLPKXTDSA-N 320.436 5.018 30 20 DKED C=CCCCCC[C@H](C)N[C@H]1CCO[C@@H](c2ccccc2)C1 793550186 DHOOIXXOTJZALJ-YSIASYRMSA-N 301.474 5.021 30 20 DKED C=C[C@H](CC(=O)Nc1cc(SC)ccc1C)c1ccccc1 539445955 GEIKJOQYYTWLJY-OAHLLOKOSA-N 311.450 5.015 30 20 DKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2o1 727955220 WCPBRWHKVJFPOX-GJZGRUSLSA-N 312.413 5.001 30 20 DKED CC[C@H](Nc1cccc(N2CCCCC2)c1)c1ccc(C#N)cc1 774283464 LTCVYMKTCWQZIF-NRFANRHFSA-N 319.452 5.112 30 20 DKED CC[C@H](C)Oc1ccc(N[C@H](C)c2ccc(C#N)cc2F)cc1 781423897 ZITHGZKRIZJQQT-UONOGXRCSA-N 312.388 5.048 30 20 DKED O=C(/C=C\c1ccc(SC(F)F)cc1)c1ccccc1F 781543956 SEYQIQSEQWDUKT-YFHOEESVSA-N 308.324 5.037 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOC(C)(C)C 803180668 YVFZRJQMLJDBCT-UHFFFAOYSA-N 317.473 5.072 30 20 DKED CC(CCCCC#N)=NNc1c(Cl)cc(F)cc1Cl 841632495 PAFVQAZHABMLOD-UHFFFAOYSA-N 302.180 5.004 30 20 DKED CCCCCCCSc1nnc(-c2ccccc2OCC)o1 915794468 MDXGLNWWKRXXDI-UHFFFAOYSA-N 320.458 5.198 30 20 DKED C=CCC[C@@H](NCc1ccc2ccccc2n1)c1ccccc1 158839098 WYRLLQCENJYBOO-HXUWFJFHSA-N 302.421 5.032 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1csc(Cl)c1 340440602 CMKLRZXRPKWBCB-BBRMVZONSA-N 318.873 5.487 30 20 DKED N#CCCC[C@@H](NCc1ccc(F)c(Cl)c1)c1ccccc1 353917917 VZSXZMMLCIBJJR-GOSISDBHSA-N 316.807 5.004 30 20 DKED CC(C)(C#N)CCCOc1ccc(Oc2ccc(C#N)cc2)cc1 433603524 MDCNFKGGUBSJBQ-UHFFFAOYSA-N 320.392 5.059 30 20 DKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C2CC2)c1 451116254 QTZQWZOYQLHBJF-MRXNPFEDSA-N 318.464 5.216 30 20 DKED N#Cc1c(F)cccc1N[C@H](Cc1ccccc1)c1cccs1 522646904 KWWZSXHXYKTPGQ-GOSISDBHSA-N 322.408 5.155 30 20 DKED CCC(CC)[C@H](NCc1ccc(F)c(C#N)c1)c1cccs1 540378569 AEBWCFGVPYDXNG-SFHVURJKSA-N 316.445 5.026 30 20 DKED CCCCOc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 551787866 NQQPLXJRWCZKIS-DLBZAZTESA-N 322.452 5.149 30 20 DKED CCSc1ccc([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618803859 IXGYXCAGWTUHBP-VLIAUNLRSA-N 322.477 5.008 30 20 DKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1csc2ccccc12 746346507 QSYIUGOEBXONBG-KTKRTIGZSA-N 324.449 5.192 30 20 DKED CCc1c(C(=O)/C=C/c2scnc2C2CC2)oc2ccccc12 782312331 IXZWCLBUKIFWLX-MDZDMXLPSA-N 323.417 5.225 30 20 DKED C=CC[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccncc1 783243799 CAFGKMORMMDEOO-YOEHRIQHSA-N 308.450 5.264 30 20 DKED CCSc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 179236008 JOIABDVERJPUJN-LSDHHAIUSA-N 310.466 5.082 30 20 DKED CC(C)C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccs1 439433134 ALRREOPIGKQTQE-MRXNPFEDSA-N 318.873 5.150 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 467118448 VXZAZMHPORZNBG-IRXDYDNUSA-N 322.452 5.401 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 539610765 IITVQAVILIKLBH-YWZLYKJASA-N 308.400 5.055 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cc(F)ccc1Cl 548600351 WDQVVPCMXJSUCD-UHFFFAOYSA-N 321.804 5.010 30 20 DKED c1ccc([C@@H]2CCCC2=NNc2nccc3sccc23)cc1 732528751 XDBPKLLDKACLKY-AWEZNQCLSA-N 307.422 5.032 30 20 DKED C=CC[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccncc1 783243781 CAFGKMORMMDEOO-PBHICJAKSA-N 308.450 5.264 30 20 DKED C[C@@H]1/C(=C\c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 809155865 HCMPDGJUHLHPLV-AXLKIAQESA-N 323.442 5.255 30 20 DKED C=CCC[C@H](C(=O)Nc1ccccc1SC)c1ccccc1 487650653 IMFXVLDYVYXTPV-INIZCTEOSA-N 311.450 5.097 30 20 DKED C=CCCCCCN(C)C(=O)Nc1c(CC)cccc1CC 523551843 GHTPECOBSJRZMZ-UHFFFAOYSA-N 302.462 5.022 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(C2CC2)[nH]c1C1CC1 626908877 PMDALDGQDCFYJG-UHFFFAOYSA-N 320.436 5.140 30 20 DKED C[C@@H](N[C@H](C)c1csc2ccccc12)c1cccc(C#N)c1 776154883 CKHWFVCRXHYZTC-ZIAGYGMSSA-N 306.434 5.185 30 20 DKED C=CCC[C@@H](NCc1ccc(F)cc1CSC)c1ccco1 428461390 PTZCTUKRBHCXNW-QGZVFWFLSA-N 319.445 5.079 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)c1ccccc1 464479335 HXQLCFYUXNXMJP-LJQANCHMSA-N 321.464 5.671 30 20 DKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)C1CC1 505017422 VSFLMRUHYGMNBP-UHFFFAOYSA-N 320.436 5.002 30 20 DKED C=CC1CCN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC1 522088217 MHGLUPZZLVLLHY-UHFFFAOYSA-N 320.392 5.016 30 20 DKED N#CCCCCN[C@@H](c1ccccc1)[C@@H]1CCCc2ccccc21 539331368 JDHSCSYRKMWTCP-YADHBBJMSA-N 318.464 5.131 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1ccncc1 766018848 JIFVFHKQTGSOQD-APWZRJJASA-N 318.420 5.310 30 20 DKED CC(C)(C)C[C@@H](NCc1cc(C#N)cs1)c1ccc(F)cc1 236627215 UIUPJMBJFRSFBF-QGZVFWFLSA-N 316.445 5.026 30 20 DKED N#Cc1ccc(CSc2ccnc3ccccc23)c(Cl)c1 438885676 VCDDLOGRKNRCAS-UHFFFAOYSA-N 310.809 5.052 30 20 DKED N#CCCCCN[C@@H](CCCc1ccccc1)c1ccc(F)cc1 495049523 SUYJSSMONDIBIC-NRFANRHFSA-N 324.443 5.173 30 20 DKED N#Cc1ccccc1CSCc1c(Cl)ccc2cccnc12 517493075 WQPYLPJSMQFGMM-UHFFFAOYSA-N 324.836 5.193 30 20 DKED C=CCC[C@@H](NCc1cc(C)nc2ccccc12)c1ccccc1 537154357 IIAVWPXBJHLMJX-OAQYLSRUSA-N 316.448 5.340 30 20 DKED C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)c1cccc(C#N)c1 537296544 CUYWQDRCQQHZPV-QVKFZJNVSA-N 322.427 5.279 30 20 DKED CCCCCCCC(=O)Nc1ccccc1SC[C@H](C)C#N 730990088 RRVLGEMBXXLDJD-OAHLLOKOSA-N 318.486 5.237 30 20 DKED N#CCCC[C@@H](N[C@H]1CCCc2sccc21)c1ccccc1 340444028 BUBYZPCKQZENBZ-MSOLQXFVSA-N 310.466 5.150 30 20 DKED N#CCc1ccc(NCc2ccc(-c3cccc(F)c3)s2)cc1 546256793 BWLOGWCJJUMHER-UHFFFAOYSA-N 322.408 5.232 30 20 DKED C=CC[C@@H](C(=O)O[C@H](C)CCCC(F)(F)F)c1ccccc1 778735558 KHBLEWDKSJLEIO-UKRRQHHQSA-N 314.347 5.011 30 20 DKED C[C@@H](Nc1cccc(C2CCC2)c1)c1ccc(OCC#N)cc1 812739581 UQZNBXCCDLRJIX-OAHLLOKOSA-N 306.409 5.030 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CF)cc1 834315365 XXLHQORUHZQWCD-UHFFFAOYSA-N 311.400 5.260 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[S@@](=O)CCCCC1(C#N)CCC1 899276067 HYBNHWNWZOKJHL-QKKBWIMNSA-N 323.889 5.014 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)CC=C 439388623 SMTJUDIJEVCBTJ-INIZCTEOSA-N 300.446 5.015 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccccc21 448024720 ZWKXPVKFHHBOTC-UQIDSAAFSA-N 322.427 5.233 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1cccc(COC(C)(C)CC)c1C 466514566 LIOCHDCLAKTZFP-HNNXBMFYSA-N 317.473 5.241 30 20 DKED CCc1ccc(C(C)(C)NCc2ccccc2C(C)(C)C#N)cc1 537159531 XOJLUIPUKRJLBU-UHFFFAOYSA-N 320.480 5.075 30 20 DKED Cc1c([C@H](NCc2ccccc2C#N)C(C)C)oc2ccccc12 538159193 DXEUFQYPZPMVNG-HXUWFJFHSA-N 318.420 5.100 30 20 DKED N#CCOc1ccc(CSCc2cccc3ccccc23)cc1 729241754 ZNXVLWNJIFCYDP-UHFFFAOYSA-N 319.429 5.176 30 20 DKED Cc1ccsc1C(=O)/C=C\c1csc(-c2ccccc2)n1 733749119 DSPMEQUDYJFVCT-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccsc1 789719820 LDUMNIBOBPXAFX-KTKRTIGZSA-N 311.450 5.252 30 20 DKED CCCCCCCCN1CCCC[C@@H]1c1nnc(C2CCC2)o1 805780669 JQNDZHZKYZTEPW-QGZVFWFLSA-N 319.493 5.225 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1 97465034 JXMLBHCVAUMCQJ-AWEZNQCLSA-N 314.816 5.196 30 20 DKED C=CCC[C@H](NCc1ccc2cc(OC)ccc2c1)c1ccco1 514086947 DQSWKPPYYIFOJO-FQEVSTJZSA-N 321.420 5.239 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(C2CC2)c1 556148256 XMAJSIJFFJMFTG-INIZCTEOSA-N 320.436 5.420 30 20 DKED CC(C)c1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 556908810 WDLZUWKEZAFZTD-OAQYLSRUSA-N 306.453 5.335 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(F)c2ccccc12 561787723 OWADIFZDZDNAAY-HNNXBMFYSA-N 312.432 5.350 30 20 DKED CC[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)s1 572208511 PGPPNCASHPQEKG-CABCVRRESA-N 316.857 5.001 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccccc2)cc1 741471326 ZBNPYZCOCYYDAW-WJDWOHSUSA-N 314.384 5.258 30 20 DKED Cc1ncsc1C(=O)/C=C\c1cccc(Oc2ccccc2)c1 745626339 NDYMFWPGSHCXKA-KHPPLWFESA-N 321.401 5.140 30 20 DKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc2ccccc2s1 784821396 PXZQYTOVSQREJA-UONOGXRCSA-N 314.454 5.079 30 20 DKED CCCCCCCCC(=O)N(C)Cc1nc2ccccc2s1 826564623 PVHRPPSUXYUCPP-UHFFFAOYSA-N 318.486 5.005 30 20 DKED CC(CCCCC#N)=NNc1ccc(OCc2ccccc2)cc1 863160538 JBCQVEDMTCXPIJ-UHFFFAOYSA-N 321.424 5.137 30 20 DKED CC(C)c1ccc(CNc2cccc(OCCCC#N)c2)cc1 236661096 VIQSKLNJRBSSTE-UHFFFAOYSA-N 308.425 5.105 30 20 DKED CC(C)(C#N)CCCCSCc1csc(C(C)(C)C)n1 435890408 SRYZIJGVGYMFNX-UHFFFAOYSA-N 310.532 5.394 30 20 DKED C=CCC[C@@H](NC(=O)Nc1ccsc1Cl)c1ccccc1 446476364 IKWPNAXQEIAGLC-CYBMUJFWSA-N 320.845 5.231 30 20 DKED Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1cccc(C#N)c1 538554774 WQUCSOHSWDQVOS-MRXNPFEDSA-N 322.452 5.355 30 20 DKED Cc1cc(F)c(C(F)(F)F)cc1N[C@H](C)c1ccc(C#N)cc1 600850830 CBQJLUKIMKQEMR-LLVKDONJSA-N 322.305 5.198 30 20 DKED C=CC1CCN(C(=O)Nc2cc(Cl)ccc2C(C)(C)C)CC1 670057360 ZIIDRPQZTNIJCS-UHFFFAOYSA-N 320.864 5.067 30 20 DKED C=CCC[C@@H](Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccco1 671758925 JJLRASGXSXLWJY-GOSISDBHSA-N 322.408 5.671 30 20 DKED C[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)C1CCCCC1 726317717 CTAWIOLLILJREJ-QAPCUYQASA-N 320.436 5.018 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nc2ccccc2s1 735395738 AXAFSJQVDWMECL-KGLIPLIRSA-N 314.454 5.079 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)CCCC2CCCCC2)n1 747195821 ACNJARJXCFTGRA-OAHLLOKOSA-N 318.486 5.193 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccncc1 815580045 AZLVXTRCESMQNL-VFNWGFHPSA-N 320.411 5.342 30 20 DKED C=CCN(C(=S)Nc1c(C(C)C)cccc1C(C)C)C(C)C 917589072 JRYRQRJJIIRYPE-UHFFFAOYSA-N 318.530 5.527 30 20 DKED CCCCCC[C@@H]1CCCC1=NNc1cccc(C(=O)O)c1C 1776086555 AWPYEIUXFMPCHD-OAHLLOKOSA-N 316.445 5.232 30 20 DKED N#C[C@H]1CC[C@@H](Sc2ccc(Cl)c(C(F)(F)F)c2)C1 430089429 NHTYACKMCHLQRV-DTWKUNHWSA-N 305.752 5.143 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C)o1 476128268 CJLLFTBIXOWRQH-UHFFFAOYSA-N 311.425 5.011 30 20 DKED CCCCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 500768836 JAOQIDQOTXCMKO-UHFFFAOYSA-N 322.408 5.178 30 20 DKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H](CC1CC1)c1ccccc1 553873768 QLSWXFSVCGIJFP-FCHUYYIVSA-N 316.448 5.067 30 20 DKED FC(F)(F)c1ccccc1ON=Cc1cccc2ccccc12 754712385 NUALXDOLIBTHQK-UHFFFAOYSA-N 315.294 5.272 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 766022031 VUCHPARTRIZNHF-SUMWQHHRSA-N 320.358 5.068 30 20 DKED C=CCC[C@H](NCc1cc2c(F)cccc2[nH]1)c1ccccc1 436282635 HWYBPFXKJKOZAZ-IBGZPJMESA-N 308.400 5.104 30 20 DKED N#Cc1ccccc1-c1ccc(CSc2ccc(O)cc2)cc1 510075070 YFWNHMSYBXSOSB-UHFFFAOYSA-N 317.413 5.223 30 20 DKED Cc1cc2cc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)oc2cc1C 532206440 RKADQQSCPCXWDB-HZPDHXFCSA-N 318.420 5.333 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H]1CCCCC1(F)F 594704305 ADVBMCYUWAOXJV-KBPBESRZSA-N 324.440 5.318 30 20 DKED Cc1ccc(SCc2cc(Cl)ccc2OCC#N)cc1C 735230697 GSPJARZSMXVNGF-UHFFFAOYSA-N 317.841 5.152 30 20 DKED CCCCCCCC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 742131706 MSIPOHFGQODACL-MAUKXSAKSA-N 305.437 5.096 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C\c1coc(-c3ccccc3)n1)C2=O 766695358 KJKHHIPFRGRMFB-XWAFYUISSA-N 315.372 5.033 30 20 DKED C[C@@H](SCCCSCC#N)c1ccc(Cl)c(Cl)c1 466638764 GPKWWTRIAYMKKE-SNVBAGLBSA-N 320.310 5.434 30 20 DKED C=CCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 530649847 XKBJUMBLJGDIGT-UHFFFAOYSA-N 322.433 5.317 30 20 DKED Cc1c(CSC(C)C)cccc1NCCCC(C)(C)C#N 531648080 VXIWHXICMXFJSH-UHFFFAOYSA-N 304.503 5.379 30 20 DKED CCSCc1cccc(N[C@H](C)c2ccc(C#N)c(F)c2)c1 540838359 QHUZFYFPMPHELI-CYBMUJFWSA-N 314.429 5.124 30 20 DKED CC(C)Oc1cccc([C@@H](C)Nc2cccc(Cl)c2C#N)c1 603859854 DOCNQEDLYULZRK-CYBMUJFWSA-N 314.816 5.172 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)CCCCC(C)(C)C)n1 805891962 ZNVXUQOJIPSJEN-ZDUSSCGKSA-N 306.475 5.049 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C#N)c1 903000656 LXJUOBHZHODRCO-SFTDATJTSA-N 317.436 5.034 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1CC 189891302 WAVNCFJDDDHTTG-UHFFFAOYSA-N 321.464 5.282 30 20 DKED C=CCC(CC=C)C(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 436437732 GEWJYUTVXTUZNZ-GOSISDBHSA-N 317.860 5.162 30 20 DKED C[C@H](NCC1CCC(C#N)CC1)c1cc(Cl)sc1Cl 442865615 IONMFJKLKXFDTK-WHXUTIOJSA-N 317.285 5.035 30 20 DKED C[C@H](SCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 539705573 LHIYBRVKXXZZDO-AWEZNQCLSA-N 323.889 5.235 30 20 DKED CC(C)[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1 611390404 XXCDBFRIERQTFF-LEWJYISDSA-N 322.427 5.062 30 20 DKED Cc1cc(SC(C)(C)C)ccc1NC(=O)CCCCCC#N 805175040 UUNOFGUOTNBPSC-UHFFFAOYSA-N 318.486 5.298 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@@H](C)/N=C\c1ccccc1O 920173633 CWMISWLLMPQWEV-UAAGNOOKSA-N 322.433 5.004 30 20 DKED COc1cccc(C=Nc2ccc3oc4ccccc4c3c2)c1O 920946212 SPYIVRJPHWNHML-UHFFFAOYSA-N 317.344 5.051 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1 154327743 JUIRLYRXBXWLQD-LSDHHAIUSA-N 310.466 5.082 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)s1 189910919 OPSBKFQZYPQZON-UHFFFAOYSA-N 313.466 5.090 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1F 340444141 CEEFCABVPICULY-WOJBJXKFSA-N 310.416 5.302 30 20 DKED Cc1c([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)oc2ccccc12 477865805 XGTQGANEPXBGPX-KBPBESRZSA-N 322.383 5.164 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1c(CCC)cccc1C(C)C 489087595 JMLODCCJJQWWCO-KRWDZBQOSA-N 314.473 5.335 30 20 DKED CC(C)C[C@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 520924074 HTDIEEZYBDRLMT-GJZGRUSLSA-N 318.486 5.092 30 20 DKED CC(C)c1nc(CSc2cccc(Cl)c2C#N)cs1 538950394 NNCILWJCYAPRGD-UHFFFAOYSA-N 308.859 5.084 30 20 DKED N#Cc1cccc(CNc2cccc(-c3cccs3)c2)c1F 544093497 HWQSNRZRQVFBMT-UHFFFAOYSA-N 308.381 5.038 30 20 DKED CC(C)[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 565568332 BOBHVZBITFNWSL-PMACEKPBSA-N 324.855 5.186 30 20 DKED CC(C)n1cc(C(=O)/C=C/c2ccccc2-c2ccccc2)cn1 746686850 NPPZGLKLVDQDCV-OUKQBFOZSA-N 316.404 5.027 30 20 DKED CCCCCCCCCCC(=O)N1CCC(C(F)F)CC1 766686275 ZMLFZEXFCYRANV-UHFFFAOYSA-N 303.437 5.021 30 20 DKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc2ccccc2c1 782303358 XBJGEJMAVUSLAL-POHAHGRESA-N 309.368 5.284 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccccc1CF 901384176 VUIFOGPFLBWWGQ-AWEZNQCLSA-N 314.429 5.020 30 20 DKED N#Cc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1 917517353 OSJHCWLFKOKKSH-KHPPLWFESA-N 315.397 5.183 30 20 DKED C[C@@H](NCc1cc(-c2ccccc2)cs1)c1ccc(C#N)cc1 77290324 LXEAMHIFCDPUNC-OAHLLOKOSA-N 318.445 5.138 30 20 DKED CCC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315888540 PFQCGTIMBDDKSF-LIRRHRJNSA-N 312.844 5.404 30 20 DKED CCC[C@@H](NCCCCC(C)(C)C#N)c1ccc(F)cc1F 444677733 URTLGINZDMEOKR-QGZVFWFLSA-N 308.416 5.116 30 20 DKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)CCCC(C)(C)C#N 472437006 BBAGRUMSQGZJAK-CYBMUJFWSA-N 312.379 5.028 30 20 DKED CCC[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 500747996 STCRMLCPTTUCGF-CQSZACIVSA-N 322.408 5.034 30 20 DKED C[C@H](NCCC(C)(C)C#N)c1ccc(Cl)c2ccccc12 545902425 BNBRLINGFMEKGE-ZDUSSCGKSA-N 300.833 5.084 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1cc(Cl)ccc1Cl 782303414 YGECGXGHCLXXRY-WAYWQWQTSA-N 324.232 5.223 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1ccc[nH]1 918012025 NYDVOMYSVZFJRT-SFHVURJKSA-N 304.478 5.209 30 20 DKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cc2ccccc2o1 182646308 QTKMHXNOXGWGQD-OAHLLOKOSA-N 318.420 5.085 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc[nH]c1C1CCC1 487314574 WSDHCRVAHMIXNE-UHFFFAOYSA-N 322.452 5.386 30 20 DKED C=C(CC)CSCCCC(=O)Nc1c(C)cc(C)cc1C 536882393 RMLLHYQUCJNRBB-UHFFFAOYSA-N 305.487 5.030 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1cc2c(ccc3ccccc32)o1 554367394 WYXNUSIETRNPQT-OAHLLOKOSA-N 320.436 5.567 30 20 DKED C[C@@H](CC#N)Sc1ccccc1N[C@@H](C)c1ccccc1F 600847556 VFUSLIYDFNBCMD-KBPBESRZSA-N 314.429 5.393 30 20 DKED N#CCCCCSc1nc2cc(C(F)(F)F)ccc2s1 753854712 PPMPWDAGELPINA-UHFFFAOYSA-N 316.373 5.101 30 20 DKED O=C(/C=C/c1nccc2ccccc12)c1cc2ccccc2s1 780189047 SQPIZOMDTLHRGM-MDZDMXLPSA-N 315.397 5.346 30 20 DKED CCc1ccc([C@@H](CC)N[C@@H](CCC#N)c2ccccc2)cc1 358340934 MZSUJDDOMWLQDW-RTWAWAEBSA-N 306.453 5.335 30 20 DKED CC[C@H](NCCCCC#N)c1ccc(Oc2ccccc2)cc1 482457376 QNKXPHBMXBPGHI-FQEVSTJZSA-N 308.425 5.213 30 20 DKED C[C@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1F 512640900 BGZMSMSMOMDROX-GJZGRUSLSA-N 318.395 5.262 30 20 DKED CCCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1 537293556 WXHKVZCGFAAPMN-HRAATJIYSA-N 322.452 5.149 30 20 DKED Cc1cccc2c1[C@H](C)C[C@H]2Nc1cccc(OCCCC#N)c1 538527927 IRHHRODMVUROTR-OXQOHEQNSA-N 320.436 5.338 30 20 DKED C=CCC[C@@H](NCc1ncc(Cl)cc1Cl)c1ccccc1 538628627 NWGAMULJIALTFL-MRXNPFEDSA-N 321.251 5.186 30 20 DKED C=CCCC[C@@H](C)N[C@@H](C)c1cccc(OCc2ccccn2)c1 539257193 QVZJPCYUSDJIRK-MSOLQXFVSA-N 324.468 5.056 30 20 DKED C[C@@H](NCCCC#N)c1ccc(-c2ccc(Cl)cc2F)s1 541738823 SNRYEBFXVTXASL-LLVKDONJSA-N 322.836 5.162 30 20 DKED C=CCC[C@H](NCc1ccc(SC)s1)c1ccccc1 554972252 HIRRVVQMRHMXIX-INIZCTEOSA-N 303.496 5.267 30 20 DKED C=CCCNc1ccc(Oc2ncc(Cl)cc2Cl)cc1 607149322 VBYHTVWDVOCQEQ-UHFFFAOYSA-N 309.196 5.169 30 20 DKED Fc1c(Cl)cccc1NN=CC1CCC(C(F)(F)F)CC1 767379926 NCKDPHZNAPXXHB-UHFFFAOYSA-N 322.733 5.246 30 20 DKED CCCC[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 799891282 CGRVCVOJXUUPEX-OXQOHEQNSA-N 320.436 5.107 30 20 DKED C[C@@H](OC(=O)CCCCCC#N)c1ccccc1-c1ccccc1 805870567 SRODNQYJXYVAKH-QGZVFWFLSA-N 321.420 5.432 30 20 DKED COc1cc(C(=O)/C=C\c2ccc(Cl)s2)ccc1SC 212271708 VNSSCFLHOQCOAF-XQRVVYSFSA-N 324.854 5.028 30 20 DKED CC[C@H](N[C@@H](C)c1oc2ccccc2c1C)c1ccc(C#N)cc1 447545817 YFKBMPURNVYOGM-KXBFYZLASA-N 318.420 5.415 30 20 DKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(-c2ccccc2)s1 453287419 FTPDVXNLJXOHAU-VYDXJSESSA-N 310.466 5.148 30 20 DKED CC(C)c1ccc([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618802057 FNJSWFIARHUGTP-BTYIYWSLSA-N 304.437 5.020 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1ccc(Cl)s1 730433194 DODJBKCOLYEKSI-SOFGYWHQSA-N 301.798 5.087 30 20 DKED CC(C)c1ccc2c(Cl)c(C(=O)O[C@H](C)CC#N)sc2c1 733709116 BDFJVQLQZDSYFT-SNVBAGLBSA-N 321.829 5.137 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cnc(C(C)(C)C)s1 736434564 VYMROLINCFSPIF-KTKRTIGZSA-N 324.449 5.126 30 20 DKED CCN(Cc1cc(C#N)ccc1F)[C@H](C)c1cc2ccccc2o1 64348924 RQQMHNZQRIQIOD-CQSZACIVSA-N 322.383 5.027 30 20 DKED O=C(/C=C\c1cccc(O)c1)c1ccc(-c2cccs2)cc1 96973272 UUEKEJFHTKARRG-WDZFZDKYSA-N 306.386 5.017 30 20 DKED N#CCCCOc1cccc(NCc2cc3ccccc3s2)c1 237827041 ZJNYUVVSIYQUID-UHFFFAOYSA-N 322.433 5.196 30 20 DKED Cc1cc(C)c2c(c1)CC[C@@H]2N[C@H](CCCC#N)c1ccccc1 594505958 GJUODJOQGPUPEX-RTWAWAEBSA-N 318.464 5.316 30 20 DKED C=CCCCN(C)C(=O)c1cc2sc3ccccc3c2s1 605645451 ALDXYNBZBNEHSU-UHFFFAOYSA-N 315.463 5.154 30 20 DKED CCCCCCCC(=O)N(Cc1cscn1)c1ccccc1 731176488 CCTJCRWYBQNDKB-UHFFFAOYSA-N 316.470 5.037 30 20 DKED Cc1ccc(C)c(NN=Cc2c(Cl)cccc2OC(F)F)c1 732924222 UJAAJJKXXLYGSC-UHFFFAOYSA-N 324.758 5.004 30 20 DKED C[C@H](Nc1ccc(N2CCCCCC2)cc1)c1ccc(C#N)cc1 743475157 OGSNCHFYJSGUGX-KRWDZBQOSA-N 319.452 5.112 30 20 DKED CC/C(C)=C(/C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 779836733 FVOOZBFBNIORKG-CNNWTFKKSA-N 318.420 5.027 30 20 DKED O=C(/C=C/c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1F 916127506 AMZPQFFLHMFMCT-QHHAFSJGSA-N 313.130 5.168 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@@H](C)c2ccc(C#N)c(F)c2)c2ccccc21 448034009 ZKWIWVXGZSIPAN-UQIDSAAFSA-N 322.427 5.233 30 20 DKED CC(C)(C#N)CCCCSCc1cccnc1C(F)(F)F 600638790 XVXTWLCVBLJGKA-UHFFFAOYSA-N 316.392 5.054 30 20 DKED C[C@H](NCc1ccc(C#N)cc1)c1cccc(-c2ccccc2)c1 765008342 BFELEUWRBAFTSG-KRWDZBQOSA-N 312.416 5.076 30 20 DKED CC(C)CC1(C(=O)[C@H](C#N)c2nccc3ccccc23)CCCC1 792106503 ROJVOJOYFVBJMO-GOSISDBHSA-N 320.436 5.018 30 20 DKED C[C@H]1/C(=C/c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 809156334 LCPLSGZHVAODIW-PDICVPPASA-N 323.442 5.255 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1 319640497 CBZQMCWHLUDNLZ-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CC(C)c1cnc(S[C@@H](C)c2cccc(C#N)c2)n1C(C)C 442912617 FESOQBJRXSMGDJ-AWEZNQCLSA-N 313.470 5.312 30 20 DKED C=CCC[C@@H](NCc1csc(-c2ccccc2)n1)c1ccco1 513717144 LMBKXDOHEXNGBY-QGZVFWFLSA-N 324.449 5.200 30 20 DKED CC(C)c1ccc(C(=O)[C@H](C)Sc2ccc(C#N)cc2)cc1 525631626 SIUYIMOGRNZZPI-AWEZNQCLSA-N 309.434 5.045 30 20 DKED C=C[C@H](CC(=O)Nc1ccc(OC(C)C)cc1C)c1ccccc1 536245668 WVFMSGSWKLYHFF-QGZVFWFLSA-N 323.436 5.081 30 20 DKED C=C[C@H](CC(=O)N(C1CC1)[C@H](C)c1ccccc1)c1ccccc1 559681234 LJEMHHGFMSQCRO-QZTJIDSGSA-N 319.448 5.099 30 20 DKED C[C@@H](Nc1ccc(N2CCCCCC2)cc1)c1cccc(C#N)c1 785529709 JDFXZQKKFGXGGI-QGZVFWFLSA-N 319.452 5.112 30 20 DKED C#CCCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1 785623219 YHHQCMHGGQIHRU-UHFFFAOYSA-N 311.812 5.139 30 20 DKED C=CC[C@H](CC)N[C@H](C)c1ccc(SC(F)F)c(OC)c1 798937431 QRHCNBKUWLOFJX-YPMHNXCESA-N 315.429 5.015 30 20 DKED CCCCCCCCCCCCCCn1cnc2ccccc21 196659136 QPHHOADAIHHOMT-UHFFFAOYSA-N 314.517 6.737 30 20 DKED Cc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1C(=N)O 329083658 SVHRFVNSIMUMEP-CWRNSKLLSA-N 314.429 5.073 30 20 DKED N#CCC[C@@H](NC1CC(c2ccccc2Cl)C1)c1ccccc1 352694173 VXSYNKWMWFMJQN-LBXVMSDZSA-N 324.855 5.221 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc(Cl)cc1F 485757357 MQTRFFWZQGLORV-UHFFFAOYSA-N 321.804 5.010 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1cc(C)c(C)o1)c1ccc(F)c(F)c1 502433310 VNTWZZUFVUOADL-KZULUSFZSA-N 305.368 5.143 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccccc1 505040238 TUXHJTNDHYYFRV-INIZCTEOSA-N 308.425 5.030 30 20 DKED C/C(=C\c1ccccc1C(F)(F)F)CNCC(C)(C)CCC#N 562894700 RNHPYUPGZAFEPE-SDNWHVSQSA-N 324.390 5.028 30 20 DKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc2ccccc12 618806906 SKYPMXGNFAZVLM-IVZQSRNASA-N 312.416 5.050 30 20 DKED O=C(/C=C/c1ccc(Cl)nc1)c1cc2cc(Cl)ccc2o1 748997686 GQJHYJRJQZSLIP-DAFODLJHSA-N 318.159 5.031 30 20 DKED Cc1cc(NC(=O)CCCCCC#N)ccc1-c1ccccc1 805198904 VCSAHTPBBGAUMN-UHFFFAOYSA-N 306.409 5.075 30 20 DKED CC[C@@H](CCC(F)(F)F)N[C@H](CCCC#N)c1ccccc1 872072735 JDUCEPINLYDXGX-JKSUJKDBSA-N 312.379 5.132 30 20 DKED N#CCCCCNC1(c2cccc(C(F)(F)F)c2)CCCCC1 477649533 HILDYFFOWFCLFO-UHFFFAOYSA-N 324.390 5.148 30 20 DKED CC(C)(C)CCCCC(=O)N[C@H](CCCC#N)c1ccccc1 487218892 LISUHBZJEGSTJG-GOSISDBHSA-N 314.473 5.144 30 20 DKED C=CCC[C@H](NCc1cccc(C(F)(F)F)c1)c1ccco1 514105306 QKLIJKGSEOUCGW-HNNXBMFYSA-N 309.331 5.096 30 20 DKED COc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1cccc(C#N)c1 539494942 WZQMEEGHCPPGOI-OXJNMPFZSA-N 322.452 5.005 30 20 DKED COc1cc(/C=C/C(=O)c2coc3ccccc23)ccc1SC 747704491 AFRRKNUGDHIDCA-VQHVLOKHSA-N 324.401 5.059 30 20 DKED C=CC[C@H](CC)NC(=S)Nc1c(C(C)C)cccc1C(C)C 798376261 UIEGNMNHZPAMJE-HNNXBMFYSA-N 318.530 5.575 30 20 DKED CC[C@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 814887871 MZMLBHVBWVJHIY-CYBMUJFWSA-N 307.315 5.264 30 20 DKED C/C(=C\C(C)(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 185727538 SNNDFRFZUMQELS-XTZCOPOCSA-N 316.470 5.012 30 20 DKED Cc1cc(CN[C@@H](C)c2ccc(SC(C)C)cc2)ccc1C#N 488152221 QDNOOEXMVZQPJB-INIZCTEOSA-N 324.493 5.218 30 20 DKED C=C[C@H](CC(=O)N(CC)c1ccccc1Cl)c1ccccc1 550764921 UIQBBQDTWUWGSE-OAHLLOKOSA-N 313.828 5.053 30 20 DKED C=CCC[C@H](N[C@H](C)c1nc(C)sc1C)c1ccccc1 678602218 BBSMOMZFPMSBGF-DYVFJYSZSA-N 300.471 5.118 30 20 DKED CCCCCCCC(=O)c1ccc(OCc2ncc(C)o2)cc1 742349020 REMICGGPRAOGDY-UHFFFAOYSA-N 315.413 5.105 30 20 DKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccccc3F)cs2)cc1 757476170 WJDMNVRKBAIGRM-ZHACJKMWSA-N 323.392 5.154 30 20 DKED CCCCC[C@@H](CC)C(=O)Nc1ccccc1SCCC#N 775726019 OFHMLWSIXJPBDG-OAHLLOKOSA-N 318.486 5.237 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CC)nc1C 189884920 XXNUIFBCCWUGMK-UHFFFAOYSA-N 322.452 5.057 30 20 DKED Cc1cc(CNc2ccccc2SC[C@H](C)C#N)c(C)s1 435893735 OMXYGYWPRMIMPX-GFCCVEGCSA-N 316.495 5.229 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)CC(C)(C)C 476091906 PNDVAEUCPDINJD-OAHLLOKOSA-N 301.474 5.549 30 20 DKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccsc1 727267451 UNLXQRLWUOZOJW-RQOWECAXSA-N 316.731 5.316 30 20 DKED Cc1ccc(F)c(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741473433 PHXWWDYERORUDF-VURMDHGXSA-N 317.363 5.092 30 20 DKED CCSc1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 755606889 MYIRZIVJSUSUTG-VAWYXSNFSA-N 319.429 5.243 30 20 DKED CC(C)c1ccc(C=NOCc2cc(-c3ccccc3)no2)cc1 913029393 JHVGOECRJBAVNY-UHFFFAOYSA-N 320.392 5.016 30 20 DKED CCCCCCC[C@@H](CC(=O)O)NCC1CCCCCCC1 1776783328 QHQCKEKCKGWZGF-SFHVURJKSA-N 311.510 5.140 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)C1CCC(F)(F)CC1 340453074 RKGRIPSJVXHHOA-CRAIPNDOSA-N 320.427 5.225 30 20 DKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1csc(Cl)c1 417375576 ZGTVMEFLTMRFRK-BDJLRTHQSA-N 316.857 5.001 30 20 DKED CC[C@H](Nc1cccc(-c2nccs2)c1)c1ccc(C#N)cc1 447602997 UWQRUAKKMUEFPL-SFHVURJKSA-N 319.433 5.245 30 20 DKED N#CCC[C@@H](NC1CC(c2ccc(Cl)cc2)C1)c1ccccc1 544369823 DKNJKNNXJQKKGL-LYBXBRPPSA-N 324.855 5.221 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2nc(-c3ccccc3)cs2)c1 763293364 XKKDCXUWDBZXFI-MDZDMXLPSA-N 323.392 5.154 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(OCC(C)C)cc1)c1ccncc1 766018157 GETHOKUVJQRLBW-UTKZUKDTSA-N 324.468 5.084 30 20 DKED CC(C)(C#N)CCCNc1ccccc1COCc1ccccc1 268601228 SDYKHXCYVJQEQG-UHFFFAOYSA-N 322.452 5.145 30 20 DKED N#CCCC[C@H](NCc1ccc(C2CC2)cc1)c1ccccc1 459598511 WTWLDXKUICFONE-NRFANRHFSA-N 304.437 5.089 30 20 DKED N#Cc1cccc(CSCc2cccc(C(F)F)c2)c1F 479626574 NILHJUYNDMTMNT-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@@H](Nc1ccccc1N1CCCCCC1)c1cccc(C#N)c1 611475862 WCQWELJLYNDPLK-QGZVFWFLSA-N 319.452 5.112 30 20 DKED C[C@@H](Nc1ccccc1N(C)C1CCCC1)c1cccc(C#N)c1 611483225 MRPUGJYHYSIYOI-MRXNPFEDSA-N 319.452 5.110 30 20 DKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc2ccccc12 618806912 SKYPMXGNFAZVLM-OYHNWAKOSA-N 312.416 5.050 30 20 DKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1F 181082278 YEWBZIWERAGRHR-LJQANCHMSA-N 312.388 5.071 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)CC1 191418875 KYNMJASNZASVIN-MRXNPFEDSA-N 314.473 5.192 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 447573707 IRZMBFJRLLFABG-FKBYEOEOSA-N 318.464 5.506 30 20 DKED CC[C@H](NCc1ccc(C2CCC2)cc1)c1ccc(C#N)cc1 447592316 KPLRACDHRWBDGZ-NRFANRHFSA-N 304.437 5.067 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccccc1F)c1ccc(F)c(F)c1 480684641 ULTMXAJULPXDIR-KZULUSFZSA-N 305.343 5.072 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 539051414 ICYSQLPPSPIGTQ-BBRMVZONSA-N 323.358 5.657 30 20 DKED C[C@@H](CC#N)Sc1ccccc1N[C@H](C)c1cccc(C#N)c1 600847430 SHSQCRHFZXDBDU-LSDHHAIUSA-N 321.449 5.126 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1ccccc1 789720344 WGTCIAGHYJMRTK-ICFOKQHNSA-N 319.448 5.581 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccc(C)cc1C 799901096 UCMOCPKNBPCWGE-UHFFFAOYSA-N 310.466 5.231 30 20 DKED CC[C@H](C)c1ccc([C@@H](NCc2ccc(C#N)o2)C(C)C)cc1 236909102 MMVQFQPFPXGXTB-YWZLYKJASA-N 310.441 5.152 30 20 DKED N#Cc1ccc(CN[C@@H]2CCCc3c2sc2ccccc32)s1 421887052 SGMHJNLPKZLKQO-MRXNPFEDSA-N 324.474 5.002 30 20 DKED CC(C)(CCC#N)CNc1ccc(C(C)(C)C(F)(F)F)cc1 428537416 NLECUKNRNGQCRG-UHFFFAOYSA-N 312.379 5.268 30 20 DKED CC[C@H](N[C@H](c1ccccc1C)C1CC1)c1ccc(C#N)cc1 447526556 CXBNMMIZFPNZEV-SFTDATJTSA-N 304.437 5.059 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)C(C)(C)C 476087983 CYSJGDHCSPZIDO-OAHLLOKOSA-N 301.474 5.549 30 20 DKED N#CCCC[C@@H](NCc1ccc2ccccc2c1)c1ccccc1 556908490 RPGJWLONWPLWCG-JOCHJYFZSA-N 314.432 5.365 30 20 DKED CCCCCCC[S@](=O)Cc1nc(-c2ccccc2)cs1 766875391 GPNVESAZIIIKTI-NRFANRHFSA-N 321.511 5.029 30 20 DKED C[C@@H](C=NOCc1ccccc1)c1ccc(C(F)(F)F)cc1 788974921 IGAZIWDBKXCXMT-ZDUSSCGKSA-N 307.315 5.012 30 20 DKED CCCCCCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 916848789 HCFLIFUEZFOFCW-QGZVFWFLSA-N 308.425 5.162 30 20 DKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccccc2)cc1 237587455 JXUZZCWHSJQVEW-KRWDZBQOSA-N 312.416 5.076 30 20 DKED Cc1cc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc(C)c1F 358336083 CBRSIPXGEAFNMY-LPHOPBHVSA-N 310.416 5.138 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC[C@@H](F)C1 424784584 ABQSWJJUFAFQLZ-JKSUJKDBSA-N 303.421 5.005 30 20 DKED C=CCN(Cc1ccc(Cl)s1)Cc1oc(C(C)C)nc1C 428457899 HLKRRHIIHBGKSU-UHFFFAOYSA-N 324.877 5.010 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(C(C)C)CC1 475551562 KKZZMLIARUTNPS-UHFFFAOYSA-N 314.473 5.096 30 20 DKED CC(C)(C)C[C@H](N[C@H](C#N)Cc1ccccc1)c1ccc(F)cc1 610294674 QXNSCJAHVAXPSP-PMACEKPBSA-N 324.443 5.027 30 20 DKED CCSc1ccc(C(=O)/C=C/c2cccc3cnccc23)cc1 782890323 USHJZQAJBJGIKG-DHZHZOJOSA-N 319.429 5.243 30 20 DKED COC1CCC(=NNc2c(Cl)cc(Cl)cc2Cl)CC1 783774018 QAEQUSMMPALKMS-UHFFFAOYSA-N 321.635 5.004 30 20 DKED CC(C)n1nccc1/C=C\C(=O)c1ccc(-c2ccccc2)cc1 794925845 DYJYCRURFOYWCS-SEYXRHQNSA-N 316.404 5.027 30 20 DKED CCCCCCCC(=O)N1CCC[C@@H]1c1ccccc1Cl 113217173 SOVXZRHYBFYOBX-QGZVFWFLSA-N 307.865 5.364 30 20 DKED N#CCCSc1ccccc1NCc1ccc(Cl)cc1F 187492711 UDANULKUUDIJQA-UHFFFAOYSA-N 320.820 5.097 30 20 DKED CC(C)(C#N)CCCCN(Cc1ccccc1)Cc1ccco1 444591612 BUCHSKXLMKGXRF-UHFFFAOYSA-N 310.441 5.002 30 20 DKED CC(C)c1ccc(CSCCCC2(C#N)CCOCC2)cc1 538609071 SBYUYIUQBYOGDL-UHFFFAOYSA-N 317.498 5.144 30 20 DKED CC(C)(C#N)CCCCN1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 548928216 TYAOGVAOAIAGQW-ACDBMABISA-N 310.485 5.117 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1Cl 573858317 FTFZFPQPRCTOEM-BEFAXECRSA-N 312.844 5.426 30 20 DKED Cc1ccsc1/C=C/C(=O)c1c[nH]c2cc(Cl)ccc12 920068887 SQHBEEKYGKDVHE-SNAWJCMRSA-N 301.798 5.087 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)CCC 191513073 ZOZHHNJBSHVPKR-UHFFFAOYSA-N 302.462 5.192 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CC(C)(C)C 476519373 NDGMAXKJZAUQCF-KBPBESRZSA-N 318.486 5.092 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc2[nH]c(C)cc2c1 486489922 QWQNZPCKULIIAB-UHFFFAOYSA-N 322.433 5.007 30 20 DKED CCc1ccc(CNc2ccccc2S[C@H](C)CC#N)cc1 600848412 RMFUKWKYTDOHRJ-OAHLLOKOSA-N 310.466 5.255 30 20 DKED O=C(/C=C/c1nc(Cl)cs1)c1cc2cc(Cl)ccc2o1 759076995 UZEDICPGLFNUFH-DUXPYHPUSA-N 324.188 5.092 30 20 DKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797566522 MIWLBQUZJCEUDM-UONOGXRCSA-N 320.502 5.223 30 20 DKED CSc1ccccc1N=Cc1cc(Cl)cc(Cl)c1O 920943362 WCXVHUSOJXJDOA-UHFFFAOYSA-N 312.221 5.172 30 20 DKED CC1(C)C[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 358337027 DXZIBHCBKYTYNP-VQTJNVASSA-N 304.437 5.044 30 20 DKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(C#N)c1 538396675 XVESLENQHQLYGT-VLIAUNLRSA-N 324.855 5.404 30 20 DKED C=CCC[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccco1 552274874 DUFAYDDACBABOV-HNNXBMFYSA-N 308.381 5.418 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C 605924585 LQMOXKIDAUATPT-UHFFFAOYSA-N 324.424 5.217 30 20 DKED CC(=NNc1ccc(Cl)cc1)c1cccc(-c2ccncc2)c1 741451584 SCQSEVHSNBIJIU-UHFFFAOYSA-N 321.811 5.238 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccsc2)cc1 741468594 FUADHIBARDEWDM-IZZDOVSWSA-N 320.413 5.320 30 20 DKED Cc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)s1 741471624 CGPMFAFGEHETAU-FPLPWBNLSA-N 305.402 5.015 30 20 DKED C[C@H](Nc1ccc(OC2CCCCC2)cc1)c1ccc(C#N)cc1 743476076 DBKXGYCTSJKXFN-INIZCTEOSA-N 320.436 5.443 30 20 DKED C#CC[C@@H](NC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 757778771 QYDBIQQIKNMUIL-LJQANCHMSA-N 320.436 5.005 30 20 DKED Cc1ncsc1C(=O)/C=C/c1sc2ccccc2c1Cl 915987929 NDFQGYWEUUWPOP-VOTSOKGWSA-N 319.838 5.216 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(Cl)nc1)c1ccccc1 181508167 NJWJVGOARZAMSQ-YOEHRIQHSA-N 300.833 5.093 30 20 DKED Cc1cccc(-c2cccc(CNCC(C)(C)CCC#N)c2)c1 462773210 MIIIPYGKGXZKJN-UHFFFAOYSA-N 306.453 5.082 30 20 DKED CC(C)(C)c1ccc(CN[C@H](CCC#N)c2ccccc2)cc1 533496309 HGIWKZQADNWORN-HXUWFJFHSA-N 306.453 5.119 30 20 DKED Oc1ccc(Cl)cc1C=Nc1ccc(SC(F)F)cc1 730546027 MKQNPJSHMKXLBV-UHFFFAOYSA-N 313.756 5.111 30 20 DKED CCc1cccc(Cl)c1C=NNc1ccc(OC)c(Cl)c1 788723616 WNXVBBAKXASLIL-UHFFFAOYSA-N 323.223 5.010 30 20 DKED CC(C)c1nc2cc(N=Cc3cc(Cl)ccc3O)ccc2o1 914703200 QVGBQGULQVXQSJ-UHFFFAOYSA-N 314.772 5.061 30 20 DKED COc1ccc2cc(/C=C/C(=O)c3ccc(C)s3)ccc2c1 917043525 JMYYIOKTAKHSHA-WEVVVXLNSA-N 308.402 5.114 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329114743 SLOMMACHMOJXAG-YXJHDRRASA-N 323.440 5.271 30 20 DKED CCc1ccc(CCNc2ccccc2S[C@@H](C)CC#N)cc1 462235499 VHCWJKCORFWJAF-INIZCTEOSA-N 324.493 5.298 30 20 DKED CC(C)(C#N)c1ccc(CN[C@H](c2ccccc2)C(C)(C)C)cc1 614171102 VAUVZTKDKOXHTN-HXUWFJFHSA-N 320.480 5.365 30 20 DKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2)c(C)c1 499732849 QMSYWPNYGXSUCU-AWEZNQCLSA-N 324.449 5.010 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(-c2ccccc2)cc1C 605910376 SNUVQJFTLLBLQL-UHFFFAOYSA-N 308.425 5.092 30 20 DKED Cc1ccc(C(C)C)c(OC(=O)C[C@H](CC#N)c2ccccc2)c1 796627976 AEGOQROVCBPKKA-SFHVURJKSA-N 321.420 5.111 30 20 DKED COc1ccc2cc(N[C@@H](C)c3ccc(C#N)c(F)c3)ccc2c1 797022452 QWYNYWGETXMZKN-ZDUSSCGKSA-N 320.367 5.032 30 20 DKED N#CCCSc1ccccc1NCc1ccc(C(F)F)cc1 185620784 ZIUBKBDKSCDGJB-UHFFFAOYSA-N 318.392 5.242 30 20 DKED CCC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccsc1 340447180 PFEJFBYZNMPECX-MOPGFXCFSA-N 312.482 5.614 30 20 DKED C=CCCCC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 479543784 OWQFSRPUVNYKKX-INIZCTEOSA-N 308.425 5.155 30 20 DKED CCCc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 537951263 GXSNQNHASCLMFK-DYESRHJHSA-N 306.453 5.335 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccoc1)c1ccc(C(F)(F)F)cc1 540149039 LJYGTFHFXZCRMB-GUYCJALGSA-N 323.358 5.657 30 20 DKED CCCCC[C@H](C)CC(=O)Nc1ccccc1SCCC#N 742648816 CVYUAMUIMPMKOU-HNNXBMFYSA-N 318.486 5.237 30 20 DKED CC(C)(C)OC(=O)N1c2ccccc2Sc2ccc(C#N)cc21 2090611527 IRFWDEXYUDBNSN-UHFFFAOYSA-N 324.405 5.096 30 20 DKED N#CC1(c2ccccc2)CCC(Nc2ccc3ccoc3c2)CC1 443082333 ACDXOYMROUJZOC-UHFFFAOYSA-N 316.404 5.249 30 20 DKED C[C@H](N[C@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 541176032 OTBOZNDPBIFHNC-JKSUJKDBSA-N 316.404 5.230 30 20 DKED N#CCc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)cc1 541327985 KXPDRFHQQMECLK-HXUWFJFHSA-N 324.855 5.037 30 20 DKED C=CCCCCCN(C)[C@@H](C)c1nc2ccccc2n1C(F)F 579767773 YIXDAILXDLQHBS-AWEZNQCLSA-N 321.415 5.171 30 20 DKED Cc1cc(Sc2ccccc2)ccc1NC(=O)CCCCC#N 593967802 DTAXNJZALLOWMW-UHFFFAOYSA-N 324.449 5.169 30 20 DKED CC[C@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 609427791 LRGQCFLMCKDSOC-HUUCEWRRSA-N 318.486 5.092 30 20 DKED CCSc1ccccc1[C@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618807751 WHLOPGPBXMESGG-IFXJQAMLSA-N 322.477 5.008 30 20 DKED CCCCCC[C@H](C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 741900870 XKEQDYHKSLKUEF-IRXDYDNUSA-N 314.473 5.074 30 20 DKED FC(F)(F)c1ccccc1ON=C[C@@H]1CCCc2ccccc21 754709664 MTNLVGLVSRYLQK-AWEZNQCLSA-N 319.326 5.190 30 20 DKED Cc1cc(C)c(C=NOc2ccccc2C(F)(F)F)cc1C 754725612 XSIPVOWZRGBRRS-UHFFFAOYSA-N 307.315 5.044 30 20 DKED O=C(/C=C\c1ccc(Cl)s1)c1c(F)cccc1Cl 809159472 PYBVUCLCHINTLN-XQRVVYSFSA-N 301.169 5.090 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C(C)=C/c1ccco1 846994797 VYKQONOZVORCAU-FYWRMAATSA-N 309.409 5.174 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccccc1 191386078 KGPJINPKRWEOMW-OXQOHEQNSA-N 311.473 5.131 30 20 DKED CC(C)(C#N)CCCCSCc1csc(-c2ccco2)n1 435882003 CXRABCOJAHOPCS-UHFFFAOYSA-N 320.483 5.356 30 20 DKED C=CCOc1ccc(CN[C@@H](CC)c2ccc(Cl)s2)cc1 512219756 RUAWPWMJCGXSNP-HNNXBMFYSA-N 321.873 5.207 30 20 DKED C[C@H]1[C@@H](c2ccccc2)C[C@H]1N[C@@H](CCCC#N)c1ccccc1 559861671 CEAFVAWGUBJPGE-AGOPTVSRSA-N 318.464 5.203 30 20 DKED CCC(CC)(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 610756527 NHXYPXSIQJSGOO-CQSZACIVSA-N 318.486 5.093 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\C1CCCCC1 789718413 BPCLMEYIPNMXCA-PFONDFGASA-N 311.469 5.614 30 20 DKED C[C@H](OC(=O)CCCCCC#N)c1cc(Cl)ccc1Cl 805698226 XQBQKURKWWCIKO-NSHDSACASA-N 314.212 5.072 30 20 DKED CC(=NNc1ccccc1F)c1cc(Cl)sc1Cl 812460612 WTDLFBMZNOBXRA-UHFFFAOYSA-N 303.189 5.030 30 20 DKED Cc1nc(S[C@@H](C)c2cccc(C#N)c2)[nH]c1-c1ccccc1 442906580 IAPDHEKALHQWJV-AWEZNQCLSA-N 319.433 5.110 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)C(CC)CC 476090847 NBJHJZXLMYFJGG-HNNXBMFYSA-N 301.474 5.549 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccco1 529137248 QELZPXSBQJIFEJ-OAHLLOKOSA-N 311.425 5.264 30 20 DKED CC(C)(C)[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1 563330072 JQACLYQMAXVVNU-PMACEKPBSA-N 322.427 5.062 30 20 DKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(C)s2)cc1 765025448 KNFVDSAUEBLOJZ-CQSZACIVSA-N 321.873 5.039 30 20 DKED CCCCCCCC(=O)Nc1ccc(-c2nccs2)cc1 884745501 GAIYGMOHCDMBKY-UHFFFAOYSA-N 302.443 5.109 30 20 DKED CCCCCCCCCC(=O)[C@@H](C#N)c1nc2ccccc2o1 917510117 OMXQPEICYCBUAI-OAHLLOKOSA-N 312.413 5.145 30 20 DKED N#Cc1csc(CNc2ccc(SC3CCCC3)cc2)c1 93686610 SYWADCQWVSVHLU-UHFFFAOYSA-N 314.479 5.267 30 20 DKED CC(C)[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 315134032 CHRKXMLOTVSWJK-AUUYWEPGSA-N 312.844 5.260 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)C(c1ccccc1)c1ccccc1 578803601 IGVHAYJFGTYBAM-GOSISDBHSA-N 320.480 5.127 30 20 DKED N#Cc1ccccc1-c1ccc(CSCCC(F)(F)F)cc1 610137209 JDNARYHTTGYBLP-UHFFFAOYSA-N 321.367 5.411 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1C1CCCC1 649956435 SCACAJJVPBUJSC-MOPGFXCFSA-N 311.469 5.303 30 20 DKED C=CC[C@H](N[C@@H](CC)c1cccc(Cl)c1)c1ccncc1 746048273 ZVZWYMVIAUZQQA-ROUUACIJSA-N 300.833 5.093 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C\c1coc(-c3ccccc3)n1)C2=O 766695355 KJKHHIPFRGRMFB-BGARDKSCSA-N 315.372 5.033 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2[nH]1 926481582 UUQRBMFIKVNZHD-LPHOPBHVSA-N 317.436 5.254 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 186452845 IHRPWESFPNWUJI-ZBEGNZNMSA-N 322.424 5.006 30 20 DKED CC[C@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 560563616 BJWRWYYRKWIYPJ-NQIIRXRSSA-N 306.453 5.205 30 20 DKED CCC/C(C)=C/C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 920225388 YUPJQACMQYQCAK-FYWRMAATSA-N 320.392 5.035 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1Cl 90665434 XHURBAOTQHWREO-ACJLOTCBSA-N 316.807 5.175 30 20 DKED Cc1ccc2nc(/C=C\c3ccc(O[C@H](C)C#N)cc3)ccc2c1 208259587 JWHVUCIFJXERBK-LWAXHKBTSA-N 314.388 5.005 30 20 DKED CCC[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1 341752985 ZOGPTDQNHIIPBN-SFTDATJTSA-N 304.437 5.067 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[S@](=O)CCC1(C#N)CCCCC1 414238803 KLZJDDBXRHLJCG-LHSJRXKWSA-N 323.889 5.014 30 20 DKED C=CC(C)(C)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 448857147 PEPBAZCZTMYLJE-OAHLLOKOSA-N 308.425 5.010 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)cc1 520294066 QFHJZWFCDIWMST-JLTOFOAXSA-N 322.477 5.008 30 20 DKED CCCCCCC[C@H](NCc1snnc1C)c1ccccc1 813883583 FIJVQSVUKRHIOW-KRWDZBQOSA-N 317.502 5.038 30 20 DKED N#CCCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 515359654 ZNYZFLDTAUQCPH-QGZVFWFLSA-N 301.842 5.466 30 20 DKED C=CCC[C@H](NCc1cc2c(s1)CCCC2)c1ccco1 552040232 NZSUOAMVJFBIRF-INIZCTEOSA-N 301.455 5.017 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)oc2c1 617304721 YFDAHQPXRRDGBZ-LSDHHAIUSA-N 304.393 5.025 30 20 DKED CCCCC[C@@H](C)CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 742575302 DRCDQJNDJYXBTM-IAGOWNOFSA-N 314.473 5.074 30 20 DKED C#CCCCNc1ccc(Oc2ncc(Cl)cc2Cl)cc1 766727063 XYMQMBLHDKYPMQ-UHFFFAOYSA-N 321.207 5.006 30 20 DKED C#CC[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccccc1 773116175 QDRAYGBFHYTTQH-KSSFIOAISA-N 317.354 5.121 30 20 DKED C[C@H](N[C@@H](C)c1csc2ccccc12)c1ccc(C#N)c(F)c1 776739080 LPVMAZKGIQKCOH-STQMWFEESA-N 324.424 5.324 30 20 DKED CC(C)(C)c1ccccc1NC(=O)Nc1ccc(CCC#N)cc1 929192523 ZTAAQQWSJZGHTK-UHFFFAOYSA-N 321.424 5.084 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CCC[C@H]1CC2 372771842 IAPMJDCWRJDNOT-IRXDYDNUSA-N 312.457 5.087 30 20 DKED Cc1ccc(-c2cc(CSCCCC(C)(C)C#N)on2)cc1 480411901 PFZOFVFVIJGXJZ-UHFFFAOYSA-N 314.454 5.213 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1cccs1)C1CC1 481911115 DCRIQPXPFYRVAG-QUCCMNQESA-N 322.477 5.128 30 20 DKED C=CCn1cccc1C(=O)Nc1c(C(C)C)cccc1C(C)C 490069539 CHVQXGJOWMVIKG-UHFFFAOYSA-N 310.441 5.173 30 20 DKED CO[C@@H](CSCCCC(C)(C)C#N)c1ccc(Cl)cc1 509130997 DHIUFZYOZGWSLG-HNNXBMFYSA-N 311.878 5.091 30 20 DKED CSc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(C#N)cc1)CCC2 519829959 VRPUIJZJWWUNGL-VLIAUNLRSA-N 322.477 5.008 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@H](C)c1cccc(C#N)c1 600848816 JSRBITDQVKTVQV-MRXNPFEDSA-N 324.493 5.681 30 20 DKED CSCCc1ccccc1NCc1ccccc1C(C)(C)C#N 600857863 JRTWZTPVCIYCJP-UHFFFAOYSA-N 324.493 5.005 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618803814 IXGYXCAGWTUHBP-JLTOFOAXSA-N 322.477 5.008 30 20 DKED C=CC[C@@H](N[C@H](C)c1oc2ccccc2c1CC)c1ccncc1 776155301 FYWMWUSAFKIAPI-DNVCBOLYSA-N 320.436 5.358 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[S@](=O)CCCCC1(C#N)CCC1 899276066 HYBNHWNWZOKJHL-LHSJRXKWSA-N 323.889 5.014 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1C[C@H]2CC[C@H]1C2 476076470 AWZYEKQJLQRVBS-RYQLBKOJSA-N 311.469 5.303 30 20 DKED C=C1CCN([C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 477302971 OFVBOODPZARMKP-CQSZACIVSA-N 316.832 5.016 30 20 DKED CC(C)=CCC/C(C)=C\C=NNc1cccc(C(F)(F)F)n1 739422723 XREUGOBRWQPRFZ-RUCWUFRFSA-N 311.351 5.191 30 20 DKED CCCCCCCC[C@@H](C)C(=O)N1CCC[C@@H]1c1cc(C)on1 820893025 FAYFOVDJLBKYTF-CRAIPNDOSA-N 320.477 5.033 30 20 DKED CCC/C(C)=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 920322880 BZABHIBBFLJUOE-DNXIFWLFSA-N 324.449 5.041 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC(C)(C)C 276383777 HBPGKASRLQIPBG-UHFFFAOYSA-N 302.462 5.048 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329550541 CQVQYPNTYWJJIB-ARFHVFGLSA-N 323.440 5.271 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C2CC2)c1 340445484 DUDDDBYHASELKJ-HTAPYJJXSA-N 318.464 5.650 30 20 DKED CC1(C)Cc2occc2[C@H](N[C@@H](CCCC#N)c2ccccc2)C1 340450322 XDFQLJIPGFWDOQ-RBUKOAKNSA-N 322.452 5.318 30 20 DKED C=CC[C@H]1N(C(=O)Nc2ccccc2C(F)F)CCCC1(C)C 425702636 MYZYDGNYRAUZHF-OAHLLOKOSA-N 322.399 5.223 30 20 DKED CC[C@@H](N[C@@H](C)c1cc2ccccc2o1)c1ccc(C#N)cc1 447517592 SWQTUIIFNSSMAQ-KBXCAEBGSA-N 304.393 5.106 30 20 DKED CC#CCCCC(=O)Nc1ccc(S[C@H](C)CC)cc1C 464643063 KZHUUEDMIIQYIZ-OAHLLOKOSA-N 303.471 5.018 30 20 DKED Cc1ccc(-c2cccnc2)cc1N[C@H](C)c1ccc(C#N)cc1 479846471 IYIRGXRNMWDFSV-MRXNPFEDSA-N 313.404 5.102 30 20 DKED CC(C)[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1 502499741 HNCBQODIXSXNEC-FQEVSTJZSA-N 324.443 5.114 30 20 DKED CSc1ccc(Cl)cc1N[C@H](C)c1ccc(C#N)cc1 537532788 ZMWMTZHIDOFIIP-LLVKDONJSA-N 302.830 5.107 30 20 DKED CCC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1F 538396218 WQVWKFQVZHZDRJ-ORAYPTAESA-N 314.379 5.028 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 539051415 ICYSQLPPSPIGTQ-CJNGLKHVSA-N 323.358 5.657 30 20 DKED CC(C)C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccs1 539608471 MRPBJDJDILUNOJ-DYVFJYSZSA-N 316.445 5.197 30 20 DKED C=CC[C@H](C(=O)Nc1ccc(OC(C)C)cc1C)c1ccccc1 548610615 DMAMVSSIFVBMKY-IBGZPJMESA-N 323.436 5.081 30 20 DKED CC(C)(CCC#N)CN[C@H](Cc1ccccc1F)c1ccccc1 574185274 RTQFXLBPPSCAFW-HXUWFJFHSA-N 324.443 5.029 30 20 DKED Cc1cc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)c(C)s1 736432603 BDADXBDYYZKCSB-VOTSOKGWSA-N 305.468 5.015 30 20 DKED N#Cc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)s1 762437116 BYKXFGWMVKLDIM-VURMDHGXSA-N 321.426 5.244 30 20 DKED CCCC(=CC(=O)Nc1ccccc1SCCC#N)CCC 770727037 WHWBFNFWJGMDOI-UHFFFAOYSA-N 316.470 5.157 30 20 DKED CC(C)(CCC#N)CN(Cc1cccs1)Cc1cccs1 120091512 TWKUOKDAXJDZRJ-UHFFFAOYSA-N 318.511 5.142 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1cccs1 505058619 XVKZUYZSSPFLOA-AWEZNQCLSA-N 314.454 5.092 30 20 DKED C=CC[C@H](N[C@@H](CCC)c1ccc(Cl)cc1)c1ccncc1 766021871 VFXPTDFHQOZHLT-OALUTQOASA-N 314.860 5.483 30 20 DKED C[C@H](CCc1ccsc1)N[C@H](CCCC#N)c1ccccc1 340446447 OUAUTXIUKZLXNO-VQIMIIECSA-N 312.482 5.094 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1cccnc1 356221468 RBNHKUVPUKBVMW-INIZCTEOSA-N 322.452 5.066 30 20 DKED C[C@@H]1CC[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 358350165 ZOUIISCCCSQVPI-MAODMQOUSA-N 304.437 5.260 30 20 DKED CC(C)(C#N)CCCSCCOc1ccc2ccccc2c1 480412136 PNAHYSYSORRPGP-UHFFFAOYSA-N 313.466 5.282 30 20 DKED CC(/C=C\c1ccncc1C#N)=C\c1cccc(C(F)(F)F)c1 486144528 GDXOZTFSKMBLDR-PWYSQUBCSA-N 314.310 5.089 30 20 DKED CC(C)(C)[C@H](NCc1cccc(C#N)c1)c1cc2ccccc2o1 497807594 CWKCRLVURFIVNZ-HXUWFJFHSA-N 318.420 5.181 30 20 DKED C[C@H](NCCCCC#N)c1ccccc1-c1ccc(Cl)cc1 538215952 VWRDBFZYPVFHMT-HNNXBMFYSA-N 312.844 5.351 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccsc1Cl 594704867 GGGMJZIDDRMNAL-NSHDSACASA-N 322.886 5.265 30 20 DKED CCC[C@@H](Nc1ccc(CCC#N)cc1)c1ncccc1Cl 926887704 AWACZJKGVIBWGY-QGZVFWFLSA-N 313.832 5.144 30 20 DKED Cc1c([C@H](C)N[C@H](CCC#N)c2ccccc2)oc2ccccc12 90665258 GTIAEBHWVBXECV-QFBILLFUSA-N 318.420 5.437 30 20 DKED CC(/C=C\c1ccc(C#N)cn1)=C/c1ccccc1C(F)(F)F 443442417 CRMNHQRDHLDVJZ-RXTIBHSBSA-N 314.310 5.089 30 20 DKED N#Cc1ccc(NC(=O)c2ccc(C3=CCCC3)cc2)c(Cl)c1 464129148 DJRLAQRNMVWLIZ-UHFFFAOYSA-N 322.795 5.031 30 20 DKED CC(C)(C#N)CCSCc1coc(-c2ccc(Cl)cc2)n1 564112544 FHCWOFQJARUMLA-UHFFFAOYSA-N 320.845 5.168 30 20 DKED Cc1cc(-c2ccccc2)ccc1N[C@H](C#N)Cc1ccccc1 603585144 ODMJRVRXWHBOCY-NRFANRHFSA-N 312.416 5.209 30 20 DKED C=CC[C@@H](N[C@H](C)c1cccc2ccccc12)c1ccncc1 749130085 WDKGQLSDNQGGHQ-IIBYNOLFSA-N 302.421 5.203 30 20 DKED C=CC[C@H](N[C@H]1C[C@@H](C(C)C)c2ccccc21)c1ccncc1 774185409 BOQJGSIOXFLXCI-ACRUOGEOSA-N 306.453 5.173 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nccc2ccccc12 792106441 QRUPHTHWHTWYPZ-CRAIPNDOSA-N 308.425 5.018 30 20 DKED CC[C@@H](NCc1cccc(C#N)c1F)c1cccc2ccccc12 794830101 YKEPXGDQCFKJTL-HXUWFJFHSA-N 318.395 5.091 30 20 DKED C=C(C)CN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 471175906 IWHMHRORSLXXHR-KRWDZBQOSA-N 310.441 5.178 30 20 DKED C=CCCc1ccccc1NC(=O)N[C@H](CC)c1cccs1 505034436 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N#Cc1cc(F)ccc1N[C@H](c1ccccc1)c1ccc(F)cc1 325286155 VLRDBVKHLFZQHG-HXUWFJFHSA-N 320.342 5.038 30 20 DKED C[C@@H]1CC[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340450314 XCKMQWNCMOBDBP-VOQZNFBZSA-N 318.464 5.650 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340457950 WZOWFEXZRXADTB-AUUYWEPGSA-N 314.379 5.051 30 20 DKED C[C@@H](S[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C#N)c1 443159500 AUIWOPDHKKVXFE-CHWSQXEVSA-N 312.394 5.022 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1cc(F)ccc1F 447588541 URPWUNGCFZYAGD-MOPGFXCFSA-N 314.379 5.028 30 20 DKED C[C@H](NCCCC(C)(C)C#N)c1ccc(Cl)c2ccccc12 462454067 GICJLLPMCUDYCY-AWEZNQCLSA-N 314.860 5.474 30 20 DKED CC[C@H](C)[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462759498 CRJGTIFLWLEIRJ-LIRRHRJNSA-N 312.844 5.089 30 20 DKED CC(C)c1ccc(NC(=O)c2ccc(C#N)s2)c(C(C)C)c1 486818762 IECUBYACOWRTTN-UHFFFAOYSA-N 312.438 5.119 30 20 DKED C=CCC[C@H](Nc1cccc(OCCCC#N)c1)c1ccco1 563555965 SAVNMXXDEDOQRS-SFHVURJKSA-N 310.397 5.082 30 20 DKED Cc1cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc(C)c1F 572189481 UMMXCZHHOGRDAD-XLIONFOSSA-N 324.443 5.528 30 20 DKED N#Cc1ccccc1SCc1c(Cl)ccc2cccnc12 581856834 RRLZSBGAUYGDMI-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H](C#N)CSc1ccccc1NC[C@@H]1CCCCC1(F)F 594706015 RZQVDCDKQSBLJG-KBPBESRZSA-N 324.440 5.176 30 20 DKED CCC(CC)(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 610756526 NHXYPXSIQJSGOO-AWEZNQCLSA-N 318.486 5.093 30 20 DKED CCCCCCCC(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F 728499875 YVMURHXHKNJPKQ-INIZCTEOSA-N 315.379 5.109 30 20 DKED Cc1oc(-c2ccsc2)nc1CSCCCC(C)(C)C#N 161698501 JSSUJNYQZGYJPP-UHFFFAOYSA-N 320.483 5.275 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cc(C)ccc1Cl 485497911 YGOUEPZNEQOEEU-UHFFFAOYSA-N 317.841 5.179 30 20 DKED C[C@@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 537296920 YAIBBZFGQLEHRC-KUHUBIRLSA-N 310.416 5.135 30 20 DKED CCCCCCCCC(=O)N(C)[C@H]1CCCc2nc(C)sc21 732036214 RVPZCRVYAKSEHA-INIZCTEOSA-N 322.518 5.038 30 20 DKED COCc1ccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1 741840249 LROPIRLJENJUEH-TWGQIWQCSA-N 321.203 5.036 30 20 DKED O=C(/C=C\c1ccc(Cl)c(Cl)c1)c1cc(F)ccc1F 916133415 MKWSLCMQYGKXLM-KXFIGUGUSA-N 313.130 5.168 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1ccc(C(C)=O)cc1 918542199 UVAXKCXYEFXLCX-UHFFFAOYSA-N 318.461 5.104 30 20 DKED CCc1ccc(CCNc2ccccc2SC[C@H](C)C#N)cc1 462236788 MEBXINFEVWIESE-MRXNPFEDSA-N 324.493 5.155 30 20 DKED Cc1noc(C)c1-c1ccc(OCCC2(C#N)CCCCC2)cc1 514663272 OGEOKDZKCGWHSK-UHFFFAOYSA-N 324.424 5.201 30 20 DKED C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)c1ccc(C#N)cc1 561454072 DOSRVHVRFZLMAN-QVKFZJNVSA-N 322.427 5.279 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 578562907 CWEFZKUSIAARCS-UTKZUKDTSA-N 306.453 5.506 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 734079481 QJOFDEXUNVHVOA-FUHWJXTLSA-N 320.436 5.018 30 20 DKED CC(C)(C#N)CCCNc1ccc([C@H](F)C(F)(F)F)cc1 902132169 YTURDIYMIQTCHY-ZDUSSCGKSA-N 302.315 5.001 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cccc(C#N)c1 7668619 KVPWVVUIFBJVBC-UHFFFAOYSA-N 306.409 5.057 30 20 DKED Cc1ccc(C[C@H](C#N)Sc2cc(C)c3ccccc3n2)cc1 60697462 UNTMGVLCZRXTKI-QGZVFWFLSA-N 318.445 5.079 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccsc1 189886808 MQEAEGBZJYEFCF-UHFFFAOYSA-N 313.466 5.171 30 20 DKED N#Cc1ccc(CNc2ccc(Oc3ccccc3)cc2)c(F)c1 323864782 PWKVCVFEZIUOTC-UHFFFAOYSA-N 318.351 5.102 30 20 DKED CC(C)c1ccoc1/C(O)=N/[C@H](C)c1nc(C(C)(C)C)cs1 330476104 GYRQLFXFKZIGOL-LLVKDONJSA-N 320.458 5.223 30 20 DKED CC[C@@H](NCc1ccc(C2CCC2)cc1)c1ccc(C#N)cc1 447592317 KPLRACDHRWBDGZ-OAQYLSRUSA-N 304.437 5.067 30 20 DKED Cc1cccc2nc(N[C@H](CCC#N)c3ccccc3)sc12 480079572 CFBIHAKJOKCLGM-OAHLLOKOSA-N 307.422 5.062 30 20 DKED C[C@H](Sc1ncc(Cl)cc1Cl)c1ccc(C#N)cc1 609825858 XRWTYOMMKLMOEB-VIFPVBQESA-N 309.221 5.113 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@@H](CC1CC1)c1ccccc1 611395365 HZFWRXQBTQDLQL-NRFANRHFSA-N 318.464 5.119 30 20 DKED CC(C)(c1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1)C(F)(F)F 618577822 LOXHIDDRLUYIDF-DOMZBBRYSA-N 310.363 5.021 30 20 DKED C=C(C)CN(CC)C(=O)Nc1cccc(CSC(C)C)c1C 173872036 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5.264 30 20 DKED CCCCCCCCCC(=O)N1CC(C)(C)[C@@H]1c1ccncc1 817174565 AEDIFHRGJRYFGE-IBGZPJMESA-N 316.489 5.132 30 20 DKED C[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1 36991838 DGXHVGVHVRCKRD-NWDGAFQWSA-N 319.235 5.277 30 20 DKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1 79724172 GLRHAJSNXXIGCT-IBGZPJMESA-N 312.388 5.071 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCCC 189900244 ROKHHQMDXMYSTM-OAHLLOKOSA-N 319.514 5.399 30 20 DKED C[C@@H](Nc1cc(Cl)c(F)c(Cl)c1)c1cccc(C#N)c1 232026604 CMESXASVQQICRC-SECBINFHSA-N 309.171 5.177 30 20 DKED Cc1cccc2c1[C@H](C)C[C@H]2N[C@H](CCC#N)c1ccccc1 246556495 WYYDKHJKBASRAL-NSISKUIASA-N 304.437 5.178 30 20 DKED CC1=C(/C(O)=N/[C@H](C#N)c2cccc(Cl)c2Cl)CCC1 330560223 BDVBLCMDLJHYNP-CYBMUJFWSA-N 309.196 5.015 30 20 DKED CC1(C)Cc2occc2[C@@H](N[C@H](CCCC#N)c2ccccc2)C1 340450318 XDFQLJIPGFWDOQ-MOPGFXCFSA-N 322.452 5.318 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1sccc1Cl 453089269 NQRJLCWIGNTTDB-NSHDSACASA-N 322.886 5.265 30 20 DKED CCCc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550834682 BXDZVJCNLVUDDN-GCJKJVERSA-N 320.480 5.725 30 20 DKED CC(C)[C@@H]1C[C@H](NC2(c3cccc(C#N)c3)CC2)c2ccccc21 576486432 NVCCATHOAFVHEY-SFTDATJTSA-N 316.448 5.022 30 20 DKED CC(C)c1ccc([C@H](NCc2cccc(C#N)c2)C(C)C)cc1 611567108 VBIRSDYBEMXNSV-OAQYLSRUSA-N 306.453 5.169 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc2ccccc2c1)c1ccncc1 749128824 MCHIULFMRKQWNC-KKSFZXQISA-N 302.421 5.203 30 20 DKED Cc1ccc(-c2nc(/C=C3/C(=O)c4ccccc4[C@H]3C)co2)cc1 809156894 OPUIOJLTZAUUDK-HIPSJFSSSA-N 315.372 5.033 30 20 DKED CCCCCC1=C(C)CCC1=NNc1nncc2ccccc12 915909447 IARYPLFJLAEROC-UHFFFAOYSA-N 308.429 5.088 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(F)ccc1F 90665045 WYROQJWSMBVVCE-OALUTQOASA-N 314.379 5.051 30 20 DKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(C)c1 323721803 KZYCVJVFGMJTBQ-HXUWFJFHSA-N 308.425 5.241 30 20 DKED C[C@@H](CCc1ccsc1)N[C@@H](CCCC#N)c1ccccc1 340446445 OUAUTXIUKZLXNO-LPHOPBHVSA-N 312.482 5.094 30 20 DKED C=CC(C)(C)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 448857146 PEPBAZCZTMYLJE-HNNXBMFYSA-N 308.425 5.010 30 20 DKED C=CCOc1cccc(CN[C@H](CC)c2ccc(Cl)s2)c1 512220638 XCKGNUSCOTYGDU-OAHLLOKOSA-N 321.873 5.207 30 20 DKED C/C=C/c1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 554117189 BVAWOYOAZGLVLF-SNAWJCMRSA-N 319.408 5.165 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CCCC 567315140 DGKCWQHZVXLXLP-INIZCTEOSA-N 316.489 5.581 30 20 DKED Cc1ccc(C(=O)/C=C\c2cccc(-c3ccccn3)c2)s1 747695980 OHDBANGBTKWDHH-KTKRTIGZSA-N 305.402 5.015 30 20 DKED C[C@H](SCCC(Cl)(Cl)Cl)c1cccc(C#N)c1 785536986 LYCCJAYUMFEDKH-VIFPVBQESA-N 308.661 5.113 30 20 DKED CCCCCCCC[C@@H](C)C(=O)Nc1c(C)noc1C1CC1 832017498 LONVOZOCKMAODV-CYBMUJFWSA-N 306.450 5.186 30 20 DKED O=C(/C=C\c1ccc(O)cc1)c1ccc(-c2ccc(F)cc2)s1 844255448 CGMDYMDPFLJCBJ-KMKOMSMNSA-N 324.376 5.156 30 20 DKED C=CCOc1ccc(/C=C(\Cl)c2nc3ccccc3o2)cc1 18065195 PRJWZYIZQIARFT-QINSGFPZSA-N 311.768 5.130 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1 537297611 YXZPRVQEXHBYIE-IERDGZPVSA-N 304.437 5.140 30 20 DKED C[C@@H](CCc1ccccc1F)N[C@H](CCCC#N)c1ccccc1 568116559 FWXCFEUHKAJVSP-LAUBAEHRSA-N 324.443 5.172 30 20 DKED N#CCCCCCc1nc(-c2ccc(-c3ccccc3)cc2)no1 588321328 BWPMXADIDCBHBB-UHFFFAOYSA-N 317.392 5.030 30 20 DKED CCSc1ccc(Cl)cc1NCc1cccc(F)c1C#N 600847054 OZPVHCUSUVUFGM-UHFFFAOYSA-N 320.820 5.075 30 20 DKED C[C@H](SCCOC1CCCCCC1)c1ccc(C#N)cc1 610137276 QIZHOCALKBVHEZ-HNNXBMFYSA-N 303.471 5.092 30 20 DKED Cc1ccc(F)c(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745990534 STUGVJAWSLRETE-CLFYSBASSA-N 317.363 5.092 30 20 DKED CC(C)(CC(=O)[C@H](C#N)c1nc2ccccc2o1)C1CCCCC1 796651905 BGVYRIDOFOMWTK-HNNXBMFYSA-N 324.424 5.001 30 20 DKED CC(C)[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1 195656689 LVYJNOMCEUEWKM-FQEVSTJZSA-N 308.425 5.178 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccccc21 475571133 DXNYDRHNLJNFNH-UHFFFAOYSA-N 320.436 5.133 30 20 DKED Cc1cc(Sc2ccccc2)ccc1NC(=O)CC(C)(C)C#N 486049368 CWCBTVJPRBBDOA-UHFFFAOYSA-N 324.449 5.025 30 20 DKED C/C(=C/c1ccccc1)CN[C@H](CCCC#N)c1ccccc1 577166470 DFQDYQNKLNOFHQ-VUANCPLDSA-N 304.437 5.115 30 20 DKED CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)CCCCCC#N 588925573 ZTGQSUUBMXQYOM-IBGZPJMESA-N 314.473 5.096 30 20 DKED CC(C)[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1 611390406 XXCDBFRIERQTFF-RTWAWAEBSA-N 322.427 5.062 30 20 DKED CCCCCCCCSc1nnc(Cc2cccs2)o1 727268560 QEDSEYJKVLHRGL-UHFFFAOYSA-N 310.488 5.175 30 20 DKED N#Cc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)s1 762437110 BYKXFGWMVKLDIM-SOFGYWHQSA-N 321.426 5.244 30 20 DKED CCCCCCC[C@@H](NCc1snnc1C)c1ccccc1 813883589 FIJVQSVUKRHIOW-QGZVFWFLSA-N 317.502 5.038 30 20 DKED Cc1ncsc1C(=O)/C=C\c1sc2ccccc2c1Cl 915987920 NDFQGYWEUUWPOP-SREVYHEPSA-N 319.838 5.216 30 20 DKED CCCCCCCCCN(C)C(=O)c1cncc2ccccc12 918398106 VHZYBLUYQSPAHU-UHFFFAOYSA-N 312.457 5.057 30 20 DKED Cc1ccc([C@@H](C)Nc2ccc(C#N)cc2C(F)(F)F)s1 36973690 LMVBGDIMEOOOBK-SNVBAGLBSA-N 310.344 5.120 30 20 DKED C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 37220683 BDPYDSDDHHMMKF-RYUDHWBXSA-N 319.235 5.277 30 20 DKED CCCCCCCCCCCCCCCCCC[C@@H](C)CC 90134029 OSJUENOXPFOHLF-QFIPXVFZSA-N 310.610 8.684 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H](C)CC 191417027 XUEVHFMNCWDZEN-OAHLLOKOSA-N 302.462 5.048 30 20 DKED CCC(CC)n1ccc(CSCCCCC(C)(C)C#N)n1 435885725 NNMANNUKXPONKA-UHFFFAOYSA-N 307.507 5.197 30 20 DKED C=CCC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccccc1 447589612 YOCMKPLJPRKMAC-RTWAWAEBSA-N 304.437 5.306 30 20 DKED C=CCC[C@@H](NCc1ccn(C(CC)CC)n1)c1ccccc1 537157592 NVJLRKSQIIIDNP-HXUWFJFHSA-N 311.473 5.041 30 20 DKED CC[C@@H](C)[C@H](NCc1ccc(C#N)s1)c1ccc(Cl)cc1 537328809 FWKRBXDRIJIJES-PXAZEXFGSA-N 318.873 5.150 30 20 DKED C=CCC[C@@H](NCc1oc2ccc(F)cc2c1C)c1ccco1 560530679 REYSKTZJEBBEMD-MRXNPFEDSA-N 313.372 5.270 30 20 DKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1 618806385 QTTQRGYEYYVWKO-OYHNWAKOSA-N 312.416 5.050 30 20 DKED Cc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)s1 727974871 QTFJVIGKBHIDSU-NTMALXAHSA-N 311.431 5.076 30 20 DKED O=C(/C=C\c1c(Cl)oc2ccccc12)c1ccc2c(c1)COC2 761205534 OIDNENNIBWDCKC-FPLPWBNLSA-N 324.763 5.013 30 20 DKED CCSc1ccccc1[C@H](C)N[C@H](CCC#N)c1ccccc1 90664724 NRVPSTWCRQWPHV-QFBILLFUSA-N 324.493 5.494 30 20 DKED O=C1/C(=C\c2csc(-c3cccs3)n2)CCc2ccccc21 209743008 WSBZMVRAYYPMAP-RAXLEYEMSA-N 323.442 5.084 30 20 DKED N#Cc1ccc(-c2csc(-c3ccc(Cl)s3)n2)cc1 384350190 DQTKUKQWIPLEJP-UHFFFAOYSA-N 302.811 5.064 30 20 DKED N#C[C@H]1CC[C@H](Nc2cccc(CSCc3ccccc3)c2)C1 442852762 IHEYTWKPMIHZQK-PXNSSMCTSA-N 322.477 5.224 30 20 DKED C=CCC[C@H](NCc1ccco1)c1ccc(C(F)(F)F)cc1 539524116 WTSCGWGEYSPQJY-INIZCTEOSA-N 309.331 5.096 30 20 DKED Cc1cccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)c1 727264046 MRLKAHSWOMSAPJ-ZHACJKMWSA-N 305.402 5.015 30 20 DKED CC[C@H](C)c1nc(-c2cn(CCC#N)c3ccccc23)cs1 345736560 BLMBBEXSMXEIGA-ZDUSSCGKSA-N 309.438 5.192 30 20 DKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)c1 414136149 IQHFITHHOPQZHN-LAUBAEHRSA-N 322.452 5.089 30 20 DKED C=CCC[C@H](N[C@@H](CC)c1ccc(C#N)cc1)c1ccccc1 447589613 YOCMKPLJPRKMAC-SFTDATJTSA-N 304.437 5.306 30 20 DKED CC(C)c1cnc(S[C@@H](C)c2ccc(C#N)cc2)n1C(C)C 523497595 UJTNEUMOBWRAKU-AWEZNQCLSA-N 313.470 5.312 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1 540150280 GQGFYPDOENAQKD-KXBFYZLASA-N 313.416 5.192 30 20 DKED C[C@H](N[C@H]1CC[C@H](C#N)C1)c1ccccc1-c1ccc(Cl)cc1 549927995 JQKUCKSCPPHZKA-MPGHIAIKSA-N 324.855 5.350 30 20 DKED CC(C)(c1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1)C(F)(F)F 618577826 LOXHIDDRLUYIDF-IUODEOHRSA-N 310.363 5.021 30 20 DKED N#CCOc1ccc(Cl)cc1CSc1cccc(Cl)c1 735232856 DGPSWZLXTWVSBU-UHFFFAOYSA-N 324.232 5.188 30 20 DKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(C)o2)cc1 741467536 NSNNAYWPUZNSHS-JLHYYAGUSA-N 318.372 5.160 30 20 DKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1ccc2ccccc2n1 753389683 HCSJGESVHNJHSP-MRXNPFEDSA-N 308.425 5.018 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC[C@@H](F)C1 424784582 ABQSWJJUFAFQLZ-HZPDHXFCSA-N 303.421 5.005 30 20 DKED C[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1cccc(C#N)c1 426321382 CLMHKIMMAQQSJR-XHDPSFHLSA-N 316.857 5.001 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc12 464646804 ZJXHFIHIHUYBGT-OXJNMPFZSA-N 307.437 5.106 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(C)(C)C 476121584 OOCKPKIYOCCSGO-UHFFFAOYSA-N 301.474 5.693 30 20 DKED C[C@@H](CCCC(F)(F)F)N[C@@H]1CCCCc2cc(C#N)ccc21 481995081 ZYUILXXWLCRILG-SUMWQHHRSA-N 324.390 5.036 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(F)c1)c1ccccc1 540150277 GQGFYPDOENAQKD-BEFAXECRSA-N 313.416 5.192 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 551204109 ABEVUWNBBPVBSB-HIFRSBDPSA-N 318.873 5.487 30 20 DKED N#Cc1ccc(SCc2csc(C3CCCCC3)n2)cc1 609092303 BKOYKFYTOSNLQC-UHFFFAOYSA-N 314.479 5.355 30 20 DKED C[C@@H](S[C@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1 609825856 XQILJTBVZOAKDW-VXGBXAGGSA-N 303.377 5.392 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(SC(C)(C)C)cc1 785759373 HGBGOTQPAOKVGR-OAHLLOKOSA-N 318.486 5.150 30 20 DKED O=C(/C=C\c1cccc(O)c1)c1ccc(-c2ccc(F)cc2)s1 844255904 VKWOGHXMGSQBPF-WTKPLQERSA-N 324.376 5.156 30 20 DKED C[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 21009060 YNFQDZBBGSOGGL-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H](C)C1 191453167 XEAOFPGWKNLRGS-IYBDPMFKSA-N 314.473 5.048 30 20 DKED CC(C)(C#N)CCCCSCc1cc(-c2cccs2)on1 435883408 KPSJJTAYJVDOPV-UHFFFAOYSA-N 320.483 5.356 30 20 DKED C=CCC[C@@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccco1 671759385 BYSYZTXFGHMHLB-CQSZACIVSA-N 317.339 5.144 30 20 DKED CC(C)n1cc(/C=C/C(=O)c2cccc(-c3ccccc3)c2)cn1 732714313 PPMWSCPFIXIKTE-VAWYXSNFSA-N 316.404 5.027 30 20 DKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 744016360 LPGQSZJHJYDSRF-UONOGXRCSA-N 314.454 5.079 30 20 DKED CC(C)CCCCCC(=O)[C@H](C#N)c1nc2ccccc2s1 749022358 GGRCYNHLERNGBW-AWEZNQCLSA-N 314.454 5.079 30 20 DKED CC(C)(C=NN(Cc1ccccc1)Cc1ccccc1)CCC#N 755588777 IAOZGQXRENVXMK-UHFFFAOYSA-N 319.452 5.005 30 20 DKED CCCCc1ccc(NC(=S)Nc2cccc(C#N)c2C)cc1 769793696 AZIAKUQJVJFSOV-UHFFFAOYSA-N 323.465 5.018 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC(F)(F)C1 283397921 FILHSOLENLNLMD-HNNXBMFYSA-N 321.411 5.303 30 20 DKED CCC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315888539 PFQCGTIMBDDKSF-KUHUBIRLSA-N 312.844 5.404 30 20 DKED CSc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 340449323 UOTOQBQPHIHHOB-OXJNMPFZSA-N 324.493 5.494 30 20 DKED C=CCCC[C@@H](C)NC(=O)Nc1c(CC=C)cccc1C(C)C 475548051 LOWKJSGKEGJYLM-MRXNPFEDSA-N 314.473 5.405 30 20 DKED C[C@H](NCCCCC#N)c1ccc(-c2ccc(Cl)cc2)s1 531960204 KJAUBKZJOBJWPA-ZDUSSCGKSA-N 318.873 5.413 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc2cc(Cl)ccc2o1 540596821 JFWHSXLOZHVJSF-OLZOCXBDSA-N 324.811 5.370 30 20 DKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1cc2ccccc2o1 741840491 WUEQNLWTSJXXKX-VOTSOKGWSA-N 306.292 5.214 30 20 DKED C[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)CC(C)(C)C 797569349 PKYPMOZNUAZOMN-OLZOCXBDSA-N 320.502 5.079 30 20 DKED N#Cc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c1 205882054 IXXJQJVDZIFJFW-ZROIWOOFSA-N 309.368 5.121 30 20 DKED Cc1nc(CC/N=C(/O)CC2CCC(C(C)(C)C)CC2)c(C)o1 328921800 BSQCZIOZGAIJJN-UHFFFAOYSA-N 320.477 5.033 30 20 DKED CC(C)(C#N)CCCCSc1ncc(-c2ccc(F)cc2)o1 436191045 WBJMYGRGULFZDD-UHFFFAOYSA-N 318.417 5.293 30 20 DKED Cc1c([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)oc2ccccc12 477865807 XGTQGANEPXBGPX-UONOGXRCSA-N 322.383 5.164 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 480703355 XVFSOPXIYVOHKO-VOJFVSQTSA-N 323.333 5.211 30 20 DKED CCC[C@](C)(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 483467267 BILSGJTZOBQQNQ-KSSFIOAISA-N 318.486 5.093 30 20 DKED N#CCCC[C@@H](NCc1cc2ccccc2s1)c1ccccc1 577236865 WBJZKFAMAOFGRH-LJQANCHMSA-N 320.461 5.426 30 20 DKED N#CCCCOc1cccc(N[C@@H](c2ccc(F)cc2)C2CC2)c1 324388761 PIZTWQSSBPOKBN-HXUWFJFHSA-N 324.399 5.071 30 20 DKED CC(C)(C#N)CCCCN[C@@H](c1ccc(Cl)cc1)C1CC1 444674102 JZBIVVDSVKBKIB-QGZVFWFLSA-N 304.865 5.101 30 20 DKED CC(C)c1nc2ccc(NCCCC(C)(C)C#N)cc2s1 532413681 HBSPVWMUTWNKCG-UHFFFAOYSA-N 301.459 5.162 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1ccccc1C(=O)O 1776032147 PDYHXWYDQUMSMM-AWEZNQCLSA-N 304.434 5.169 30 20 DKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(F)c1 186842633 IZTGDRMMNZPUHC-LJQANCHMSA-N 312.388 5.071 30 20 DKED C=CCCc1ccccc1NC(=O)N1CC=C(C(C)(C)C)CC1 505011469 WARWDTZTAFHZCB-UHFFFAOYSA-N 312.457 5.015 30 20 DKED Cc1c(COC(C)(C)C)cccc1NCCCC(C)(C)C#N 531648028 ABLGWWACAXXMIO-UHFFFAOYSA-N 302.462 5.052 30 20 DKED N#Cc1cc(N[C@H](CC2CC2)c2ccccc2)nc2ccccc12 610280966 NGAWVMDUGSPSMF-HXUWFJFHSA-N 313.404 5.060 30 20 DKED CC(=NNc1cccc(Cl)c1C)c1cnc2ccsc2c1 739411698 OODHPIYTUNBMDB-UHFFFAOYSA-N 315.829 5.094 30 20 DKED CC(=NNc1ccccc1Cl)c1sc(C(C)C)nc1C 751131004 JNUUEYAFPJBLHS-UHFFFAOYSA-N 307.850 5.064 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1ccc(Cl)c(Cl)c1 782301862 NHRXUBQMCRBUGK-WAYWQWQTSA-N 324.232 5.223 30 20 DKED CC[C@@H](Nc1ccc(CCC#N)cc1)c1cccc(Cl)c1O 903293038 FLFFIEUKXWHZTJ-QGZVFWFLSA-N 314.816 5.065 30 20 DKED C=CC[C@H](C(=O)Nc1cc(C(C)C)c(O)cc1C)c1ccccc1 187080748 SGICJPJKCBLFAG-KRWDZBQOSA-N 323.436 5.122 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OC)c1 340458048 XNZLTLHXGLDMFV-NHCUHLMSSA-N 322.452 5.171 30 20 DKED CCN(Cc1cccc(C(F)F)c1)[C@H](C)c1ccc(C#N)cc1 470718092 OIFWNRZVPBAADA-CQSZACIVSA-N 314.379 5.079 30 20 DKED C=C(C)[C@H](NCc1ccc2occc2c1)c1ccc(F)c(F)c1 511913163 VXUQRWDYIMPRMZ-IBGZPJMESA-N 313.347 5.118 30 20 DKED CSc1ccc(C(=O)/C=C/c2ccc(C(F)F)cc2)cc1 794937146 GBSLUVTWRXZUSX-NYYWCZLTSA-N 304.361 5.242 30 20 DKED Cc1cc(Cl)cc(C=NOc2ccccc2C(F)(F)F)c1 814887799 MQURSFTZZDXKMN-UHFFFAOYSA-N 313.706 5.080 30 20 DKED Cc1noc(C)c1-c1ccc(OCCCCC2(C#N)CCC2)cc1 902734573 ZWNZVCILAWSKSC-UHFFFAOYSA-N 324.424 5.201 30 20 DKED CCc1c([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)oc2ccccc12 325107854 BKPVXKFHXUYLSQ-GJZGRUSLSA-N 318.420 5.279 30 20 DKED Cc1noc(C)c1C(C)(C)/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329224663 CONVPHQBPOBVEQ-ARFHVFGLSA-N 318.461 5.090 30 20 DKED C[C@H]1C[C@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 391788231 FSJFKMQYPQTJCX-YWZLYKJASA-N 306.409 5.030 30 20 DKED C=CCCCS[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1 437272517 WKIZJEGSRSDXJS-GFCCVEGCSA-N 322.861 5.074 30 20 DKED N#C[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2cccc(Cl)c2)C1 463301022 LWKJADCMELRKNM-YSGRDPCXSA-N 324.855 5.101 30 20 DKED C=CCN(CC=C)C(=O)Nc1cc(Cl)ccc1SC(C)C 591524727 QTZOHERXYRGHBT-UHFFFAOYSA-N 324.877 5.046 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2csc(-c3ccccc3)n2)c1 763291501 XXTNCMWZQLHABN-NTMALXAHSA-N 323.392 5.154 30 20 DKED CC(CCCCC#N)=NNc1cc(C)c2cc(Cl)ccc2n1 841615419 YBHDGYUJNZIMPA-UHFFFAOYSA-N 314.820 5.068 30 20 DKED c1ccc(C2CCC(=NNc3nccc4sccc34)CC2)cc1 915980331 UJHBKVVSXCDWHR-UHFFFAOYSA-N 321.449 5.422 30 20 DKED Cc1cccc(Nc2cccc(NC(=O)CCCCC#N)c2C)c1 925105395 ASWUMRHJOFGQTD-UHFFFAOYSA-N 321.424 5.070 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 187119839 CSXNMCXVDLHNML-NSHDSACASA-N 320.845 5.004 30 20 DKED C[C@H](SCc1nc2ccccc2s1)c1cccc(C#N)c1 443141742 MNSXJVFDBXRFIL-LBPRGKRZSA-N 310.447 5.162 30 20 DKED N#C[C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2cccc(Cl)c2)C1 463301020 LWKJADCMELRKNM-UIAACRFSSA-N 324.855 5.101 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccccc1F)c1ccc(F)c(F)c1 480684642 ULTMXAJULPXDIR-SGTLLEGYSA-N 305.343 5.072 30 20 DKED CCC(CC)n1ccc(CSc2cccc(Cl)c2C#N)n1 514884702 OKPQOHOQAXFYDR-UHFFFAOYSA-N 319.861 5.062 30 20 DKED N#CCCC[C@@H](N[C@H]1CCc2cc(Cl)ccc21)c1ccccc1 550829553 XWFGJQHMYPKRFO-UXHICEINSA-N 324.855 5.352 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 560907966 DCKAVGMAQGIMPW-FZKQIMNGSA-N 316.807 5.175 30 20 DKED C[C@@H](SCc1ccc(OC(F)F)cc1)c1ccc(C#N)cc1 609825739 QNYQXIWPWITCCU-GFCCVEGCSA-N 319.376 5.154 30 20 DKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Cl)cc1C(C)C 626832623 PLVKCIKOWYCVSZ-GASCZTMLSA-N 318.848 5.178 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccncc1 765805208 VDWVPHJZMDKVFS-OXQOHEQNSA-N 324.468 5.227 30 20 DKED C=CCCOCCCCC(=O)Nc1ccc(-c2ccccc2)cc1 775638417 CXZCNJJPBYZJEZ-UHFFFAOYSA-N 323.436 5.055 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1ccncc1 915698571 HAAHALKBBBNPEE-LJQANCHMSA-N 316.489 5.276 30 20 DKED COc1ccc2cc([C@H](C)Nc3ccc(CC#N)cc3)ccc2c1 78991393 DTZKOFRQWAVYDS-HNNXBMFYSA-N 316.404 5.088 30 20 DKED CCOc1ccccc1[C@@H](CC)N[C@H](CC)c1ccc(C#N)cc1 447546768 YQYABJQJDYXAIH-WOJBJXKFSA-N 322.452 5.149 30 20 DKED C=C(CC)CS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 579964979 ANUCPCPZIMYMIG-HNNXBMFYSA-N 305.487 5.145 30 20 DKED O=C(/C=C\c1ccc(F)c(F)c1)c1cc(Cl)sc1Cl 744866748 XNTMYUHAXPHMNU-RQOWECAXSA-N 319.159 5.229 30 20 DKED Cc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1F 745990558 UNBVEIGBVKHJGZ-WTKPLQERSA-N 317.363 5.092 30 20 DKED CCCCCCC[S@@](=O)Cc1c(C)cc(C)c(C(C)=O)c1C 764452071 KZUXLZZVNSJHHY-JOCHJYFZSA-N 322.514 5.034 30 20 DKED C=CC[C@H](N[C@H](CC)c1ccc(Cl)s1)c1ccncc1 766017371 ASQIJLCCFJFJCY-KGLIPLIRSA-N 306.862 5.155 30 20 DKED CC[C@@H](N[C@@H](c1ccccc1C)C1CC1)c1ccc(C#N)cc1 447526554 CXBNMMIZFPNZEV-NHCUHLMSSA-N 304.437 5.059 30 20 DKED CC1(C#N)CCC(Nc2ccc(C(C)(C)C(F)(F)F)cc2)CC1 449284121 NXMNDCHJXWLPAG-UHFFFAOYSA-N 324.390 5.411 30 20 DKED C=C(C)C[C@@H](C)C(=O)N1CC=C(c2cccc3ccccc23)CC1 464648789 ODQFLTOFSLULDX-QGZVFWFLSA-N 319.448 5.058 30 20 DKED Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1ccc(C#N)cc1 531336787 SAKYFGAJSGZDRE-INIZCTEOSA-N 322.452 5.355 30 20 DKED COc1cc(Cl)c(Cl)cc1N[C@H](C)c1cccc(C#N)c1 600850100 UFBBVCPGRQQABT-SNVBAGLBSA-N 321.207 5.047 30 20 DKED C[C@@H](SCCOC1CCCCCC1)c1ccc(C#N)cc1 610137278 QIZHOCALKBVHEZ-OAHLLOKOSA-N 303.471 5.092 30 20 DKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2o1 727955222 WCPBRWHKVJFPOX-LSDHHAIUSA-N 312.413 5.001 30 20 DKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2scnc2C)c1 729644233 SZFJITUQSMINKD-KHPPLWFESA-N 319.429 5.323 30 20 DKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccccc1 1776785312 UEULUBLLBPYKRW-IBGZPJMESA-N 319.489 5.275 30 20 DKED N#CCCC[C@@H](NCc1ccc(Cl)cc1F)c1ccccc1 353912709 FXYWIWQGWLQZDT-GOSISDBHSA-N 316.807 5.004 30 20 DKED CC(C)n1cc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cn1 732714763 XNCBCTWDYACGCS-CMDGGOBGSA-N 322.433 5.089 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H]2CCCC(C)(C)C2)n1 756573247 WYXSYHDCHSAOFB-KGLIPLIRSA-N 318.486 5.049 30 20 DKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCC(C)C 500740552 USKRUCMNNLBZKR-UHFFFAOYSA-N 322.408 5.034 30 20 DKED C=CCOc1ccc(CN[C@H](C)c2oc3ccccc3c2C)cc1 513098206 CMHGVMUXNPZUHI-MRXNPFEDSA-N 321.420 5.157 30 20 DKED C=CCC[C@@H](NCc1cc(Cl)nc(Cl)c1)c1ccccc1 775462657 BSYTWYMDJYVFSS-OAHLLOKOSA-N 321.251 5.186 30 20 DKED Cc1ccc2c(c1)CC[C@@H]2N[C@H](CCCC#N)c1ccccc1 815635497 DNJIVJFGSXRCQQ-RTWAWAEBSA-N 304.437 5.007 30 20 DKED CCCCCCCCCCCc1cnc2cc(Cl)ccc2n1 100158776 WJEZHVVNUJRVOR-UHFFFAOYSA-N 318.892 6.357 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2)s1)c1cccc(C#N)c1 237429094 INVZSURUNDZGMI-OAHLLOKOSA-N 318.445 5.138 30 20 DKED N#Cc1ccc(CNc2cccc(Oc3ccccc3)c2)c(F)c1 392085437 RDYZBPXGOIRUFD-UHFFFAOYSA-N 318.351 5.102 30 20 DKED CC(C)O[C@@H](CSCCCCC(C)(C)C#N)c1ccccc1 427696451 QFPGEQAPTCQODR-SFHVURJKSA-N 319.514 5.606 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccccc1 469802822 VXJVJNWMHORYHO-DOTOQJQBSA-N 314.498 5.625 30 20 DKED C=CCCCC(=O)Nc1ccccc1O[C@H](C)c1ccccc1 480846940 PEAHSDZEIPZEEV-MRXNPFEDSA-N 309.409 5.121 30 20 DKED C=CC[C@@H]1CCN(C(=O)Nc2c(CCC)cccc2C(C)C)C1 626532589 IEOWZZJKCAECBT-MRXNPFEDSA-N 314.473 5.192 30 20 DKED C[C@H](Nc1ccc(OC2CCCCC2)cc1)c1cccc(C#N)c1 863996201 QXFVOMZBRILXKV-INIZCTEOSA-N 320.436 5.443 30 20 DKED CCCCCCCCCCCN(C)Cc1cc(C)c(C(=O)O)o1 1776784623 UONSNVZJYOIVSM-UHFFFAOYSA-N 323.477 5.249 30 20 DKED N#CCCSc1ccccc1NCc1c(F)cccc1Cl 108352813 UXRCGLTUQSEZIK-UHFFFAOYSA-N 320.820 5.097 30 20 DKED N#CCC[C@@H](NCc1cccc(Cl)c1Cl)c1ccccc1 130511642 IMMROYLRYICYSB-MRXNPFEDSA-N 319.235 5.128 30 20 DKED C=C[C@@H](CC(=O)N1CCCCC[C@H]1c1ccco1)c1ccccc1 135275377 ZZFMWEOUHJACJH-HKUYNNGSSA-N 323.436 5.083 30 20 DKED C[C@@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)cc1 174047917 APFOJTRQLKXVBO-LLVKDONJSA-N 304.365 5.046 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)C1CCC(F)(F)CC1 340453076 RKGRIPSJVXHHOA-QAPCUYQASA-N 320.427 5.225 30 20 DKED C=CCCCCCN(C)C(=S)Nc1ccc2ccccc2c1 739458551 NISMTRRWZQKSIW-UHFFFAOYSA-N 312.482 5.215 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ccccc1 756759010 HBZHKIKLOKIEBW-FZKQIMNGSA-N 317.379 5.029 30 20 DKED CC(/C=C\C(=O)c1cncs1)=C\c1ccccc1C(F)(F)F 799891660 AUSBSLCFFPQYIU-BQGCWICQSA-N 323.339 5.004 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc2ccccc12 27353967 WTNUVEXRUDZLRD-UHFFFAOYSA-N 316.404 5.060 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC 340441708 DFSSQVSAKGNQEQ-UXHICEINSA-N 322.452 5.171 30 20 DKED C=CCC[C@H](NCc1cccc(C(F)F)c1)c1ccccc1 470775877 ASWCUWQWTCGVHE-SFHVURJKSA-N 301.380 5.421 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 480669784 WCKXPSWRNHCTRV-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cc2ccccc2s1 568936761 WRJYOHZFYRHISA-FZKQIMNGSA-N 318.445 5.111 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C(C)(C)C#N)cc1)C1CC1 614182921 NCNGYDKXIADQIK-OAQYLSRUSA-N 318.464 5.037 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 21009057 YNFQDZBBGSOGGL-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccccc1C)c1ccccc1 156541560 FPLKBMPTVNCJEW-NQIIRXRSSA-N 319.448 5.018 30 20 DKED Cc1c([C@H](NCc2cccc(C#N)c2)C(C)C)oc2ccccc12 236739371 BKFAXFBAJGEYKD-HXUWFJFHSA-N 318.420 5.100 30 20 DKED CC(C)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315860942 MKJRHCKLCGTDHY-IFXJQAMLSA-N 312.844 5.260 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)c1ccccc1 464479334 HXQLCFYUXNXMJP-IBGZPJMESA-N 321.464 5.671 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1ccc(F)cc1)c1ccc(F)c(F)c1 480658607 LALWNSISXZUARL-KPZWWZAWSA-N 305.343 5.072 30 20 DKED N#CCCSc1ccccc1NCc1cc2ccccc2o1 486433484 GQCDKGRDNLZBOQ-UHFFFAOYSA-N 308.406 5.051 30 20 DKED N#Cc1cccc(CSCc2ccc(Cl)c3cccnc23)c1 609236499 LXXVMHXIVBIWIV-UHFFFAOYSA-N 324.836 5.193 30 20 DKED CC(C)(C#N)c1ccc(CNc2cccc3ccsc23)cc1 614058651 KSHZMAFAGQJONF-UHFFFAOYSA-N 306.434 5.315 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(-c3c(F)cccc3F)o2)o1 734366866 BQMCCFJHKJEWOC-VURMDHGXSA-N 314.287 5.022 30 20 DKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797566520 MIWLBQUZJCEUDM-KBPBESRZSA-N 320.502 5.223 30 20 DKED N#CCCC[C@H](N[C@H]1CCCc2ccccc21)c1ccccc1 340454900 SUKSMEPDDULGPV-SFTDATJTSA-N 304.437 5.089 30 20 DKED N#Cc1cccc(SCc2ccccc2Oc2cccnc2)c1 435043002 OXDVZIFLXLZTRU-UHFFFAOYSA-N 318.401 5.038 30 20 DKED CC[C@@H](N[C@H](C)c1oc2ccccc2c1C)c1ccc(C#N)cc1 447545815 YFKBMPURNVYOGM-DNVCBOLYSA-N 318.420 5.415 30 20 DKED Cc1cc2cc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc2cc1C 532206441 RKADQQSCPCXWDB-JKSUJKDBSA-N 318.420 5.333 30 20 DKED N#CC1(C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)CCCC1 560141253 LUQKLQPRDPTJEK-UHFFFAOYSA-N 324.811 5.029 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1coc2ccccc12 747706294 UDHAVDQWNVQBLV-HJWRWDBZSA-N 309.390 5.053 30 20 DKED C=CCCCCC[C@H](C)N[C@@H]1CCO[C@H](c2ccccc2)C1 793550183 DHOOIXXOTJZALJ-SXLOBPIMSA-N 301.474 5.021 30 20 DKED CC(C)[C@@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 794525064 YSENMQWIOYGZOR-OAHLLOKOSA-N 321.342 5.510 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCC(F)(F)C1 798000094 KUKPJSVPDZYQNE-CQSZACIVSA-N 321.411 5.303 30 20 DKED Cc1c([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)oc2ccccc12 124610259 SMZOGNYOIUCIIH-HUUCEWRRSA-N 304.393 5.025 30 20 DKED Cc1ccc2sc(/C=C\c3ccc(O[C@H](C)C#N)cc3)nc2c1 207992230 HXVXYWHWCCSGAM-LBIZBFCRSA-N 320.417 5.066 30 20 DKED C=CCC[C@H](NCc1ccccc1C(F)(F)F)c1ccco1 556871251 SAKPPCRXSWCNNI-HNNXBMFYSA-N 309.331 5.096 30 20 DKED CCCCCCCC(=O)N1CCCC[C@H]1c1ccccc1OC 729955882 MGUUKCLTHFUGBJ-SFHVURJKSA-N 317.473 5.109 30 20 DKED C=CCCCN(C)C(=S)Nc1c(C(C)C)cccc1C(C)C 736450337 QVITUALGCIXAKC-UHFFFAOYSA-N 318.530 5.528 30 20 DKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1cc2ccccc2o1 761474703 MPUODOHUUUMOLC-FPLPWBNLSA-N 323.348 5.078 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1cc(Cl)cc(Cl)c1 782341816 LGVRIFTVNJWNBW-ARJAWSKDSA-N 324.232 5.223 30 20 DKED O=C(/C=C\c1c(Cl)cccc1Cl)c1cc(F)ccc1F 916134987 WBOIPZCLUMOFRJ-ALCCZGGFSA-N 313.130 5.168 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1sccc1CC 188073065 BAKLPJIMQZBJQE-UHFFFAOYSA-N 313.466 5.415 30 20 DKED C[C@H]1C[C@@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 391788229 FSJFKMQYPQTJCX-MGPUTAFESA-N 306.409 5.030 30 20 DKED N#CCCCCSCC/C=C/c1ccc(Br)cc1 480380704 AHXYAZWTGHBXIA-QHHAFSJGSA-N 324.287 5.279 30 20 DKED C=CCC[C@@H](Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccco1 560554059 PWZNAPQAKAFHRO-GOSISDBHSA-N 322.408 5.671 30 20 DKED C=C(C)CCS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 578734527 GAYQXVYHFSDYCI-OAHLLOKOSA-N 305.487 5.145 30 20 DKED C=CC[C@@H](N[C@@H](CC)c1ccc(Cl)cc1)c1ccncc1 766022520 WOUHVEVLPQOKSB-ZWKOTPCHSA-N 300.833 5.093 30 20 DKED CCCCCCCCC(=O)Nc1cccc(-c2ncco2)c1C 816719733 KFWGAIJWKJLZDV-UHFFFAOYSA-N 314.429 5.339 30 20 DKED CC(C)(C#N)CCCCSCc1cc(-c2ccccc2)no1 435884488 SYLKGNQCVGQGJZ-UHFFFAOYSA-N 314.454 5.295 30 20 DKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2o1 727955221 WCPBRWHKVJFPOX-HUUCEWRRSA-N 312.413 5.001 30 20 DKED CSc1ccc(C(=O)/C=C\c2ccc(Cl)s2)cc1F 741847653 RJKYJYWVZHYLTG-HYXAFXHYSA-N 312.818 5.159 30 20 DKED CC(=NNc1ccc(F)cc1)c1cc(Cl)sc1Cl 744566478 FNWYBCDMYXPXTE-UHFFFAOYSA-N 303.189 5.030 30 20 DKED COc1cc2c(cc1NCCCC(C)(C)C#N)oc1ccccc12 756079304 FYDWRDCETRSGLY-UHFFFAOYSA-N 322.408 5.336 30 20 DKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(C)s2)cc1 765025325 KNFVDSAUEBLOJZ-AWEZNQCLSA-N 321.873 5.039 30 20 DKED C[C@@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(C#N)cc1 463904485 HYRSLOPLSJCJKB-QRWLVFNGSA-N 324.443 5.525 30 20 DKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2ccccc2s1 618807432 UNRPHNHFENMLRN-FZKQIMNGSA-N 318.445 5.111 30 20 DKED Cc1ccsc1C(=O)/C=C\c1cc(C(F)(F)F)ccc1F 733749535 NPMAKKNULIXLNH-DJWKRKHSSA-N 314.303 5.111 30 20 DKED CC(C)(C)Nc1ccccc1NCc1ccc(Cl)cc1C#N 766132868 QDTNELRFCNIRPE-UHFFFAOYSA-N 313.832 5.034 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccc2)o1 138058091 LZQCAGXGQZNAOK-OUKQBFOZSA-N 318.372 5.063 30 20 DKED C[C@H](C#N)CSc1ccccc1NC[C@@H]1C[C@H]1c1ccccc1 461765129 DAXMBVQKGQGHFN-NJAFHUGGSA-N 322.477 5.154 30 20 DKED N#Cc1ccccc1Oc1ccc(NCc2ccccc2)cc1F 463232261 RONUEZGNNVDZFX-UHFFFAOYSA-N 318.351 5.102 30 20 DKED C[C@@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)c(F)c1 495413725 FTNMLVTXKYBAKR-VFNWGFHPSA-N 322.427 5.279 30 20 DKED N#CC1(CC(=O)Nc2ccccc2-c2ccccc2)CCCCC1 596680500 NSLYJHKUKZWGHN-UHFFFAOYSA-N 318.420 5.156 30 20 DKED C=CCCCSCc1csc(COc2ccc(F)cc2)n1 609803892 JPUUJFSTGCQSNY-UHFFFAOYSA-N 323.458 5.061 30 20 DKED O=C(/C=C/c1cc2ccccc2o1)c1c(F)cccc1Cl 809159151 JGWPPFWHCHHMOR-CMDGGOBGSA-N 300.716 5.121 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2o1 193905805 RZSRSXIGDJEWLB-HNNXBMFYSA-N 320.392 5.288 30 20 DKED C=CCC(CC=C)C(=O)Nc1c(CC)ccc(Cl)c1CC 468556372 UVKMIMKSWGEDRW-UHFFFAOYSA-N 305.849 5.172 30 20 DKED C[C@@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1F 512280241 OGGNMBTUNHANCK-VFNWGFHPSA-N 322.427 5.279 30 20 DKED C[C@H](NCc1ccc(-c2cccs2)cc1)c1cccc(C#N)c1 618302232 JHHLGXPRLZDEKD-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CCCCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915084942 BLURDLPCHBESNX-FQEVSTJZSA-N 320.436 5.251 30 20 DKED N#CCCCCNC1CCC(c2cccc(C(F)(F)F)c2)CC1 432406713 IJJYXVHWCYFBNO-UHFFFAOYSA-N 324.390 5.015 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 539051416 ICYSQLPPSPIGTQ-CZUORRHYSA-N 323.358 5.657 30 20 DKED CC(C)c1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550829093 AVJXVFRLACUPLI-AVRDEDQJSA-N 320.480 5.896 30 20 DKED C[C@@H]1CC[C@H](NCc2ccc(C#N)c(Cl)c2)c2sccc21 590778610 FGTQVFHQXPVNJM-BZNIZROVSA-N 316.857 5.001 30 20 DKED COc1cccc(C=Nc2ccc(SC(C)(C)C)cc2)c1O 726739754 IFTYKXWBHMEFKT-UHFFFAOYSA-N 315.438 5.042 30 20 DKED C=CCOc1ccc(CN[C@H](C)c2csc3ccccc23)cc1 730019082 FSEAVUFGKAULTK-OAHLLOKOSA-N 323.461 5.317 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(CC(C)C)cc1)c1ccncc1 766021594 QRYHQDDXZCNACI-DYESRHJHSA-N 308.469 5.248 30 20 DKED CSc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665226 FIARHEJDWPRALN-BEFAXECRSA-N 310.466 5.104 30 20 DKED CC(C)(C#N)CCCNc1ccccc1SC(F)(F)F 153798101 OVNMGDZGTMZSEW-UHFFFAOYSA-N 302.365 5.040 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1F 340444132 CEEFCABVPICULY-PMACEKPBSA-N 310.416 5.302 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C)c1 340450382 XYMNLQJLESLAAS-RTWAWAEBSA-N 306.453 5.471 30 20 DKED C[C@@H]1C[C@@H]1c1ccc(CN(CCCCC(C)(C)C#N)C2CC2)o1 444597692 ODCLDEIVJNATQC-QAPCUYQASA-N 314.473 5.087 30 20 DKED C=C(C)CCc1noc([C@H](C)Sc2ccc(Cl)cc2)n1 508661857 KYGWZXIBGFTRMM-NSHDSACASA-N 308.834 5.085 30 20 DKED N#CCCCCSC(c1ccc(F)cc1)c1ccc(F)cc1 531946271 CJCGPDIQYLGYFG-UHFFFAOYSA-N 317.404 5.481 30 20 DKED CSc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 538636331 RBAVIWXQZAQAFV-NSHDSACASA-N 302.830 5.107 30 20 DKED CC(C)(C#N)CCCN[C@@H](c1ccc(Cl)cc1)C1CCC1 539304912 RCAGWWOSXGNBGM-QGZVFWFLSA-N 304.865 5.101 30 20 DKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc2ccccc12 554996696 ARZUXIBVEWJBBS-OYHNWAKOSA-N 312.416 5.050 30 20 DKED Cc1ncccc1/C=C\C(=O)c1ccc(-c2ccccc2)s1 728785584 HLDIMZHZZOOFQU-KTKRTIGZSA-N 305.402 5.015 30 20 DKED CC(C)n1cc(C(=O)/C=C/c2ccc(-c3ccccc3)cc2)cn1 58465413 IVHXIEJZPWDMHO-JLHYYAGUSA-N 316.404 5.027 30 20 DKED CC(C)Oc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1Cl 97393721 GMOOKIVWFKLSNN-CYBMUJFWSA-N 314.816 5.172 30 20 DKED C[C@@H]1C[C@H](C(O)=Nc2ccc3c(c2)oc2ccccc23)CCC1=O 328909470 DRYSPIYRRJMNGP-CHWSQXEVSA-N 321.376 5.179 30 20 DKED N#CC1CCC(CN[C@@H](CC2CC2)c2ccc(Cl)cc2)CC1 442866234 KNZSEMLYTRGIHN-RJYAGPCLSA-N 316.876 5.101 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(CC)(CC)C1 455237967 AKTZGWJRJOVMQP-UHFFFAOYSA-N 314.473 5.192 30 20 DKED Cc1ccc2c(c1)[C@@H](Nc1cccc(OCCCC#N)c1)[C@H](C)C2 494952529 OTVFLPBPZDASCW-IERDGZPVSA-N 320.436 5.023 30 20 DKED C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 537296921 YAIBBZFGQLEHRC-LIRRHRJNSA-N 310.416 5.135 30 20 DKED C=CCC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccccc1 614178805 FJYVUXLOFJHOSC-NRFANRHFSA-N 318.464 5.285 30 20 DKED Cc1ncsc1C(=O)/C=C\c1ccc(-c2ccccc2)cc1 915054021 BDIOLHGEPXMKMX-XFXZXTDPSA-N 305.402 5.015 30 20 DKED CC(C)(C#N)CCCCSCc1ccc(OC(F)F)cc1 435879588 DJWJYJVDBYCSLZ-UHFFFAOYSA-N 313.413 5.241 30 20 DKED CC[C@@H](N[C@H](c1ccc(F)cc1)C(C)C)c1ccc(C#N)cc1 503885149 KELAXDDBXHIRMA-UXHICEINSA-N 310.416 5.135 30 20 DKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cc2ccccc2s1 512668850 WVUXABQPJCWRHO-STQMWFEESA-N 324.424 5.324 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 744016054 IEKZTNZOLLLURF-KGLIPLIRSA-N 314.454 5.079 30 20 DKED CCCC[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 799891284 CGRVCVOJXUUPEX-UZLBHIALSA-N 320.436 5.107 30 20 DKED C[C@@H]1CC[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340450316 XCKMQWNCMOBDBP-YHYVQYDKSA-N 318.464 5.650 30 20 DKED Cc1cc2c(cc1C)[C@H](N[C@@H](C)c1ccc(C#N)cc1)CCS2 427589575 RSBMZJVLZOPDHE-HNAYVOBHSA-N 322.477 5.063 30 20 DKED CC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1cccs1 481667669 HCQFXYGITFCIGC-QZTJIDSGSA-N 310.466 5.128 30 20 DKED CC(C)(C#N)c1ccccc1CSc1cccc2cccnc12 488595388 MFVRSPLCKKRDIH-UHFFFAOYSA-N 318.445 5.328 30 20 DKED C=CCC[C@H](N[C@H](C)c1sc(CC)nc1C)c1ccccc1 540150307 IBVDHOVEJWHYSI-PBHICJAKSA-N 314.498 5.372 30 20 DKED N#CCC[C@H](NC1CC(c2ccc(Cl)cc2)C1)c1ccccc1 544369827 DKNJKNNXJQKKGL-UUKMXZOPSA-N 324.855 5.221 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cccc(C)c1Cl 547623032 WCSHISRCBVQKEE-UHFFFAOYSA-N 317.841 5.179 30 20 DKED C[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)C1CCCCC1 726317716 CTAWIOLLILJREJ-MAUKXSAKSA-N 320.436 5.018 30 20 DKED Cc1ccc(NCc2ccc(C#N)o2)cc1OCC1CCCCC1 742372463 NDYSGPVFRNGPAW-UHFFFAOYSA-N 324.424 5.031 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2c(F)cccc2Cl)s1 809159394 OQJKPSBADCPAAI-BQYQJAHWSA-N 323.820 5.129 30 20 DKED CC(=NNc1nc(-c2ccccc2)cs1)c1ccc(C)s1 917025136 FATRRNLGMHHKSA-UHFFFAOYSA-N 313.451 5.016 30 20 DKED N#CCCSc1ccccc1NCc1ccc(F)c(Cl)c1 189645494 WRYIBNKOUVNXBZ-UHFFFAOYSA-N 320.820 5.097 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1F 189911285 BISFFWQPUGQTAK-UHFFFAOYSA-N 315.363 5.069 30 20 DKED CSc1ccc(/C=C\C(=O)c2ccc(SC)cc2)cc1 195792547 RSFMOXYGJZKDCF-XGICHPGQSA-N 300.448 5.027 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H]1CCCc2sccc21 360876057 YRXOOGSIWNKYKQ-RTBURBONSA-N 322.477 5.054 30 20 DKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)c1 414136105 IQHFITHHOPQZHN-DYESRHJHSA-N 322.452 5.089 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccc(Cl)cc1 444600846 UWAAJIKHJQJINQ-KRWDZBQOSA-N 304.865 5.197 30 20 DKED C[C@H](SCCCSCC#N)c1ccc(Cl)c(Cl)c1 466638763 GPKWWTRIAYMKKE-JTQLQIEISA-N 320.310 5.434 30 20 DKED CC(C)(C#N)CCCN(Cc1ccc(F)cc1F)C1CCCC1 472427824 DDYSSJLOYDEDCH-UHFFFAOYSA-N 320.427 5.039 30 20 DKED C=C(C)CCc1noc([C@@H](C)Sc2ccc(Cl)cc2)n1 508661854 KYGWZXIBGFTRMM-LLVKDONJSA-N 308.834 5.085 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1ccccc1Cl 444598010 NZUOQCYASBOVFE-QGZVFWFLSA-N 304.865 5.197 30 20 DKED CC#CCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 462334671 RQPBJOOUTKPPJO-SFHVURJKSA-N 322.452 5.015 30 20 DKED COc1ccc(/C=C/C(=O)c2sccc2C)c2ccccc12 733748561 CEPNGUTYINEOSO-VQHVLOKHSA-N 308.402 5.114 30 20 DKED O=C1/C(=C/c2cccs2)CCc2cc(SC(F)F)ccc21 750918059 ZYHHZVDUJSDCSF-PKNBQFBNSA-N 322.401 5.275 30 20 DKED CC1(C)CCCC[C@@H]1CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 752472908 CECGAODKISMNLE-SJORKVTESA-N 320.436 5.018 30 20 DKED CC(C)c1ccc(CC=NOc2ccccc2C(F)(F)F)cc1 760246279 IYCREBPFDIDKIL-UHFFFAOYSA-N 321.342 5.436 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CSCCCC 789719399 PLGJVVSJHWHENW-UHFFFAOYSA-N 305.487 5.010 30 20 DKED COc1ccc(C(C)(C)C)cc1N[C@@H](C)c1ccc(C#N)cc1 319742263 SQXCSXUNDCHINC-AWEZNQCLSA-N 308.425 5.037 30 20 DKED N#CCCC[C@H](N[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 340453001 QDUGJGPGSUQIMU-BBWFWOEESA-N 324.390 5.132 30 20 DKED C[C@@H](SCc1coc(-c2ccccc2)n1)c1cccc(C#N)c1 443146327 LBACTQJGUSWJMA-CQSZACIVSA-N 320.417 5.208 30 20 DKED C=C(C)[C@H](NCc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 479416416 YMBSLPSSLREDFD-HGQUKEQDSA-N 317.379 5.088 30 20 DKED C=CCC(CC=C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F 518251382 NFESKEARQQEVSL-UHFFFAOYSA-N 317.738 5.066 30 20 DKED C[C@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1 537297610 YXZPRVQEXHBYIE-HRAATJIYSA-N 304.437 5.140 30 20 DKED CC(C)(C#N)CCN1CCCC[C@H]1c1ccccc1C(F)(F)F 537362226 FOSFWYGIIIJKKR-INIZCTEOSA-N 324.390 5.172 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccccc1 559863025 NCWXECGQORJKSF-MNAPGUCWSA-N 318.464 5.203 30 20 DKED C[C@H](Nc1cccc2c1ccn2C(F)F)c1cccc(C#N)c1 600857502 OSCORWKQGSDGPY-LBPRGKRZSA-N 311.335 5.081 30 20 DKED CC1(C#N)CCC(N[C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 414253503 ZIZXEQKKBNYMMA-ZTRSQXPZSA-N 316.876 5.038 30 20 DKED C=CC[C@@H](C)NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 439982032 SKKNMDNJJAYISV-SJORKVTESA-N 322.452 5.021 30 20 DKED CC1=C(C(=O)N[C@H](CCCC#N)c2ccccc2)CCC(C)(C)C1 452138704 JXTHLBHQLYAUFM-LJQANCHMSA-N 324.468 5.064 30 20 DKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)s1 539497253 SAWCEEASBPFZQV-RISCZKNCSA-N 304.846 5.075 30 20 DKED Cc1ccccc1[C@@H](NCc1ccc(C(C)(C)C#N)cc1)C1CC1 614182920 NCNGYDKXIADQIK-NRFANRHFSA-N 318.464 5.037 30 20 DKED CC[C@@H](N[C@@H](CC1CC1)c1ccccc1)c1ccc(C#N)cc1 618573938 QVBWBZAIHFBYCY-RTWAWAEBSA-N 304.437 5.140 30 20 DKED CCCCCC[C@@H](C)C(=O)Nc1ccccc1SCCC#N 741924594 GVBRGTNXZNPMOK-OAHLLOKOSA-N 318.486 5.237 30 20 DKED C=CCN(C(=O)Nc1ccc(S[C@H](C)CC)cc1C)C(C)C 748446800 FMNFWXZLIYYEME-OAHLLOKOSA-N 320.502 5.314 30 20 DKED CCCCCCC[C@H](O)CCCCCCCCCC(=O)O 102183317 CJUFNCPPYUSJPR-KRWDZBQOSA-N 300.483 5.303 30 20 DKED N#CCC[C@@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1 130595132 CXQYCCPZHPYOIP-QGZVFWFLSA-N 319.235 5.128 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCCCc1ccsc1 541169099 AHKWCUNIDDLOEZ-CQSZACIVSA-N 316.495 5.187 30 20 DKED C[C@H](CNCC(C)(C)CCC#N)c1c(Cl)cccc1Cl 237516790 KXTVFTLLIDYCHD-GFCCVEGCSA-N 313.272 5.016 30 20 DKED C=CCC[C@@H](Nc1cccc(CC(F)(F)F)c1)c1ccco1 552282341 BRQJRCXSZYERQG-OAHLLOKOSA-N 309.331 5.504 30 20 DKED C[C@H](Nc1ccccc1S[C@H](C)CC#N)c1ccccc1F 600847562 VFUSLIYDFNBCMD-KGLIPLIRSA-N 314.429 5.393 30 20 DKED O=C(/C=C/C1=Cc2ccccc2OC1)c1cccc2ccccc12 726739538 BLEJRXOANAGCHC-OUKQBFOZSA-N 312.368 5.055 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nc(C(C)C)cs1 747197640 LBHNWSLYHDRYKP-KGLIPLIRSA-N 306.475 5.049 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cc2ccc(C)cc2o1)c1ccncc1 756036109 NZWZZVLJKDYEJB-MAUKXSAKSA-N 306.409 5.104 30 20 DKED Cc1noc(C2CC2)c1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329088966 IGSWNAYGCKNMOE-AEGPPILISA-N 302.418 5.055 30 20 DKED Cc1noc(C)c1C(C)(C)/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329298293 UFGPDPIOTQEYQB-HRCADAONSA-N 318.461 5.090 30 20 DKED C=CC[C@H](C)NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 439982031 SKKNMDNJJAYISV-IRXDYDNUSA-N 322.452 5.021 30 20 DKED Cc1csc(-c2cccc(NC3CCC(C)(C#N)CC3)c2)n1 449053868 MLRPPPXYRYAFEM-UHFFFAOYSA-N 311.454 5.003 30 20 DKED Cc1cccc2c1[C@@H](C)C[C@@H]2Nc1cccc(OCCCC#N)c1 538527925 IRHHRODMVUROTR-JXFKEZNVSA-N 320.436 5.338 30 20 DKED C=CCC[C@H](NCc1ccc2[nH]c(C)c(C)c2c1)c1ccco1 552047547 QFZMPOSDFHRJDZ-IBGZPJMESA-N 308.425 5.175 30 20 DKED CC(C)OCc1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1 594496555 NVYJUSKGTRCZPM-UHFFFAOYSA-N 322.452 5.025 30 20 DKED CC[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1F 613114006 QTHUJJWOQKDYNX-PXAZEXFGSA-N 316.807 5.153 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1C1CCCC1 649956437 SCACAJJVPBUJSC-RBUKOAKNSA-N 311.469 5.303 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1ccc2ncccc2c1 916249647 DCILQPLQKDQPKM-UHFFFAOYSA-N 323.399 5.407 30 20 DKED CCCCCCCCCCCN(C)c1ccc(C(=O)O)c(C)n1 1776787753 MAQHWAUYOFJHFI-UHFFFAOYSA-N 320.477 5.055 30 20 DKED Cc1c([C@H](C)N[C@@H](C)c2cccc(C#N)c2)oc2ccccc12 178176797 JQDTVNLYJCSVIM-GJZGRUSLSA-N 304.393 5.025 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)c1cccc(C#N)c1 538407100 IVBAMARMAUAXHE-AFHBHXEDSA-N 324.855 5.260 30 20 DKED C[C@H](SCc1ccnc(C#N)c1)c1cccc2ccccc12 610954547 UIWGPGUBDBMLAW-AWEZNQCLSA-N 304.418 5.101 30 20 DKED Cc1cccc2c1C/C(=C/c1csc(-c3ccsc3)n1)C2=O 729150713 LNWCZSKTPYWEPD-QPEQYQDCSA-N 323.442 5.002 30 20 DKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccccc2)cc1 742429006 CJQKMIDUFPVOMH-VAWYXSNFSA-N 305.402 5.015 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@@H]1c1cccc(C)n1 766189993 WXRHWSULQGXBLO-LJQANCHMSA-N 316.489 5.194 30 20 DKED N#Cc1ccc(/C=C(/Cl)c2nc3ccccc3s2)c(F)c1 772797274 NLAPWXXLTKVQKU-XYOKQWHBSA-N 314.772 5.044 30 20 DKED CCCCCCCC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 785683926 WYTGYVJJSKHMDD-UHFFFAOYSA-N 319.411 5.118 30 20 DKED C[C@H](NN=Cc1ccccc1-c1ccccc1)c1ccccc1 920383264 VCHYLDUXDSDUFU-KRWDZBQOSA-N 300.405 5.038 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1coc2ccccc12 925599894 DGLYKXBGXOLXMF-BEFAXECRSA-N 304.393 5.128 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)c1ccccc1 90580750 KIIAPOVPBGRLHD-KKSFZXQISA-N 322.452 5.003 30 20 DKED Cc1csc(-c2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2)n1 183013731 IAQWNFLUCFBPOJ-AWEZNQCLSA-N 319.433 5.163 30 20 DKED C[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1 231666675 BIUSDIFQXGUKQQ-VXGBXAGGSA-N 319.235 5.277 30 20 DKED CC[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1 447512024 WPTJPMFVYIUGIB-WOJBJXKFSA-N 324.855 5.404 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1C 475546729 FKIQEBMMLJYAIU-MRXNPFEDSA-N 314.473 5.335 30 20 DKED N#CCC[C@@H](Nc1ccc2ccc(Cl)cc2n1)c1ccccc1 480447682 VXJLBOJVINSVPM-QGZVFWFLSA-N 321.811 5.345 30 20 DKED C=C[C@@H](CC(=O)N1CCCC[C@H]1c1ccccc1)c1ccccc1 545969102 DPKWMKQBXJBXCN-RXVVDRJESA-N 319.448 5.100 30 20 DKED C=CCC[C@@H](N[C@H](C)c1nccc2ccccc12)c1ccccc1 558493885 YDKUOWZEUSFMHZ-DYESRHJHSA-N 316.448 5.593 30 20 DKED C=CCCCSCc1csc(-c2cccc(OC)c2)n1 609803832 BNEMLSYPHZVONO-UHFFFAOYSA-N 305.468 5.018 30 20 DKED CCC/C(C)=C/C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 731331336 BZZZDUZHQJXIEN-NTCAYCPXSA-N 320.392 5.035 30 20 DKED C#CC[C@H](N[C@@H](C)c1cc2ccc(C)cc2o1)c1ccccc1 756040275 JBMFMBKRJVLDJX-LPHOPBHVSA-N 303.405 5.156 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2cccc(-c3cccnc3)c2)c1 763287405 CJFYBBXGJZIZTO-CSKARUKUSA-N 317.363 5.092 30 20 DKED C=CC[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccncc1 766017749 CSSYRAOUTICKQG-WBMJQRKESA-N 321.251 5.356 30 20 DKED CCc1c(C(=O)/C=C\c2scnc2C2CC2)oc2ccccc12 782312330 IXZWCLBUKIFWLX-KTKRTIGZSA-N 323.417 5.225 30 20 DKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1cscn1 799891909 JGOGHCGLUCRWFN-VEQVDCDKSA-N 323.339 5.004 30 20 DKED CCCCCCCCCC(=O)N1CC(C)(C)[C@H]1c1cccnc1 814135445 XJIOPMZVGYTPEV-LJQANCHMSA-N 316.489 5.132 30 20 DKED N#C[C@@H]1CC[C@@H](Sc2ccc(Cl)c(C(F)(F)F)c2)C1 430089432 NHTYACKMCHLQRV-RKDXNWHRSA-N 305.752 5.143 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CCSCC1 530560552 QCUNEIBIBNWVAU-UHFFFAOYSA-N 317.498 5.010 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2o1 551207005 YVWCEOKOPOGWKX-QFBILLFUSA-N 318.420 5.519 30 20 DKED Cc1cccc(C(=O)/C=C\c2csc(-c3cccs3)n2)c1 728439536 MKTMSKCIHFFPPA-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C=CC[C@H](N[C@H](C)c1ccccc1SCC)c1ccncc1 766022989 YVEDNZQOMBYQIA-QAPCUYQASA-N 312.482 5.162 30 20 DKED C=CC[C@H]1CCN1C(=O)Nc1c(C(C)C)cccc1C(C)C 929142141 NQNCARDIATYNTE-HNNXBMFYSA-N 300.446 5.116 30 20 DKED C[C@@H](SCCC(C)(C)C#N)c1ncc(-c2ccccc2)o1 289383413 KTAAFYXEJCDLJR-CYBMUJFWSA-N 300.427 5.076 30 20 DKED CCC[C@@](C)(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 483467265 BILSGJTZOBQQNQ-KBXCAEBGSA-N 318.486 5.093 30 20 DKED N#C[C@@H](Sc1nc2cc(Cl)ccc2o1)C1CCCCC1 524532474 WAUKBMLNZYRVBR-CQSZACIVSA-N 306.818 5.046 30 20 DKED CC1(C)CC[C@@H]2C[C@H](NCc3cc(C#N)cs3)c3cccc1c32 538487687 TUJVNQAQSDPLAL-KDOFPFPSSA-N 322.477 5.009 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H]2CCCC(C)(C)C2)n1 756573248 WYXSYHDCHSAOFB-UONOGXRCSA-N 318.486 5.049 30 20 DKED C=CC[C@@H](N[C@H]1CCSc2cc(C)c(C)cc21)c1ccncc1 779023677 HTFMHFSFBSQCPS-MOPGFXCFSA-N 324.493 5.142 30 20 DKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 805947912 VKEYDCKBQGXJCL-ZDUSSCGKSA-N 320.502 5.223 30 20 DKED N#Cc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)c1 834784433 WZFIOJOLNKYBSB-KTKRTIGZSA-N 315.397 5.183 30 20 DKED CCCc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550834681 BXDZVJCNLVUDDN-AVRDEDQJSA-N 320.480 5.725 30 20 DKED CC(C)Sc1ccc(Cl)cc1NC(=O)CCCCCC#N 588753699 NSMDGKAKTPFJDT-UHFFFAOYSA-N 324.877 5.253 30 20 DKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1F 613114009 QTHUJJWOQKDYNX-YVEFUNNKSA-N 316.807 5.153 30 20 DKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(F)cc3)s2)cc1 734303346 MCOMSNPTROBXBO-KHPPLWFESA-N 323.392 5.154 30 20 DKED O=C(/C=C/c1ccc(Cl)cc1Cl)c1cc(F)ccc1F 916133363 JFUXQGYUXQCMSL-QHHAFSJGSA-N 313.130 5.168 30 20 DKED CCc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)s1 194339417 NOMSGCSXAXAKDW-AWEZNQCLSA-N 314.454 5.166 30 20 DKED Cc1ccc(C(F)(F)F)cc1N[C@H](C)c1cccc(C#N)c1 317026196 UMDAUNIGDZOIKE-GFCCVEGCSA-N 304.315 5.059 30 20 DKED N#C[C@H]1CCC[C@H](Nc2ccc(SC3CCCC3)cc2)C1 463290608 WOTDNQUOFOEKAF-HOCLYGCPSA-N 300.471 5.216 30 20 DKED CC#CCCCC(=O)Nc1ccc(Cl)cc1-c1ccccc1 468296417 NDDTULNTZQHZLJ-UHFFFAOYSA-N 311.812 5.139 30 20 DKED N#Cc1cccc(CNc2ccccc2Sc2ccccc2)c1 574092470 QHSMUTKJLSRHJP-UHFFFAOYSA-N 316.429 5.322 30 20 DKED CC1(C)CCC(CC(=O)[C@H](C#N)c2ccc3ccccc3n2)CC1 752473406 HARRNSHNBYDQIQ-QGZVFWFLSA-N 320.436 5.018 30 20 DKED CCCCCCCC(=O)N(C)[C@H](C)c1nc2ccccc2s1 886732007 UABFIBQWDUQGTM-CQSZACIVSA-N 318.486 5.176 30 20 DKED CC(/C=C\c1ccc(C#N)cn1)=C/c1cccc(C(F)(F)F)c1 486121137 AYMYEZFXHYJUHV-YYKSKGJFSA-N 314.310 5.089 30 20 DKED N#Cc1ccc(CN[C@@H](c2ccccc2)C2CCCCC2)s1 561355799 MCUSTUBSRWTPSG-IBGZPJMESA-N 310.466 5.031 30 20 DKED CC[C@@H](C)Oc1ccc(N[C@H](C)c2ccc(C#N)cc2F)cc1 781423900 ZITHGZKRIZJQQT-ZIAGYGMSSA-N 312.388 5.048 30 20 DKED CC(=NNc1ccccc1Cl)c1sc(C(C)(C)C)nc1C 915109570 APLLLOAVCIJNTC-UHFFFAOYSA-N 321.877 5.239 30 20 DKED CC(=NNc1cccc2ncccc12)c1oc2ccccc2c1C 915964977 XYMPCCQIBZNBJV-UHFFFAOYSA-N 315.376 5.126 30 20 DKED Cc1ccc([C@@H](C)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 49185827 FIRNXPXIWWBCPF-SNVBAGLBSA-N 310.344 5.120 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1C=C 489087529 IWNOZFXXBPCZMR-KRWDZBQOSA-N 312.457 5.111 30 20 DKED CCC(CC)[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cccs1 539498705 QAOWSTHZASCNAM-LIRRHRJNSA-N 312.482 5.448 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)CC(C)(C)CCC#N 539849620 HJSVATGNVYCQEH-CABCVRRESA-N 306.881 5.094 30 20 DKED CCCCCCCC(=O)Nc1cc(-c2ccncc2)ccc1C 726152622 PQQNPNILEXJSFI-UHFFFAOYSA-N 310.441 5.356 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 747194166 VQZAUNNWWZKZSP-KGLIPLIRSA-N 306.475 5.049 30 20 DKED CC[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 37748433 VLWBPPVKBGIERS-KRWDZBQOSA-N 319.235 5.106 30 20 DKED COc1cccc2cc(/C=C/C(=O)c3cc4ccccc4o3)oc12 69130193 BANKPVUBMOFRPU-MDZDMXLPSA-N 318.328 5.084 30 20 DKED C[C@H](c1ccc(CSCCCCC#N)cc1)C(F)(F)F 419514689 HVFVSLPQJHGKDM-GFCCVEGCSA-N 301.377 5.279 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CC[C@@H](C)C1 429624109 SOLCVZMESIANGR-NVXWUHKLSA-N 314.473 5.191 30 20 DKED Cc1cc(C)c(CN[C@H](CCCC#N)c2ccccc2)c(C)c1 433014120 QWUUNYBPLXMYDZ-OAQYLSRUSA-N 306.453 5.137 30 20 DKED CC(C)(C#N)CCCCNC(C)(c1ccccc1)c1ccccc1 444684237 IYSJLDOQINHRPR-UHFFFAOYSA-N 320.480 5.260 30 20 DKED CC(C)(C#N)c1ccccc1CSCc1ncc(Cl)s1 478921582 VIHGXSNBSSDIDZ-UHFFFAOYSA-N 322.886 5.031 30 20 DKED C[C@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1 495402826 SKICEOHCXUGRGZ-KKSFZXQISA-N 304.437 5.140 30 20 DKED CC(C)c1ccc(NC(=O)CCCCCC#N)c(C(C)C)c1 588866635 AGAZKQSJPSXMNR-UHFFFAOYSA-N 300.446 5.346 30 20 DKED Cc1ccc2cc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)oc2c1 617304719 YFDAHQPXRRDGBZ-GJZGRUSLSA-N 304.393 5.025 30 20 DKED C[C@H](NCc1ccc(-c2ccsc2)cc1)c1cccc(C#N)c1 618302217 CWNKBOOQVWLDSL-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CCC[C@@H](C)CCCC(C)=NNc1ccc(Cl)c(C(=O)O)c1 1776034175 QVKGWOKXWHIZOO-GFCCVEGCSA-N 324.852 5.433 30 20 DKED C=CCCc1ccccc1NC(=O)CCc1ccc(Cl)s1 410365118 JYVXAMGSNNQTOK-UHFFFAOYSA-N 319.857 5.091 30 20 DKED CC(C)[C@@H]1C[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 447573706 IRZMBFJRLLFABG-FDFHNCONSA-N 318.464 5.506 30 20 DKED N#C[C@@H](Nc1ccccc1CCC(F)(F)F)C1CCCCC1 464789842 OZTICTJFJSOYGU-MRXNPFEDSA-N 310.363 5.066 30 20 DKED C=CCN(CC=C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 498855634 MQNCXMQEKXHTTG-HNNXBMFYSA-N 318.486 5.092 30 20 DKED Cc1ccc2c(c1)[C@H](Nc1cccc(OCCCC#N)c1)CCC2 538527167 UTMIKXMAIWZDLS-OAQYLSRUSA-N 320.436 5.167 30 20 DKED C[C@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)c(F)c1 539604169 IHNCVYLCXOSKFA-LSDHHAIUSA-N 318.395 5.262 30 20 DKED CC(C)c1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551810993 AEEWVYFDFPBHMP-MRXNPFEDSA-N 304.437 5.022 30 20 DKED C[C@H](S[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C#N)cc1 609825625 IYCFESUOUKUAKI-STQMWFEESA-N 312.394 5.022 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](c1ccc(Cl)cc1)C(C)C 614396151 ZNNDLTXIPFCFOH-LJQANCHMSA-N 312.844 5.007 30 20 DKED C=CCC[C@@H](N[C@H](C)c1nc(C)sc1C)c1ccccc1 678602217 BBSMOMZFPMSBGF-CXAGYDPISA-N 300.471 5.118 30 20 DKED C=CCCCCCN(C)C(=S)Nc1cccc(C(C)C)c1 739459662 SCIYEPWJOFWERW-UHFFFAOYSA-N 304.503 5.185 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(SC(C)(C)C)cc1 785759372 HGBGOTQPAOKVGR-HNNXBMFYSA-N 318.486 5.150 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1c(CC)cccc1CC 58854448 JUSRFXNRRLGBPV-UHFFFAOYSA-N 322.452 5.032 30 20 DKED C=CCCC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 78466557 GJOXPACXLGCVPG-INIZCTEOSA-N 309.409 5.040 30 20 DKED C=CCC[C@@H](C(=O)Nc1cc2[nH]ccc2cc1C)c1ccccc1 444443260 BAZHJKCXIBEGMN-GOSISDBHSA-N 318.420 5.165 30 20 DKED Cc1c(C#N)cccc1C(=O)Nc1c(C(C)C)cccc1C(C)C 509032020 VMIFYKNVFBFBJB-UHFFFAOYSA-N 320.436 5.366 30 20 DKED Cc1ccccc1[C@H](NCc1ccccc1C(C)(C)C#N)C1CC1 539493100 JERSSJORCFOCPI-OAQYLSRUSA-N 318.464 5.037 30 20 DKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@H](C)CC#N)cc1 597362021 JEHQBCZMZQHCBQ-CABCVRRESA-N 324.449 5.028 30 20 DKED CCC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccccc1 614179126 DIULMNUCFAAOMB-HXUWFJFHSA-N 306.453 5.119 30 20 DKED C=CC[C@H](N[C@@H]1CCSc2cc(C)c(C)cc21)c1ccncc1 779023703 HTFMHFSFBSQCPS-RBUKOAKNSA-N 324.493 5.142 30 20 DKED Cc1ccc(NC(=O)CCCCCC#N)cc1-c1ccsc1 874908482 CYWLTGPZGABVIV-UHFFFAOYSA-N 312.438 5.136 30 20 DKED CCCCCCCC/C=C/C/C=C/CCCCCCC(=O)O 102181997 XUJWOMMOEOHPFP-OKLKQMLOSA-N 308.506 6.665 30 20 DKED Cc1noc(C)c1[C@H](C)C/C(O)=N/[C@H]1CCCCC12CCCC2 329599079 DIXRFZKVSJALSJ-CJNGLKHVSA-N 318.461 5.245 30 20 DKED C[C@@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340444766 JKFPBDIJIGWWKB-MAODMQOUSA-N 304.437 5.260 30 20 DKED CC1(C)Cc2occc2[C@@H](N[C@@H](CCCC#N)c2ccccc2)C1 340450321 XDFQLJIPGFWDOQ-OALUTQOASA-N 322.452 5.318 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccccc1CCC=C 505024548 UYANURXTNMVIQS-UHFFFAOYSA-N 300.446 5.015 30 20 DKED CCC(CC)[C@@H](NCc1ccc(F)c(C#N)c1)c1cccs1 540378562 AEBWCFGVPYDXNG-GOSISDBHSA-N 316.445 5.026 30 20 DKED CCC(CC)[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1cccs1 561453976 AXCIWVBCIPTVEK-AUUYWEPGSA-N 312.482 5.448 30 20 DKED C=CCC[C@@H](NCc1cccc(-c2ccccn2)c1)c1ccco1 573824662 MGUKBOIVJVTBOT-HXUWFJFHSA-N 318.420 5.139 30 20 DKED N#CCCC[C@@H](NCc1cccc(C(F)F)c1)c1ccccc1 433022109 TVPMCZCPVHQGOV-GOSISDBHSA-N 314.379 5.149 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 480669937 OINUTAAVWDMJJG-VOJFVSQTSA-N 323.333 5.211 30 20 DKED Cc1cc(SC(C)(C)C)ccc1NCc1ccccc1C#N 725795529 XJFPARWARKZBBW-UHFFFAOYSA-N 310.466 5.369 30 20 DKED CCC/C(C)=C\C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 731331337 BZZZDUZHQJXIEN-QINSGFPZSA-N 320.392 5.035 30 20 DKED Cc1ccsc1C(=O)/C=C/c1nc(-c2ccccc2)cs1 733749030 QFPNDDYILBGWDA-BQYQJAHWSA-N 311.431 5.076 30 20 DKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc(C(C)C)cs1 747198184 UKPFVNYMBQOOLI-KBPBESRZSA-N 306.475 5.049 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc2ccccc2c1)c1ccncc1 749128821 MCHIULFMRKQWNC-IIBYNOLFSA-N 302.421 5.203 30 20 DKED CC[C@@H](C)c1ccccc1OC(=O)C[C@H](CC#N)c1ccccc1 796523030 CCCPWXJECJRDBO-AEFFLSMTSA-N 321.420 5.193 30 20 DKED C[C@@H](OC(=O)CCCCCC#N)c1cc(Cl)ccc1Cl 805698225 XQBQKURKWWCIKO-LLVKDONJSA-N 314.212 5.072 30 20 DKED Cc1nc(SCCCCC(C)(C)C#N)[nH]c1-c1ccccc1 436254436 QWVDKAIFSXEBGN-UHFFFAOYSA-N 313.470 5.197 30 20 DKED Cc1cccc2c1[C@@H](C)C[C@H]2Nc1cccc(OCCCC#N)c1 538527926 IRHHRODMVUROTR-OXJNMPFZSA-N 320.436 5.338 30 20 DKED C=CCC[C@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)C1CC1 538628180 MCZQGCWVXVOFTK-KRWDZBQOSA-N 314.473 5.136 30 20 DKED Cc1ccccc1[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C(C)C 539608288 CFPFEWJDKBESPN-YWZLYKJASA-N 310.416 5.054 30 20 DKED C=CCC[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccco1 552071188 UIEDEFOXSYLHLW-HNNXBMFYSA-N 309.331 5.504 30 20 DKED CC(C)c1ccc2c(Cl)c(C(=O)O[C@@H](C)CC#N)sc2c1 733709115 BDFJVQLQZDSYFT-JTQLQIEISA-N 321.829 5.137 30 20 DKED Cc1ccc2ccccc2c1CNc1ccccc1O[C@@H](C)C#N 779743542 PJTNUXIDKODBTH-INIZCTEOSA-N 316.404 5.051 30 20 DKED C[C@H](C=NOCc1ccccc1)c1ccc(C(F)(F)F)cc1 788974920 IGAZIWDBKXCXMT-CYBMUJFWSA-N 307.315 5.012 30 20 DKED CC(C)(C)c1cnc(/C=C/C(=O)c2coc3ccccc23)s1 790601255 SKJMQPGOKCWHAK-CMDGGOBGSA-N 311.406 5.083 30 20 DKED COc1ccc2cc(N[C@@H](C)c3ccc(C#N)cc3F)ccc2c1 797024277 ZHMJISLHRPYAJW-ZDUSSCGKSA-N 320.367 5.032 30 20 DKED C[C@H](Nc1ccc(SC(F)F)cc1)c1cccc(C#N)c1 37271212 KIHQTVBMHQLKMI-NSHDSACASA-N 304.365 5.046 30 20 DKED N#CCC[C@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 130608271 CGQHTYAUWVDFNU-FQEVSTJZSA-N 316.404 5.081 30 20 DKED C=CCC[C@@H](NCc1ccc(C(F)F)cc1)c1ccccc1 461373438 NLKFJXHGFIHYEA-GOSISDBHSA-N 301.380 5.421 30 20 DKED CC[C@H](C)Oc1cccc(N[C@H](C)c2ccc(C#N)c(F)c2)c1 559876891 IVHJJWMGPVFWJZ-UONOGXRCSA-N 312.388 5.048 30 20 DKED CSc1ccc2c(c1)[C@H](N[C@@H](C)c1cccc(C#N)c1)CCC2 592387615 YFNXJRRVYLEOSS-VBKZILBWSA-N 322.477 5.008 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(C#N)CCCCC1 597554387 IIYCKAAJSBIJMC-UHFFFAOYSA-N 324.468 5.341 30 20 DKED C#Cc1cccc(NC(=S)Nc2ccc(CCC(C)C)cc2)c1 726486027 YCSUEYMQBYUXHB-UHFFFAOYSA-N 322.477 5.065 30 20 DKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1SC(C)(C)C 834880171 LUPUFFAJADSREY-PMPSAXMXSA-N 316.514 5.310 30 20 DKED N#Cc1ccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc1 916132341 YZIFKJKRLPSCGC-LUAWRHEFSA-N 323.351 5.354 30 20 DKED CC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1cccs1 481667664 HCQFXYGITFCIGC-MSOLQXFVSA-N 310.466 5.128 30 20 DKED CC(C)(C)C[C@H](NCc1ccc(CC#N)cc1)c1ccccc1 542255062 AVZYUVXWIXNUME-FQEVSTJZSA-N 306.453 5.020 30 20 DKED Cc1cccc([C@H](NCC(C)(C)CCC#N)c2cccc(F)c2)c1 562036399 WIYWQZHODONKGS-FQEVSTJZSA-N 324.443 5.143 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](c1ccccc1Cl)C(C)C 614407499 SLAPMQSBUDNVMF-IBGZPJMESA-N 312.844 5.007 30 20 DKED FC(F)(F)C1CCC(C=NNc2ccccc2Cl)CC1 767356843 CWYGQNBRESXFEE-UHFFFAOYSA-N 304.743 5.106 30 20 DKED CC[C@H](C)c1ccccc1OC(=O)C[C@@H](CC#N)c1ccccc1 796523068 CCCPWXJECJRDBO-FUHWJXTLSA-N 321.420 5.193 30 20 DKED CC(/C=C/C(=O)c1cscn1)=C\c1ccccc1C(F)(F)F 799891906 JGOGHCGLUCRWFN-HRCSPUOPSA-N 323.339 5.004 30 20 DKED CC(=NNc1nccc2sccc12)c1cc(C)c(C)cc1C 915979880 MVSKXNBLCLCORV-UHFFFAOYSA-N 309.438 5.058 30 20 DKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cccc(C#N)c1 519907826 IHJBNWFEVWONQN-LBPRGKRZSA-N 319.235 5.058 30 20 DKED CN(Cc1ccccc1)c1ccccc1NCC(C)(C)CCC#N 537723657 LUAHECDDSYVAHL-UHFFFAOYSA-N 321.468 5.065 30 20 DKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCC(C)(C)C#N)C1 538487959 HCIJCINELOXKON-CZUORRHYSA-N 324.390 5.028 30 20 DKED CCc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550828964 QDNXAZHFHATPHV-UWJYYQICSA-N 306.453 5.335 30 20 DKED C=CC[C@@H](N[C@@H](CCC)c1ccc(Cl)cc1)c1ccncc1 766021873 VFXPTDFHQOZHLT-RBUKOAKNSA-N 314.860 5.483 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)=C1CCCC1 789721190 YTQJQYDTUJIAKB-UHFFFAOYSA-N 301.405 5.275 30 20 DKED N#Cc1ccc(C(=O)/C=C\c2ccc(C(F)F)cc2)c(Cl)c1 794949960 RPWYPOWXXUYBSH-YWEYNIOJSA-N 317.722 5.045 30 20 DKED CC(/C=C\C(=O)c1cscn1)=C\c1ccccc1C(F)(F)F 799891905 JGOGHCGLUCRWFN-BQGCWICQSA-N 323.339 5.004 30 20 DKED CCC[C@@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 154329681 JGXXMIALUOWSSO-HUUCEWRRSA-N 318.486 5.092 30 20 DKED C[C@H](Nc1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 302929295 DNUBKCZUJINCLT-INIZCTEOSA-N 314.388 5.524 30 20 DKED N#Cc1ccc(CSCc2c(Cl)ccc3cccnc23)cc1 498124462 XRPOFRBMPOZWCF-UHFFFAOYSA-N 324.836 5.193 30 20 DKED C=CCC[C@H](Nc1cnn(CC(C)C)c1C(F)F)c1ccco1 574351185 GWJXOOYXYIHFHJ-ZDUSSCGKSA-N 323.387 5.189 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1ccc2[nH]ccc2c1 729038612 AOSFPHGHNMYMPS-UHFFFAOYSA-N 315.461 5.382 30 20 DKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567519 JOWHJRRYRQPXIA-KBPBESRZSA-N 320.502 5.223 30 20 DKED CCCCCCCC(=O)N1CCC[C@H]1c1ccccc1Cl 113217176 SOVXZRHYBFYOBX-KRWDZBQOSA-N 307.865 5.364 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(F)(F)CC1 189884716 BAHVNLPLBPANAQ-UHFFFAOYSA-N 321.411 5.303 30 20 DKED CC(C)(C#N)CCCCN[C@H](c1ccc(F)cc1)C(C)(C)C 444652239 XIDNWKSHGXAODS-QGZVFWFLSA-N 304.453 5.223 30 20 DKED C=CCCCCCN(C)C(=O)c1ccc(SC(C)C)cc1 606816371 UUNZTPDDFRPZMO-UHFFFAOYSA-N 305.487 5.006 30 20 DKED N#C[C@H](Cc1ccccc1)SCc1ccc(C(F)(F)F)cc1 619460485 KYSXDFAPTZOKMV-INIZCTEOSA-N 321.367 5.073 30 20 DKED CC(=NNc1cccc2ccccc12)c1cnc2ccsc2c1 739410333 UISSLLJOQKRWMP-UHFFFAOYSA-N 317.417 5.286 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1csc2ccccc12 769798685 XOSNJYDOJOZVHL-AWEZNQCLSA-N 300.471 5.272 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2csc(Cl)c2)s1 787186588 PIJPUXWPNDDDDZ-SNAWJCMRSA-N 311.859 5.052 30 20 DKED CCCCCCCCCC(=O)[C@H](C#N)c1nc2ccccc2o1 917510116 OMXQPEICYCBUAI-HNNXBMFYSA-N 312.413 5.145 30 20 DKED CCCc1ccc([C@H](N[C@H]2CC[C@@H](C#N)C2)c2cccs2)cc1 442640019 ZIZARMWGGFGMQN-KPFFTGBYSA-N 324.493 5.072 30 20 DKED C[C@@H](SCCC(C)(C)C#N)c1ccc(OC(F)(F)F)cc1 463250316 KOHNQPKOXORURX-LLVKDONJSA-N 317.376 5.319 30 20 DKED CC[C@H](N[C@H](c1ccc(F)cc1)C(C)C)c1ccc(C#N)cc1 503885148 KELAXDDBXHIRMA-PMACEKPBSA-N 310.416 5.135 30 20 DKED COc1cc(Cl)c(Cl)cc1N[C@@H](C)c1cccc(C#N)c1 600850093 UFBBVCPGRQQABT-JTQLQIEISA-N 321.207 5.047 30 20 DKED CC(C)Sc1ccc(Cl)cc1NCc1ccc(C#N)cc1 609221018 FZRNBYGYGBHPMA-UHFFFAOYSA-N 316.857 5.324 30 20 DKED Cc1cccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)c1 727264045 MRLKAHSWOMSAPJ-KHPPLWFESA-N 305.402 5.015 30 20 DKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccccc2)cc1 742429005 CJQKMIDUFPVOMH-QXMHVHEDSA-N 305.402 5.015 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1ccc(Cl)s1 742437280 SEWVSAQCEUVHDH-LOBLAWFCSA-N 312.868 5.224 30 20 DKED CC1(C)CCC(CC(=O)[C@@H](C#N)c2nccc3ccccc23)CC1 792105453 MIZSCPOLZZWBHP-GOSISDBHSA-N 320.436 5.018 30 20 DKED CCC/C(C)=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 920221019 KCFADUKTTMPCQW-HZMYXVCSSA-N 318.420 5.027 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2sccc2[nH]1 192222666 RSDYUSCPDCLXDJ-UHFFFAOYSA-N 324.449 5.334 30 20 DKED Cc1ccccc1C1CC(Nc2cccc(OCCCC#N)c2)C1 237700688 VSGJNBGFVFYFSJ-UHFFFAOYSA-N 320.436 5.036 30 20 DKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329013790 PKQXUAXTKIOIMI-JCGIZDLHSA-N 314.429 5.489 30 20 DKED C[C@@H]1C[C@@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 391788228 FSJFKMQYPQTJCX-FOIQADDNSA-N 306.409 5.030 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC(C)(C)C 476519374 NDGMAXKJZAUQCF-KGLIPLIRSA-N 318.486 5.092 30 20 DKED Cc1ccc2c(c1)[C@@H](Nc1cccc(OCCCC#N)c1)[C@@H](C)C2 494952534 OTVFLPBPZDASCW-KKSFZXQISA-N 320.436 5.023 30 20 DKED C[C@@H](SCCCC1(C#N)CCOCC1)c1ccccc1Cl 541881386 RQLAFHMSIPKYKP-CQSZACIVSA-N 323.889 5.235 30 20 DKED O=C(/C=C/c1csc(-c2cccs2)n1)C1CCCCC1 728438943 CSMVPRYLGIFREX-CMDGGOBGSA-N 303.452 5.034 30 20 DKED Cc1ccsc1C(=O)/C=C\c1cnc(-c2cccs2)s1 751514083 PLKVHPKYAJTDLA-PLNGDYQASA-N 317.460 5.138 30 20 DKED C#CC[C@@H](N[C@H](C)c1ccccc1SCC)c1ccccc1 773103975 CVUWCGSBPCSLQY-VQIMIIECSA-N 309.478 5.214 30 20 DKED C=CCC[C@H](NCc1ccc(Cl)nc1Cl)c1ccccc1 801530308 BEBOOPINQZRJCD-HNNXBMFYSA-N 321.251 5.186 30 20 DKED C=CCCC[C@@H](N[C@@H]1CCCc2oc(C)nc21)c1ccccc1 926857043 ZZYNBMJXJUXDHT-QZTJIDSGSA-N 310.441 5.048 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C#N)cc1 340450957 YPZIBSMIDPIIAT-LEWJYISDSA-N 317.436 5.034 30 20 DKED Cc1ccccc1[C@@H](N[C@H](C)c1ccc(C#N)cc1F)C(C)C 512659997 KYBUEMIVEZVJFT-QRWLVFNGSA-N 310.416 5.054 30 20 DKED C=CCC[C@H](Nc1cccc(C2CCOCC2)c1)c1ccco1 527995236 NAJFXKITUBKGEN-IBGZPJMESA-N 311.425 5.293 30 20 DKED CC(C)C[C@@H](NCCCCC#N)c1cccc(C(F)(F)F)c1 531960501 UMMDVPXYDAJTCI-MRXNPFEDSA-N 312.379 5.076 30 20 DKED C[C@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1cccc(C#N)c1 613242442 DOBZGGCPVDCSFR-CVEARBPZSA-N 322.452 5.147 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccccc3Cl)co2)cc1 749886373 MDTKAFGUIBCSRF-KHPPLWFESA-N 323.779 5.200 30 20 DKED CC[C@@H]1C[C@H](C=NN(c2ccccc2)c2ccccc2)CCO1 779751049 AYDADCTVTGJHEY-YLJYHZDGSA-N 308.425 5.016 30 20 DKED CCCCCCCC[C@@H](C)C(=O)N1CCC[C@H]1c1cc(C)on1 820893027 FAYFOVDJLBKYTF-QAPCUYQASA-N 320.477 5.033 30 20 DKED C[C@@H](N[C@H](C)c1ccc(C(F)(F)F)s1)c1cccc(C#N)c1 902827758 OOPUZLRDVREHIM-GHMZBOCLSA-N 324.371 5.050 30 20 DKED C=CCC[C@H](NCc1ccc(F)cc1CSC)c1ccco1 428461384 PTZCTUKRBHCXNW-KRWDZBQOSA-N 319.445 5.079 30 20 DKED CC[C@@H](N[C@@H](C)c1ccccc1SC)c1ccc(C#N)cc1 442867557 YYURRVZFFPWYJZ-KBXCAEBGSA-N 310.466 5.082 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(C)cc1 505023157 JYRHBRBTGDNSPM-KRWDZBQOSA-N 322.452 5.339 30 20 DKED CC[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 609427789 LRGQCFLMCKDSOC-CABCVRRESA-N 318.486 5.092 30 20 DKED Cc1ccsc1C(=O)/C=C/c1cc(C(F)(F)F)ccc1F 733749537 NPMAKKNULIXLNH-GORDUTHDSA-N 314.303 5.111 30 20 DKED C=CC[C@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccncc1 762477072 SVPRYXADBZLAKI-RBUKOAKNSA-N 312.844 5.019 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1 191436865 HTDFYPCSNGXZAP-UHFFFAOYSA-N 322.452 5.202 30 20 DKED Cc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1C 195656641 VXTNAKRVXWMPDY-QGZVFWFLSA-N 308.425 5.159 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 481585071 HPQYOLIKUNWMPJ-BBATYDOGSA-N 323.333 5.211 30 20 DKED Cc1nc(-c2ccc([C@H](C)Nc3ccc(C#N)cc3)cc2)cs1 507197886 XSMWGRPYJJDOBX-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED Cc1ncsc1/C=C/C(=O)c1cccc(-c2ccccc2)c1 742433256 UXOLCZDOCBPIIK-ZHACJKMWSA-N 305.402 5.015 30 20 DKED CC(C)CCOc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1 745225215 VWSNYXKHJSLBKG-INIZCTEOSA-N 308.425 5.156 30 20 DKED C#CCCCCC(=O)Nc1ccccc1SCc1ccccc1 773204594 GLWUWVUVNOMXGD-UHFFFAOYSA-N 323.461 5.111 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(CF)cc1 777542657 WPFLEIWOIWYQPS-AWEZNQCLSA-N 314.429 5.162 30 20 DKED C=C(Cl)COc1ccc([C@@H](C)NCc2cscc2C)cc1 786924515 BRQYVWBSMPEODZ-CQSZACIVSA-N 321.873 5.039 30 20 DKED Fc1c(Cl)cccc1NN=Cc1cscc1C(F)(F)F 811640705 XLEFECKPDHEMEZ-UHFFFAOYSA-N 322.714 5.005 30 20 DKED CCCC(=CC(=O)N[C@H](CCCC#N)c1ccccc1)CCC 817312405 CIDJNVFRHDFMAC-LJQANCHMSA-N 312.457 5.064 30 20 DKED C=CCC[C@@H](C(=O)Nc1ccsc1Cl)c1ccccc1 187848683 QCNWGMZYTKLYDV-CYBMUJFWSA-N 305.830 5.090 30 20 DKED N#CCCCOc1cccc(NCc2csc3ccccc23)c1 237827001 FEWWCSCOINYDEC-UHFFFAOYSA-N 322.433 5.196 30 20 DKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 303765088 LTAJGMCHPCUDPV-INIZCTEOSA-N 314.388 5.524 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(C)n(C(C)C)c1C 504290716 UXYMSSWCUDBDMH-UHFFFAOYSA-N 310.441 5.057 30 20 DKED C=CCCc1ccccc1NC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 505028880 JPFRZXFJDYMHMQ-OXJNMPFZSA-N 320.436 5.030 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cc2ccccc2s1 512668847 WVUXABQPJCWRHO-OLZOCXBDSA-N 324.424 5.324 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccccc1SCC 568902466 MENCFKZFMZUTHK-UHFFFAOYSA-N 311.450 5.170 30 20 DKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc2ccccc12 619746888 QVBACHHPSIIUHQ-AWEZNQCLSA-N 320.823 5.216 30 20 DKED CC(C)(C#N)CCCCN1CCC(c2cc3ccccc3[nH]2)CC1 769706720 WYYGFQZDOSDVST-UHFFFAOYSA-N 323.484 5.067 30 20 DKED C=CCC[C@H](N[C@@H]1CCc2ccc(Cl)nc21)c1ccccc1 788673801 YHGLOMYPOIAHTQ-DLBZAZTESA-N 312.844 5.019 30 20 DKED COc1cc(C(=O)/C=C/c2ccsc2Cl)ccc1SC 790214511 DGPQIYNBEFDDHQ-HWKANZROSA-N 324.854 5.028 30 20 DKED CCCC(C)(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 426322177 HKBXELAYGZRPQH-AWEZNQCLSA-N 318.486 5.236 30 20 DKED CC[C@H](N[C@H](C)c1cc2ccccc2o1)c1ccc(C#N)cc1 447517596 SWQTUIIFNSSMAQ-KDOFPFPSSA-N 304.393 5.106 30 20 DKED C[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1csc(Cl)c1 594517242 JCNDEPWQMPOFFC-LBPRGKRZSA-N 316.857 5.003 30 20 DKED Cc1ccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2F)s1 733206515 MKGZJYVETDGCPE-ZZXKWVIFSA-N 314.303 5.111 30 20 DKED N#Cc1cc(Cl)ccc1CNc1ccc(SC(F)F)cc1 774280356 YXJQKQODLWEMEG-UHFFFAOYSA-N 324.783 5.138 30 20 DKED CC[C@@H](C)Oc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 776869935 SLWAFNHNCJPJOW-KGLIPLIRSA-N 312.388 5.048 30 20 DKED C[C@@H](Nc1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 302929298 DNUBKCZUJINCLT-MRXNPFEDSA-N 314.388 5.524 30 20 DKED N#CCC[C@@H](N[C@@H]1CCCc2c(Cl)cccc21)c1ccccc1 349756917 JABNFHCRAVQXSZ-WOJBJXKFSA-N 324.855 5.352 30 20 DKED C[C@H](NCC1(CC#N)CC1)c1ccc(SC2CCCC2)cc1 430745781 FKJVRBQYCQDMHC-HNNXBMFYSA-N 314.498 5.066 30 20 DKED C[C@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(C#N)c(F)c1 538508053 SYSHQARJLLKVLC-YCRPNKLZSA-N 322.427 5.279 30 20 DKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H](c1ccccc1)C1CCC1 611391880 CQEBHJFRZIWCQS-FGZHOGPDSA-N 316.448 5.067 30 20 DKED CC(C)N(CCCC#N)Cc1ccc(-c2cccc(F)c2)s1 63614901 VPPXUZCLMSACMZ-UHFFFAOYSA-N 316.445 5.068 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H](CC)c1ccc(F)cc1 410362909 DJLIEFIYJBHWOE-SFHVURJKSA-N 311.400 5.077 30 20 DKED CCCC(C)(C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 469412684 VWZDVOBVYXMTEC-AWEZNQCLSA-N 318.486 5.093 30 20 DKED C[C@@H](S[C@@H](C#N)Cc1ccccc1)c1ccc(Cl)cc1 604485847 VXMITCZOSUXRLY-CXAGYDPISA-N 301.842 5.269 30 20 DKED CC[C@H](NCc1ccc(C#N)cc1F)c1cccc2ccccc12 615085941 WCVPUWLHVMOUHX-NRFANRHFSA-N 318.395 5.091 30 20 DKED O=C(/C=C\c1nccc2ccccc12)c1ccc2c(c1)CCCC2 740765135 QNSCFWIJZCTXOU-QXMHVHEDSA-N 313.400 5.010 30 20 DKED O=C(/C=C\c1ccc2oncc2c1)c1cc2cc(Cl)ccc2o1 821030839 CRPCWGGXBCIQTO-RJRFIUFISA-N 323.735 5.124 30 20 DKED N#CCCc1ccc(N[C@H]2CC3(CCC3)Oc3ccccc32)cc1 903298777 ZJLZRBCAKUCHQV-IBGZPJMESA-N 318.420 5.001 30 20 DKED CCCC[C@@H](CC)CC(CC)=NNc1ccc(F)c(C(=O)O)c1 1776064987 PFWOQKSHTIJTHM-CYBMUJFWSA-N 322.424 5.308 30 20 DKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1ccccc1[N+](=O)[O-] 443162711 SWLPEMAVCUHMMW-OLZOCXBDSA-N 312.394 5.022 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cc2[nH]ccc2cc1C 444451251 SSTMNXCPWRUKOC-UHFFFAOYSA-N 322.433 5.007 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1sccc1Cl 453080644 FPSYADKPUJJQMG-LLVKDONJSA-N 322.886 5.408 30 20 DKED C=C(C)CN(C)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471400597 BDWLFRLIGACJDK-UHFFFAOYSA-N 314.816 5.047 30 20 DKED N#Cc1cccc(CN[C@H]2CCc3ccc(-c4ccccc4)cc32)c1 495151838 AASJSOQGKVRZDH-QHCPKHFHSA-N 324.427 5.002 30 20 DKED N#CCCCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 619247898 HWDVFWZGUAXYJZ-SFHVURJKSA-N 315.869 5.856 30 20 DKED C=C(Cl)COc1ccc([C@H](C)NCc2sccc2C)cc1 765335782 YVXQENIDOCXYNQ-AWEZNQCLSA-N 321.873 5.039 30 20 DKED O=C(/C=C\c1cccc(-c2cccnc2)c1)c1c[nH]c2ccccc12 768496287 SOGBIPPKPXZIHV-KHPPLWFESA-N 324.383 5.126 30 20 DKED CCCCC1CCC(C(=O)[C@H](C#N)c2nc3ccccc3o2)CC1 915104503 DBIRAFRLWFGZOK-GPANFISMSA-N 324.424 5.001 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 195656649 BSKIUOBBVNVJIJ-CQSZACIVSA-N 314.816 5.196 30 20 DKED CC(C)Sc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 531950921 DSNZCFCBASUJBX-CVEARBPZSA-N 324.493 5.471 30 20 DKED C[C@@H](Nc1ccc2nc(C3CC3)sc2c1)c1ccc(C#N)cc1 610341831 YYJYQEAORDDKGF-GFCCVEGCSA-N 319.433 5.218 30 20 DKED C=CCOc1cccc(CN[C@@H](CC(C)C)c2cccs2)c1 616029307 VFCFKJWQOBPVKV-SFHVURJKSA-N 315.482 5.190 30 20 DKED Cc1ccc([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)s1 795785866 DQZUJVWOMMEVBJ-KSSFIOAISA-N 310.466 5.047 30 20 DKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccsc2)cc1 800986313 FUKDDYMUYFZDSF-UONOGXRCSA-N 321.873 5.291 30 20 DKED Cc1nc(C)c(-c2csc(N=C(O)C3(C)CCCC3)n2)s1 329330330 LPEUPBRSICCHML-UHFFFAOYSA-N 321.471 5.052 30 20 DKED N#Cc1cccc(SCc2ccc(Cl)c3cccnc23)c1 435027294 LZGYUUMVWOSZPI-UHFFFAOYSA-N 310.809 5.052 30 20 DKED N#CCCSc1ccccc1NCc1ccc(Cl)s1 475040694 VAMHZAIFOWPWLI-UHFFFAOYSA-N 308.859 5.019 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 480703357 XVFSOPXIYVOHKO-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED N#Cc1cccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)c1 520959324 ARTMMYUDADMELL-FQEVSTJZSA-N 324.855 5.233 30 20 DKED CCN(CCC(C)(C)C#N)[C@H](C)c1cccc(C(F)(F)F)c1 540665220 MXNOFZPXVCKEJO-CYBMUJFWSA-N 312.379 5.028 30 20 DKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccoc1 541175357 IUKMMXKFUOQDCY-CVEARBPZSA-N 316.404 5.230 30 20 DKED CCCCCCCCCN(C)C(=O)c1csc(C(C)C)n1 726502144 GDNITKBPIUEGLM-UHFFFAOYSA-N 310.507 5.089 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2cnc(-c3ccccc3)s2)c1 763287332 BONZOPRCMRCJPT-CSKARUKUSA-N 323.392 5.154 30 20 DKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 805845271 RZXUQMARNWYANP-MRXNPFEDSA-N 308.425 5.018 30 20 DKED N#Cc1cccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)c1 818260947 UVUCUJHEDYEBIU-WDZFZDKYSA-N 315.397 5.183 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1 358344682 XDYFMXUIXNESCI-MOPGFXCFSA-N 312.844 5.426 30 20 DKED C[C@@H]1CC[C@@H](N[C@H](CCC#N)c2ccccc2)c2sccc21 453183382 YDJUZEHRCAWJEI-ZTFGCOKTSA-N 310.466 5.321 30 20 DKED C=CCC[C@@H](NCc1ccc(Cl)cc1C#N)c1ccccc1 480880359 VLKUBGYZWDNYGV-LJQANCHMSA-N 310.828 5.009 30 20 DKED CC(C)Oc1ccccc1-c1nc(-c2ccc(C#N)cc2)cs1 498106958 NUDHDAHNLWHTSS-UHFFFAOYSA-N 320.417 5.136 30 20 DKED N#CCCC[C@H](N[C@@H]1CC[C@@H](c2ccccc2)C1)c1ccccc1 559861907 DLTUDCRLALAWPB-VSKRKVRLSA-N 318.464 5.347 30 20 DKED N#CCOc1ccc(CSc2ccc3ccccc3c2)cc1 729242241 RQRJPNHBEDCEAG-UHFFFAOYSA-N 305.402 5.034 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 766018907 JQHFVCSFGAQQNM-PXAZEXFGSA-N 321.251 5.356 30 20 DKED Cc1nc(C)c(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)o1 821027106 DFIPIERBQJWDEE-SEYXRHQNSA-N 309.409 5.235 30 20 DKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1SC(C)(C)C 834880170 LUPUFFAJADSREY-JYJNAYRXSA-N 316.514 5.310 30 20 DKED CCCCCCCC(=O)O[C@H](c1ccccc1)c1ccncc1 920771091 KXFYVWNETMZDQX-HXUWFJFHSA-N 311.425 5.075 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ncco1)c1ccc(C(F)(F)F)cc1 925598199 QOZYKFVZQLOJLX-IUODEOHRSA-N 324.346 5.052 30 20 DKED C[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 127688628 RQRNZBVHOQENKF-ABAIWWIYSA-N 316.857 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC1(C)C 475553341 UMTJEBQINOCWBR-OAHLLOKOSA-N 314.473 5.191 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(F)c2ccccc12 551039152 MHCWFIYUOLWUQF-CABCVRRESA-N 318.395 5.262 30 20 DKED CSc1ccc(C(=O)/C=C\c2cnc(C(C)C)s2)cc1F 758434095 LTELFGKVVQTXBV-WAYWQWQTSA-N 321.442 5.024 30 20 DKED C#CC[C@@H](NCc1csc(C2CCCCC2)n1)c1ccccc1 775399263 QOLSBJPMOSTZQD-LJQANCHMSA-N 324.493 5.045 30 20 DKED CC(C)c1ccc([C@H](C)Nc2ccccc2O[C@H](C)C#N)cc1 780743956 CCVVHWLIHXUZTN-CVEARBPZSA-N 308.425 5.274 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccc(CC)cc1 799900550 MNNOVVZTQHVCJL-UHFFFAOYSA-N 310.466 5.177 30 20 DKED N#C[C@H](C(=O)CCCC1CCCCC1)c1ccc2ccccc2n1 916849438 UXTGGLXNCRFDCD-SFHVURJKSA-N 320.436 5.162 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1Cl 90665435 XHURBAOTQHWREO-SCLBCKFNSA-N 316.807 5.175 30 20 DKED COc1ccc(C(C)(C)C)cc1N[C@H](C)c1ccc(C#N)cc1 319742264 SQXCSXUNDCHINC-CQSZACIVSA-N 308.425 5.037 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 481585070 HPQYOLIKUNWMPJ-ADLMAVQZSA-N 323.333 5.211 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1cc(F)c(Cl)cc1Cl 558243964 NAAKSICQOKINNN-SNVBAGLBSA-N 317.235 5.113 30 20 DKED C=CCC[C@@H](NCc1coc(-c2ccc(C)cc2)n1)c1ccco1 560529042 IKTWQAGBFSMRHL-GOSISDBHSA-N 322.408 5.040 30 20 DKED N#CCCC[C@H](NC/C=C\c1ccc(Cl)cc1)c1ccccc1 590069143 CKLUNJUVPFNPBM-HCZHMGAMSA-N 324.855 5.378 30 20 DKED CCCCC[C@@H](C)CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 742575305 DRCDQJNDJYXBTM-SJORKVTESA-N 314.473 5.074 30 20 DKED C=CC[C@H](N[C@@H](CC)c1cccc(Cl)c1F)c1ccncc1 763537386 CTGAAOLNKOMYCM-IRXDYDNUSA-N 318.823 5.232 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc[nH]c1CCC 421864138 BAXPNSSFSXLFPP-UHFFFAOYSA-N 310.441 5.071 30 20 DKED C[C@@H](c1ccc2ccccc2c1)N(CCCSCC#N)C1CC1 466736411 WEWVZXDSWFHUED-INIZCTEOSA-N 324.493 5.012 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 466759981 CRDDHZJYYISFDT-CQSZACIVSA-N 312.413 5.006 30 20 DKED C[C@H](C#N)CSc1ccccc1NCCCc1ccsc1 541168143 FNFIKQXEGGAEIE-CQSZACIVSA-N 316.495 5.045 30 20 DKED C=CCC[C@@H](N[C@H]1CCCc2c(O)cccc21)c1ccccc1 565109653 HTELNAUDAYRVGU-UXHICEINSA-N 307.437 5.067 30 20 DKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1c[nH]c2cc(F)ccc12 741842722 GZYVDWJKFSWBIR-HWKANZROSA-N 323.298 5.088 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 90664722 NRVPSTWCRQWPHV-VQIMIIECSA-N 324.493 5.494 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90665107 ZVWOKEVNTSUNQJ-LSDHHAIUSA-N 318.873 5.487 30 20 DKED C=CCC[C@H](NCc1cnc(-c2ccco2)s1)c1ccccc1 193173399 UWFYYFAWRQUJDJ-KRWDZBQOSA-N 324.449 5.200 30 20 DKED C[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1cccc(C#N)c1 427874786 IIVXNJPQSBCNHK-VXGBXAGGSA-N 319.235 5.277 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1C[C@@H](C)C[C@H](C)C1 476170706 XOSKTEXQGYSPGW-HOTGVXAUSA-N 313.485 5.549 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 480703353 XVFSOPXIYVOHKO-BBATYDOGSA-N 323.333 5.211 30 20 DKED C=CCC1(C(=O)Nc2ccccc2COC(C)(C)CC)CCC1 485681758 YMHQMUQLKZODHA-UHFFFAOYSA-N 315.457 5.077 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 537950263 OUMHMEOVEAKKAJ-HTAPYJJXSA-N 314.432 5.535 30 20 DKED Cc1ccccc1C(=O)/C=C/c1nc(-c2ccccc2)cs1 727976273 OQKIIRXRPDTBEK-VAWYXSNFSA-N 305.402 5.015 30 20 DKED CCCCCCCCC(=O)N1CCC(n2c(C)ccc2C)CC1 751410356 HAYUBWABCKRCTH-UHFFFAOYSA-N 318.505 5.019 30 20 DKED C=CC[C@@H](N[C@H](C)c1cc2cc(C)c(C)cc2o1)c1ccncc1 766018470 HYPOPCZSEJIVOV-VQIMIIECSA-N 320.436 5.413 30 20 DKED C=C(C)CN(C)C(=S)Nc1c(C(C)C)cccc1C(C)C 777918258 LFUBBJFZWIKADK-UHFFFAOYSA-N 304.503 5.138 30 20 DKED C[C@@H](NN=Cc1ccccc1-c1ccccc1)c1ccccc1 920383267 VCHYLDUXDSDUFU-QGZVFWFLSA-N 300.405 5.038 30 20 DKED N#Cc1cnc(Oc2ccc(-c3ccccc3)cc2)c(Cl)c1 78727377 NUPSVNDGUHXZEM-UHFFFAOYSA-N 306.752 5.066 30 20 DKED Cc1cc(F)ccc1CNc1ccccc1S[C@@H](C)CC#N 181848549 GDBBQLAHKSMLCT-AWEZNQCLSA-N 314.429 5.141 30 20 DKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329013788 PKQXUAXTKIOIMI-BMGDILEWSA-N 314.429 5.489 30 20 DKED CC(C)(C)c1cnc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)o1 329153434 BPIAYUZCWXWBDL-RRFJBIMHSA-N 318.461 5.035 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1cccs1 417348789 JORKPFPOBJHUHR-QXCFHYIPSA-N 324.493 5.265 30 20 DKED COc1cc(C)ccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 556202710 RONHNNWEQGWZCW-XLIONFOSSA-N 322.452 5.089 30 20 DKED C=C(CN[C@H](C)[C@@H](C)c1nc2ccccc2s1)c1ccccc1 675783602 MBOAAGDVPGMTIF-HZPDHXFCSA-N 322.477 5.091 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1cc2oc3ccccc3c2cc1OC 767045933 IDBIJZWDLATLFZ-CYBMUJFWSA-N 323.392 5.135 30 20 DKED CCC/C(C)=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 920221020 KCFADUKTTMPCQW-KETLNSEPSA-N 318.420 5.027 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)CCC2 189880453 YDGHFGDRPHKQGV-UHFFFAOYSA-N 319.448 5.280 30 20 DKED CSc1ccc(C(=O)/C=C/c2cnc(C(C)C)s2)cc1F 758434094 LTELFGKVVQTXBV-AATRIKPKSA-N 321.442 5.024 30 20 DKED C#CC[C@@H](N[C@@H]1CCSc2cc(C)c(C)cc21)c1ccccc1 779039163 QFCXGFZCGLQSEG-WOJBJXKFSA-N 321.489 5.195 30 20 DKED Cc1ccc(-c2ccccc2NCc2cccc(C#N)c2F)s1 864032993 NAYTZRLCUGWHAY-UHFFFAOYSA-N 322.408 5.346 30 20 DKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(C)(C)C#N)cc1 267990742 WKGLFBPKRMYDII-AWEZNQCLSA-N 324.449 5.028 30 20 DKED N#CCCC[C@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 340428911 CCRFRKVAAORIPZ-RBUKOAKNSA-N 322.477 5.248 30 20 DKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1csc(Cl)c1 417375578 ZGTVMEFLTMRFRK-MEDUHNTESA-N 316.857 5.001 30 20 DKED N#C[C@@H](Cc1ccccc1)Sc1ccc(Cl)c(Cl)c1 610287885 WGUUNQLMXGBXIA-CYBMUJFWSA-N 308.233 5.220 30 20 DKED Cc1cc2cc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)oc2cc1C 610829875 QMECMJAAGWSTNI-HZPDHXFCSA-N 318.420 5.333 30 20 DKED N#Cc1ccc(CNc2ccc(OC3CCCCC3)cc2)c(F)c1 734834214 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Cc1ccccc1[C@H](N[C@H](C)c1ccc(C#N)cc1F)C(C)C 512659995 KYBUEMIVEZVJFT-FOIQADDNSA-N 310.416 5.054 30 20 DKED N#C[C@@H](Sc1nc2ccc(Cl)cc2o1)C1CCCCC1 524534457 UXNBUBTUZJVQLB-CQSZACIVSA-N 306.818 5.046 30 20 DKED Cc1ccc([C@H](NCc2ccc(C#N)c(Cl)c2)C2CCC2)cc1 619755067 RZTYIHYWKKDVOC-HXUWFJFHSA-N 324.855 5.151 30 20 DKED COc1ccc2oc(C(=O)/C=C/c3ccc(C)s3)c(C)c2c1 729150738 LYTSUIMIYRBUMD-BQYQJAHWSA-N 312.390 5.016 30 20 DKED C=CCC[C@@H](NC(=S)Nc1cc(C)ccc1C)c1ccccc1 771850800 QDXFOJZQHBWIHJ-GOSISDBHSA-N 324.493 5.297 30 20 DKED CCSc1ccc(C(=O)/C=C\c2scnc2C2CC2)cc1 782347659 MGBWGNGWLLUZJB-KTKRTIGZSA-N 315.463 5.029 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccccc1CF 901384177 VUIFOGPFLBWWGQ-CQSZACIVSA-N 314.429 5.020 30 20 DKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 303765090 LTAJGMCHPCUDPV-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C2CC2)c1 340308469 FHGRQGRDNQXTNL-HRAATJIYSA-N 304.437 5.260 30 20 DKED Cc1cc2cc(CN[C@H](CCC#N)c3ccccc3)oc2cc1C 344823233 GLMWFFJLRGGBCP-HXUWFJFHSA-N 318.420 5.184 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1cccc(C(F)(F)F)c1 444687889 WWNHFTSOVBFJEV-CYBMUJFWSA-N 312.379 5.076 30 20 DKED C=CCC[C@H](NCc1cc2ccc(F)cc2[nH]1)c1ccccc1 486715423 WLNDEFGADBCNEX-IBGZPJMESA-N 308.400 5.104 30 20 DKED CC(C)[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 538393607 BNFHARBHEGXQGP-LIRRHRJNSA-N 312.844 5.260 30 20 DKED C[C@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)cc1 540834780 AIJDNQFDBGSYAR-KRWDZBQOSA-N 319.452 5.112 30 20 DKED Cc1ncccc1/C=C/C(=O)c1ccc(-c2ccccc2)s1 728785586 HLDIMZHZZOOFQU-MDZDMXLPSA-N 305.402 5.015 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1c(C)cccc1C 732624728 DRKJXLWBMCUFQI-UHFFFAOYSA-N 316.514 5.069 30 20 DKED CC(C)(C#N)CCCN1CCC[C@H]1c1ccccc1C(F)(F)F 746666109 ISOWCVQUBNVRKD-INIZCTEOSA-N 324.390 5.172 30 20 DKED C#CC[C@H](NCc1nc(C2CCCCC2)cs1)c1ccccc1 769785918 HEGCFSVRXPQHHW-SFHVURJKSA-N 324.493 5.045 30 20 DKED C=CC[C@H](C(=O)O[C@@H](C)CCCC(F)(F)F)c1ccccc1 778735559 KHBLEWDKSJLEIO-ZFWWWQNUSA-N 314.347 5.011 30 20 DKED Cc1ncsc1C(=O)/C=C/c1ccc(-c2ccccc2)cc1 915054020 BDIOLHGEPXMKMX-FMIVXFBMSA-N 305.402 5.015 30 20 DKED C=C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 179870966 JQPHNYQVAPLPFK-CYBMUJFWSA-N 319.326 5.004 30 20 DKED CC[C@@H](C)c1ccc([C@@H](NCc2ccc(C#N)o2)C(C)C)cc1 236896790 MMVQFQPFPXGXTB-QRWLVFNGSA-N 310.441 5.152 30 20 DKED CC[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1c(C)noc1C 329089875 ISEVJOXTTIABAQ-HZMVEIRTSA-N 318.461 5.306 30 20 DKED CCCC(C)(C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 469412685 VWZDVOBVYXMTEC-CQSZACIVSA-N 318.486 5.093 30 20 DKED Cc1ccc(C[C@@H](C#N)SCc2ccc(Cl)cc2)cc1 556816990 XGCUXJSDVPFMQX-KRWDZBQOSA-N 301.842 5.017 30 20 DKED N#CCCCCCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 588831126 RJUVTWJMGQIXFL-UHFFFAOYSA-N 319.619 5.059 30 20 DKED C=CC[C@@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccncc1 762477074 SVPRYXADBZLAKI-RTBURBONSA-N 312.844 5.019 30 20 DKED C#CC[C@H](N[C@@H](C)c1oc2ccccc2c1C)c1ccccc1 773115129 LRLTXZHZBPCVHO-LPHOPBHVSA-N 303.405 5.156 30 20 DKED C=CCN(C(=O)Nc1c(CCC)cccc1C(C)C)C(C)C 788312031 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CC[C@H](CCC(F)(F)F)N[C@H](CCCC#N)c1ccccc1 872072734 JDUCEPINLYDXGX-HZPDHXFCSA-N 312.379 5.132 30 20 DKED CCCCCCCCCC(=O)Nc1ccc(NC(C)=O)c(C)c1 892807922 ZFNXMBGKZCFFCA-UHFFFAOYSA-N 318.461 5.033 30 20 DKED N#CC1CCC(CNc2ccc([C@H](F)C(F)(F)F)cc2)CC1 902128971 KLVARNKLMLGXFO-QOZQQMKHSA-N 314.326 5.001 30 20 DKED CC(C)C[C@@H](NCc1ccc(C#N)s1)c1ccc(Cl)cc1 540613684 LZPJIGKWMPPQAY-QGZVFWFLSA-N 318.873 5.150 30 20 DKED N#CCc1ccc(CN[C@@H](CC2CCCC2)c2ccccc2)cc1 541329197 ZVKUPULIYNGYHP-QFIPXVFZSA-N 318.464 5.164 30 20 DKED C[C@H](CCc1ccc(F)cc1)N[C@@H](CCCC#N)c1ccccc1 577271095 UYYBSGOVDNEYLC-UTKZUKDTSA-N 324.443 5.172 30 20 DKED Cc1ccsc1/C=C/C(=O)c1ccc(SC(F)F)cc1 734981825 UQJCJTQIYANGTH-VOTSOKGWSA-N 310.390 5.267 30 20 DKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1ccccc1 735317636 DTPFWANXOIMMJH-ZDUSSCGKSA-N 317.841 5.237 30 20 DKED CC(=NN(Cc1ccccc1)c1ccccc1)c1ccsc1 749099890 WMGPKZBXUNYQRN-UHFFFAOYSA-N 306.434 5.179 30 20 DKED C=CCN(C(=O)Nc1ccc(SC(C)(C)C)cc1C)C1CC1 772284852 YKISSSCEZIELLK-UHFFFAOYSA-N 318.486 5.068 30 20 DKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccsc2)cc1 800986314 FUKDDYMUYFZDSF-ZIAGYGMSSA-N 321.873 5.291 30 20 DKED C=CCN(C(=O)c1cc2sc3ccccc3c2s1)C(C)C 915153038 AUUJCJQWQCSGQQ-UHFFFAOYSA-N 315.463 5.153 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3cccc(F)c3)cs2)cc1 918714323 ZJTBTKAYWQHAGL-KTKRTIGZSA-N 323.392 5.154 30 20 DKED Cc1csc(-c2ccc(N[C@H](C)c3cccc(C#N)c3)cc2)n1 183013700 RZDWRWWQSSDWPS-CQSZACIVSA-N 319.433 5.163 30 20 DKED C=CC1CCN(C(=O)Nc2c(CCC)cccc2C(C)C)CC1 189964290 TXMXRCALNODECK-UHFFFAOYSA-N 314.473 5.192 30 20 DKED N#CCCC[C@H](NCc1cc(F)ccc1Cl)c1ccccc1 433027753 WSPYSQSXJPDLJZ-SFHVURJKSA-N 316.807 5.004 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccsc1 476124862 YSAILJXOELQLQL-AWEZNQCLSA-N 313.466 5.342 30 20 DKED CC(C)(C)c1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 483042253 BYCWADHQTCBVGX-KRWDZBQOSA-N 320.436 5.010 30 20 DKED CCC(CC)[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cccs1 539498702 QAOWSTHZASCNAM-AUUYWEPGSA-N 312.482 5.448 30 20 DKED C[C@@H](NCCCC#N)c1ccc(-c2ccc(Cl)cc2)s1 544387106 VPVQLDJPRHDEIW-GFCCVEGCSA-N 304.846 5.023 30 20 DKED COc1ccc2cc(/C=C\C(=O)c3sccc3C)ccc2c1 733748667 GKXZIOHFVDSHSN-YWEYNIOJSA-N 308.402 5.114 30 20 DKED C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)s1)c1cccc(C#N)c1 902827760 OOPUZLRDVREHIM-QWRGUYRKSA-N 324.371 5.050 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc2c(c1)CCC2 195656691 SDTDAUQFTYYYTR-MRXNPFEDSA-N 320.436 5.031 30 20 DKED Cc1cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)s1 340451869 PXAYDCSJTVNRHL-BEFAXECRSA-N 312.482 5.451 30 20 DKED C=CCc1cccc(C(C)C)c1NCc1nc2cccnc2s1 352553407 ILKJSGMLDKFCTM-UHFFFAOYSA-N 323.465 5.155 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H]1CCCc2sccc21 360876055 YRXOOGSIWNKYKQ-OALUTQOASA-N 322.477 5.054 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 480669781 WCKXPSWRNHCTRV-ADLMAVQZSA-N 323.333 5.211 30 20 DKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H](c1ccccc1)C1CCC1 611391882 CQEBHJFRZIWCQS-YADHBBJMSA-N 316.448 5.067 30 20 DKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2cccs2)cc1 742430730 AEJRWLOKEGMJPV-CMDGGOBGSA-N 311.431 5.076 30 20 DKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(-c2cccs2)cc1 742725611 ZDMAHXCUECCDSY-HNNXBMFYSA-N 318.445 5.138 30 20 DKED Cc1cc(F)ccc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745989856 CWYARUBQYDEAGG-VQHVLOKHSA-N 317.363 5.092 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1ccc2cnccc2c1 782342625 QLHGBGGFFLRNEL-RCEBRVLHSA-N 323.442 5.057 30 20 DKED CC(C)n1nccc1/C=C\C(=O)c1ccc(-c2ccccc2)s1 794938126 KTHAFZSRWRDDAI-HJWRWDBZSA-N 322.433 5.089 30 20 DKED CCCOc1ccc(Cl)cc1N[C@@H](C)c1cccc(C#N)c1 315618454 SAILVUGUVHWBSR-ZDUSSCGKSA-N 314.816 5.174 30 20 DKED N#C[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 463290673 TWULLXWMBLHUPS-XPGWFJOJSA-N 324.855 5.101 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 480669935 OINUTAAVWDMJJG-BBATYDOGSA-N 323.333 5.211 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1C(C)C 484989931 RNLSEEZGTUPFMW-UHFFFAOYSA-N 314.473 5.410 30 20 DKED CC[C@@H](NCc1cccc(Cl)c1Cl)c1ccc(C#N)cc1 580399926 ONNARIWIHSXGDB-MRXNPFEDSA-N 319.235 5.106 30 20 DKED C=C(C)[C@@H](NCc1sccc1Cl)c1ccc(F)c(F)c1 584279557 PCAPLQUYXJXULU-OAHLLOKOSA-N 313.800 5.087 30 20 DKED C#Cc1cccc(NC(=S)N(CCCCC)CCCCC)c1 726467442 YLVIJKPLFQMHLI-UHFFFAOYSA-N 316.514 5.047 30 20 DKED CCCCCCCCC(=O)Nc1c(C)cccc1OC(F)F 726507324 QFTLNWDVJZPDPD-UHFFFAOYSA-N 313.388 5.286 30 20 DKED C/C(=C/C(=O)Nc1sc(-c2ccccc2)cc1C#N)C(C)(C)C 744361434 LULWGJSPQPTEIF-RAXLEYEMSA-N 324.449 5.218 30 20 DKED N#C[C@H](C(=O)CCCC1CCCCC1)c1nccc2ccccc12 792099761 JLSNSJIKVQZMDU-LJQANCHMSA-N 320.436 5.162 30 20 DKED CC[C@@H](N[C@H](C)c1cccc(OC(C)C)c1)c1ccc(C#N)cc1 447538013 AHYYJWZHQFADQS-IIBYNOLFSA-N 322.452 5.147 30 20 DKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CC(C)(C)CCC#N 539849626 HJSVATGNVYCQEH-LSDHHAIUSA-N 306.881 5.094 30 20 DKED C=CCC[C@@H](NCc1ccccc1OC1CCC1)c1ccco1 560546893 XTDJVNQIHXAOKJ-GOSISDBHSA-N 311.425 5.008 30 20 DKED Cc1cc(F)c(C(F)(F)F)cc1N[C@@H](C)c1cccc(C#N)c1 600853496 WYOXQJSSNKMRDY-NSHDSACASA-N 322.305 5.198 30 20 DKED CCCCCCCC(=O)Nc1cccc(Oc2ccccn2)c1 742962181 FWQLUZDDCMCFIH-UHFFFAOYSA-N 312.413 5.173 30 20 DKED C=CCCCCC[C@H](C)N[C@H]1CCO[C@H](c2ccccc2)C1 793550181 DHOOIXXOTJZALJ-IHPCNDPISA-N 301.474 5.021 30 20 DKED C=CCC[C@H](NCc1ccnc(Cl)c1Cl)c1ccccc1 811484993 RWUNDEHMOBPCTF-HNNXBMFYSA-N 321.251 5.186 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 444682025 YEVJWKDNRXWJKM-CYBMUJFWSA-N 312.379 5.076 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 464444861 ZJMJBXKZLRITBQ-ZDUSSCGKSA-N 315.363 5.173 30 20 DKED Cc1cccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c1C 559860428 ULQGMWMWYLLRMD-GHTZIAJQSA-N 306.453 5.389 30 20 DKED C[C@H](NCC1(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 568802403 MKSYHLPLKUYTMQ-LBPRGKRZSA-N 316.857 5.023 30 20 DKED C=CCC[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 611394430 JAFRVYRWEUUUAB-FCHUYYIVSA-N 316.448 5.233 30 20 DKED CC[C@H](Nc1ccc2c(cnn2C(C)C)c1)c1ccc(C#N)cc1 618573749 AFTQQJAISZKQHH-IBGZPJMESA-N 318.424 5.052 30 20 DKED O=C(/C=C\c1ccccc1Cl)c1cccc(-c2ccncc2)c1 741472473 JSPGHLNAJWBRIN-HJWRWDBZSA-N 319.791 5.298 30 20 DKED CC(C)c1nc(C(=O)/C=C\c2ccc(C(F)F)cc2)cs1 812243278 IIZBSDPTKBXFRH-YVMONPNESA-N 307.365 5.100 30 20 DKED N#CCC[C@H](NCc1csc2ccccc12)c1ccccc1 130483748 JBEFCPLACCBJGP-SFHVURJKSA-N 306.434 5.036 30 20 DKED C=CC[C@H](C(=O)Nc1cc(SC)ccc1C)c1ccccc1 489602322 FNWKQAIQXAPTJP-KRWDZBQOSA-N 311.450 5.015 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1 537297612 YXZPRVQEXHBYIE-IIBYNOLFSA-N 304.437 5.140 30 20 DKED CC[C@H](c1ccccc1)N(CC(C)C)C(=O)CCCCCC#N 588925574 ZTGQSUUBMXQYOM-LJQANCHMSA-N 314.473 5.096 30 20 DKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1nccc2ccccc12 792094487 DZGXQBKUSCFJRE-KRWDZBQOSA-N 308.425 5.018 30 20 DKED CC[C@H](Nc1ccc(CCC#N)cc1)c1cccc(Cl)c1O 903293037 FLFFIEUKXWHZTJ-KRWDZBQOSA-N 314.816 5.065 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccccc1 189891388 BNHVSHNFKLGIRK-QGZVFWFLSA-N 321.464 5.671 30 20 DKED CC(C)Sc1ccc([C@H](C)NCCCCC(C)(C)C#N)cc1 444678082 VRWBLXNSPORQSV-INIZCTEOSA-N 318.530 5.558 30 20 DKED C=CCC[C@H](N[C@H](C)c1csc(C(C)C)n1)c1ccccc1 469802833 VXJVJNWMHORYHO-WBVHZDCISA-N 314.498 5.625 30 20 DKED CC(C)Oc1ccc2ccccc2c1CNCC(C)(C)CCC#N 547334109 HJVFULXIWUAGFH-UHFFFAOYSA-N 324.468 5.047 30 20 DKED O=C(/C=C/c1cncs1)c1ccc(SC2CCCC2)cc1 767720670 HWZFASAKBUFNHN-MDZDMXLPSA-N 315.463 5.074 30 20 DKED N#Cc1c(F)cccc1/C=C(/Cl)c1nc2ccccc2s1 811689074 VXAGXWGQXCITGJ-XYOKQWHBSA-N 314.772 5.044 30 20 DKED CCCCCCCCC(=O)N[C@@H](c1ccccc1)c1ccncc1 885978908 JNBQKEKJTVASNW-NRFANRHFSA-N 324.468 5.038 30 20 DKED CC(C)c1ccc(C(=O)/C=C/c2ccc3ncccc3c2)cc1 916133004 YESMMASEXULFTO-WUXMJOGZSA-N 301.389 5.254 30 20 DKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccccc1)c1ccccc1 435107123 RYYULDSZSLQTSJ-FXAWDEMLSA-N 322.452 5.097 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc2ccccc12 512640902 BGZMSMSMOMDROX-LSDHHAIUSA-N 318.395 5.262 30 20 DKED N#CCCCCN[C@@H]1CCCCC[C@H]1c1ccc(Cl)cc1 581419990 LNMZLTQZJDAUCS-ZWKOTPCHSA-N 304.865 5.040 30 20 DKED Cc1ccsc1C(=O)/C=C/c1cccc(-c2ccccn2)c1 747692729 JKNHXWLQPJHWGH-CMDGGOBGSA-N 305.402 5.015 30 20 DKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nccc2ccccc12 792106616 SFSZRJQOTUMJML-YJBOKZPZSA-N 308.425 5.018 30 20 DKED C[C@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571913 XCHQMEFUHXXITE-CHWSQXEVSA-N 320.502 5.079 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2cc[nH]c2c1 189910568 PGDUICZAZXJOGD-UHFFFAOYSA-N 318.420 5.272 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H](C)C1 191464922 DRACEWMBUGYDGS-JKSUJKDBSA-N 314.473 5.048 30 20 DKED N#CCCC[C@H](NC1CCC(C(F)(F)F)CC1)c1ccccc1 340451873 PYCYSFJNGNHKKS-JCYILVPMSA-N 324.390 5.132 30 20 DKED CC(C)c1nc2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2s1 439572313 PSDCBVOCVSHNMZ-CYBMUJFWSA-N 321.449 5.464 30 20 DKED N#C[C@@H]1CCC[C@@H](Nc2cccc(COC3CCCCC3)c2)C1 463287677 KIKSMALOUIONIE-SJLPKXTDSA-N 312.457 5.030 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1cccs1)C1CC1 481911111 DCRIQPXPFYRVAG-AZUAARDMSA-N 322.477 5.128 30 20 DKED C=C[C@@H](CC(=O)Nc1ccc(OC(C)C)cc1C)c1ccccc1 536245659 WVFMSGSWKLYHFF-KRWDZBQOSA-N 323.436 5.081 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nc2ccccc2o1 540858847 PXKSXRHBECUCKH-SNVBAGLBSA-N 314.797 5.206 30 20 DKED CC[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)s1 572208512 PGPPNCASHPQEKG-GJZGRUSLSA-N 316.857 5.001 30 20 DKED COCc1ccc(C=NN(c2ccccc2)c2ccccc2)cc1 741759699 MQUISJXUUUANHV-UHFFFAOYSA-N 316.404 5.005 30 20 DKED Cc1cccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)c1 72031008 ARLPSQPZPDNRKB-AATRIKPKSA-N 311.431 5.076 30 20 DKED C[C@H](Nc1ccc(C#N)c(Cl)c1)c1nc(C(C)(C)C)cs1 301300673 ZTXDDWGBHZPUFZ-JTQLQIEISA-N 319.861 5.139 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1ccccc1[N+](=O)[O-] 437279677 YBUSSMARMSQEIC-OLZOCXBDSA-N 312.394 5.022 30 20 DKED CCc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)s1 551204876 GNHJQZUVAASPMX-YJBOKZPZSA-N 312.482 5.396 30 20 DKED CCC(CC)[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccs1 574946077 OKRQOBKPQYWBSP-UYAOXDASSA-N 324.493 5.374 30 20 DKED C[C@@H](Nc1ccc(F)cc1OC1CCCC1)c1cccc(C#N)c1 600848543 UQFSBBYDTZMUFJ-CQSZACIVSA-N 324.399 5.192 30 20 DKED Cc1ccc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)s1 920068562 RYABKNKMJKTJLK-ALCCZGGFSA-N 301.798 5.087 30 20 DKED C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 21009059 YNFQDZBBGSOGGL-VXGBXAGGSA-N 319.235 5.277 30 20 DKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccccc1F 108407642 VEZOSUIYWJIDGL-KGLIPLIRSA-N 314.429 5.251 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(C)ccc1C 475559140 NHVWLFFHMGGJRH-UHFFFAOYSA-N 322.452 5.799 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccccc1F)c1ccc(F)c(F)c1 480684643 ULTMXAJULPXDIR-XIKOKIGWSA-N 305.343 5.072 30 20 DKED CC[C@H](Nc1cccc(C2CCOCC2)c1)c1ccc(C#N)cc1 527992667 BGXDUJWAFKFZST-NRFANRHFSA-N 320.436 5.015 30 20 DKED CC(C)(CCC#N)CNc1cccc(COc2ccccc2)c1 770494080 IFMPOFAYTLBBBG-UHFFFAOYSA-N 308.425 5.007 30 20 DKED C#CCCCCCC(=O)N1CCC[C@@H]1c1cccc2ccccc12 780701353 WXYIWMDLPLRRBH-OAQYLSRUSA-N 319.448 5.087 30 20 DKED Cc1cc2cc(C(=O)/C=C/c3cn(C(C)C)nc3C)oc2cc1C 798370353 KTLMGZPVCKBMKP-VOTSOKGWSA-N 322.408 5.032 30 20 DKED C=CC[C@H]1N(C(=O)Nc2c(C)cccc2Cl)CCCC1(C)C 445164231 KBUGNVCWEOVZRS-OAHLLOKOSA-N 320.864 5.247 30 20 DKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)CCCC#N)cc1 462205119 XRBMYHNSFSVAGX-HNNXBMFYSA-N 324.449 5.172 30 20 DKED C[C@@H](NCCCC(C)(C)C#N)C(c1ccccc1)c1ccccc1 543487715 RZADDXWLNLLNNG-GOSISDBHSA-N 320.480 5.127 30 20 DKED N#CCCC[C@@H](NCc1cccc(Cl)c1F)c1ccccc1 353916265 PPYBEGCDVPBYTH-QGZVFWFLSA-N 316.807 5.004 30 20 DKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H](CC1CC1)c1ccccc1 553873771 QLSWXFSVCGIJFP-FGZHOGPDSA-N 316.448 5.067 30 20 DKED CCC(C)(C)OCc1ccccc1N[C@H](C)c1cccc(C#N)c1 612574897 RYYAPFJZOZQPHJ-MRXNPFEDSA-N 322.452 5.437 30 20 DKED CC1(C)CCCC[C@@H]1CC(=O)[C@H](C#N)c1ccc2ccccc2n1 752472906 CECGAODKISMNLE-IAGOWNOFSA-N 320.436 5.018 30 20 DKED C[C@H](Nc1ccc(F)cc1OCC#N)c1ccc2ccccc2c1 760217652 XXOGMOUVLJLLCM-AWEZNQCLSA-N 320.367 5.054 30 20 DKED CC(C)[C@@H]1C[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 447573705 IRZMBFJRLLFABG-BHDDXSALSA-N 318.464 5.506 30 20 DKED COc1cc(C)ccc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 556202708 RONHNNWEQGWZCW-PXNSSMCTSA-N 322.452 5.089 30 20 DKED Clc1ccccc1-c1ccc(C=NOCc2ccccc2)o1 839420219 ZDLSIEAVCCSBQI-UHFFFAOYSA-N 311.768 5.151 30 20 DKED CC1(C#N)CCC(Nc2ccc([C@@H](F)C(F)(F)F)cc2)CC1 883363104 VXOVDWQCZPLBQK-SHARSMKWSA-N 314.326 5.144 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccccc1OC 918722759 HAAAJURMQUFFRC-UHFFFAOYSA-N 322.518 5.074 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1csc(Cl)c1 340440603 CMKLRZXRPKWBCB-CJNGLKHVSA-N 318.873 5.487 30 20 DKED CCCCOc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 585764769 DRIPFQSVHPXAHN-IRXDYDNUSA-N 322.452 5.149 30 20 DKED CC(C)c1ccc([C@H](NC(=O)CCCCCC#N)C(C)C)cc1 588460096 LYXBYPFMVUVABV-HXUWFJFHSA-N 314.473 5.097 30 20 DKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2ccccc2s1 618807437 UNRPHNHFENMLRN-UGSOOPFHSA-N 318.445 5.111 30 20 DKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)CCc2sccc21 727973927 CCEHNXNUCFQYIC-RAXLEYEMSA-N 323.442 5.084 30 20 DKED CCCCC[C@@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)C(C)C 756300949 SWHNWEPZYJUSQR-HUUCEWRRSA-N 320.502 5.295 30 20 DKED COc1ccsc1/C=C\C(=O)c1cc(Cl)sc1Cl 764434551 ZZUFZZKPXIXWKF-IHWYPQMZSA-N 319.234 5.021 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 776092259 ASGNSUZGKUSYER-KGLIPLIRSA-N 306.475 5.049 30 20 DKED CC(CCc1cccc(C)c1)=NNc1nccc2sccc12 920375448 TVGRWVJWAJZUCX-UHFFFAOYSA-N 309.438 5.025 30 20 DKED C[C@H](c1ccc(Cl)cc1Cl)N(C)CCCC(C)(C)C#N 472446240 JAVLMPGUOWMPFY-GFCCVEGCSA-N 313.272 5.316 30 20 DKED CC(C)(C#N)CCSCc1c(Cl)ccc2cccnc12 520452366 WKLKEMZNQNGWEN-UHFFFAOYSA-N 304.846 5.061 30 20 DKED C=CC[C@@H](C(=O)Nc1ccc(OC(C)C)cc1C)c1ccccc1 548610616 DMAMVSSIFVBMKY-LJQANCHMSA-N 323.436 5.081 30 20 DKED C=CCC[C@H](Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccco1 671758926 JJLRASGXSXLWJY-SFHVURJKSA-N 322.408 5.671 30 20 DKED O=C(/C=C/c1cccnc1Cl)c1cccc(-c2ccccc2)c1 728697237 LIVJAXJNQIDGJQ-VAWYXSNFSA-N 319.791 5.298 30 20 DKED CC(C)CCCCCC(=O)[C@@H](C#N)c1nccc2ccccc12 792105984 OWKROMKIOLTYRV-GOSISDBHSA-N 308.425 5.018 30 20 DKED CC(/C=C/C1=C(C)CCCC1(C)C)=NNc1cncc(Cl)n1 914557872 ZLBBKWDWSQTCLZ-QLGZWBLUSA-N 318.852 5.001 30 20 DKED C=CCN(C(=O)Nc1ccc(Oc2cccc(C)c2)cc1)C(C)C 916707084 HCEWNTSDOVSGKI-UHFFFAOYSA-N 324.424 5.216 30 20 DKED C[C@@H](Sc1ccccc1Br)c1ccc(C#N)cc1 522823247 VRVVEECCMQNIHA-LLVKDONJSA-N 318.239 5.174 30 20 DKED Cc1ccc(C[C@H](C#N)SCc2ccc(Cl)cc2)cc1 556816994 XGCUXJSDVPFMQX-QGZVFWFLSA-N 301.842 5.017 30 20 DKED C=CCCCCC[C@@H](C)Nc1ccc(C)c(NC(C)=O)c1C 793547705 MDZOFDKETUXJCC-OAHLLOKOSA-N 302.462 5.199 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1cccc(F)c1 917819627 VWAYCRFUOTYRMI-GOSISDBHSA-N 305.437 5.240 30 20 DKED CC[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)cc1 439433035 XZIJSZVKOSRELI-KRWDZBQOSA-N 319.235 5.106 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccccc1)C1CCC1 487355933 IJYKAIVHYNXULU-NRFANRHFSA-N 318.464 5.119 30 20 DKED CC(C)c1ccc(NC(=O)c2cccc(C#N)c2)c(C(C)C)c1 512390809 HYTCVBMKIHNSDR-UHFFFAOYSA-N 306.409 5.057 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(F)ccc1Cl 522116153 HARXSJWZZRIQNP-UHFFFAOYSA-N 324.827 5.079 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CCCC 567315141 DGKCWQHZVXLXLP-MRXNPFEDSA-N 316.489 5.581 30 20 DKED CSc1ccc2c(c1)[C@@H](N[C@@H](C)c1cccc(C#N)c1)CCC2 592387617 YFNXJRRVYLEOSS-XOBRGWDASA-N 322.477 5.008 30 20 DKED N#Cc1ccccc1SCc1ccc(Cl)c2cccnc12 610206564 KGTOJMCGLSUTRB-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H]1C/C(=C/c2coc(-c3ccccc3)n2)C(=O)c2ccccc21 751535826 NDICUWVFSVHTFX-IZCBMXNHSA-N 315.372 5.115 30 20 DKED CCCCCCCC[C@H](C)CC(=O)N(C)c1c(C)noc1C 775179465 BHTBLJIILBWHSO-AWEZNQCLSA-N 308.466 5.031 30 20 DKED C[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)C1CCCCC1 792102923 KAZTYQWVHOUZNI-HNAYVOBHSA-N 320.436 5.018 30 20 DKED O=C(/C=C\c1ccc2ncccc2c1)c1cccc2ccccc12 916134829 IWBFONJDCTZGNR-QBFSEMIESA-N 309.368 5.284 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(F)c1 340445491 DURTTYOKKKKNHK-WOJBJXKFSA-N 310.416 5.302 30 20 DKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(-c2cccs2)cc1 453291637 MMCLFXURNDPIIZ-MPGHIAIKSA-N 310.466 5.148 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(C)(F)F 455806146 LEWHUJMCFBXYRV-UHFFFAOYSA-N 310.388 5.008 30 20 DKED N#C[C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2cccc(Cl)c2)C1 463301021 LWKJADCMELRKNM-XPGWFJOJSA-N 324.855 5.101 30 20 DKED C=CCC[C@@H](C(=O)Nc1cccc([C@@H](C)OC)c1)c1ccccc1 488339198 MVGCIQRKHZXFGG-OXQOHEQNSA-N 323.436 5.083 30 20 DKED C=CCCCSCCCC(=O)Nc1c(C)cc(C)cc1C 609804427 LQOCDRUUIQIXSA-UHFFFAOYSA-N 305.487 5.030 30 20 DKED C[C@@H](C=NOCc1ccc(C(F)(F)F)cc1)c1ccccc1 746576335 ILMKOKGXYUJTGO-ZDUSSCGKSA-N 307.315 5.012 30 20 DKED C=CCC[C@@H](Nc1ccc(OC)c(OC(C)C)c1)c1ccco1 796935349 CMQCTFKXQFFBPE-MRXNPFEDSA-N 315.413 5.195 30 20 DKED C=CCN(C(=O)Nc1ccccc1SC1CCCC1)C(C)C 916708219 OEPZOGQJIWKPIY-UHFFFAOYSA-N 318.486 5.150 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C#N)cc1 340450970 YPZIBSMIDPIIAT-RTWAWAEBSA-N 317.436 5.034 30 20 DKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CCCC(C)(C)C#N 472439435 LXILAMYSAXLCSF-LBPRGKRZSA-N 313.272 5.316 30 20 DKED C[C@H](Sc1ccccc1C#N)c1ccc(OC(F)F)cc1 525758009 YFOJRNJPFQMUQL-NSHDSACASA-N 305.349 5.013 30 20 DKED CCC(C)(C)OCc1ccccc1N[C@@H](C)c1ccc(C#N)cc1 543450247 ZSOIVOPNLVRATA-INIZCTEOSA-N 322.452 5.437 30 20 DKED COc1ccc([C@@H](CCC(C)C)NCC(C)(C)CCC#N)cc1 558238727 JCVQXOVXJVHADL-LJQANCHMSA-N 316.489 5.092 30 20 DKED Cc1csc(NC(=O)c2coc3ccc(C(C)C)cc23)c1C#N 561837896 ZRHSIHWDIJPIMZ-UHFFFAOYSA-N 324.405 5.050 30 20 DKED Cc1ccc(C)c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1 581622062 RRGJIBNLWVUBBT-WIYYLYMNSA-N 306.453 5.389 30 20 DKED Cc1cc2cc([C@H](C)N[C@@H](C)c3cccc(C#N)c3)oc2cc1C 610829874 QMECMJAAGWSTNI-HOTGVXAUSA-N 318.420 5.333 30 20 DKED Cc1cccc(/C=C\C(=O)c2sccc2Br)c1C 731156783 LXWRBNZHERDLIS-SREVYHEPSA-N 321.239 5.024 30 20 DKED CC[C@@H](C)c1cccc(NC(=O)c2ccccc2SCC#N)c1 862487649 SNXSSXAUBOYRBY-CQSZACIVSA-N 324.449 5.068 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)s1 189874250 IOCLSPQPYMIZRR-UHFFFAOYSA-N 319.857 5.506 30 20 DKED COc1cc(/C=C\C(=O)c2ccc(Cl)s2)ccc1SC 209244511 JNNLMWPHTQBHCY-HYXAFXHYSA-N 324.854 5.028 30 20 DKED Cc1nc(C(C)C)ccc1CN[C@H](CCCC#N)c1ccccc1 339239472 WYNLDDBTMFZKEK-OAQYLSRUSA-N 321.468 5.038 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCC1CCC(F)(F)CC1 417042056 WIJUXIPAYIIEMZ-ZDUSSCGKSA-N 324.440 5.176 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2cccc(C(F)F)c2)CCCC1(C)C 445245189 UBPRFGMVNNSZCL-HNNXBMFYSA-N 322.399 5.223 30 20 DKED C[C@@H]1CC[C@H](N[C@@H](CCCC#N)c2ccccc2)c2sccc21 453237603 KXQMGPYSEJFXCY-MNEFBYGVSA-N 324.493 5.711 30 20 DKED CC[C@@H](CN[C@H](CCCC#N)c1ccccc1)c1ccccc1 560563611 BJWRWYYRKWIYPJ-GHTZIAJQSA-N 306.453 5.205 30 20 DKED CSc1ccc([C@H](C)NC2(c3ccc(C#N)cc3)CCC2)cc1 594512825 DZNYEUFRCVVBMG-HNNXBMFYSA-N 322.477 5.010 30 20 DKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1cccs1 727263914 JLFGFZQLPUZOKD-GQCTYLIASA-N 316.731 5.316 30 20 DKED C=CC[C@H](N[C@H](C)c1oc2ccccc2c1CC)c1ccncc1 776155300 FYWMWUSAFKIAPI-BEFAXECRSA-N 320.436 5.358 30 20 DKED C[C@@H](Nc1ccc2c(c1)Cc1ccccc1-2)c1cccc(C#N)c1 324236298 WTIIOLHYDRHGNT-OAHLLOKOSA-N 310.400 5.303 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(-c2ccncc2)cc1 366776509 MKROYICSOCLSIZ-KRWDZBQOSA-N 321.468 5.119 30 20 DKED Cc1ccc(-c2csc(CSCCCCC#N)n2)cc1 507133465 YXOAMIOWKZMEOX-UHFFFAOYSA-N 302.468 5.046 30 20 DKED CCCCCCCCCC(=O)NC1(c2nc(C)cs2)CCC1 734456991 UPWKOGKYGVGIEU-UHFFFAOYSA-N 322.518 5.088 30 20 DKED COc1cc(C)c([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1C 753688775 VDKFPTKWSWHTHB-PXNSSMCTSA-N 322.452 5.008 30 20 DKED C=CC[C@@H](N[C@@H](C)c1oc2ccccc2c1C)c1ccncc1 766019228 KZMUHBTZWMQYCR-MAUKXSAKSA-N 306.409 5.104 30 20 DKED Cc1cccc(C(=O)/C=C/c2csc(-c3ccccc3)n2)c1 916153512 SAMQWRUSLSSWQH-ZHACJKMWSA-N 305.402 5.015 30 20 DKED C[C@@H](Oc1ccc(C#N)c(Cl)c1)c1ncc(-c2ccccc2)o1 438906616 DLROYDYXSWUOPX-GFCCVEGCSA-N 324.767 5.007 30 20 DKED CC[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1 447528941 IXSSLGFVBGGQAK-LEWJYISDSA-N 322.427 5.279 30 20 DKED Cc1ccccc1[C@@H](N[C@H](C)c1cccc(C#N)c1)C(C)(C)C 540592175 UEFZTYROKPPWQG-OXQOHEQNSA-N 306.453 5.305 30 20 DKED N#CCCC[C@H](N[C@H]1CCc2c(Cl)cccc21)c1ccccc1 556203083 ZXTNXIKXPFZMTI-PMACEKPBSA-N 324.855 5.352 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1cc(C)ccc1C 732625781 UIMFROAIOVPANN-UHFFFAOYSA-N 316.514 5.069 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1ccncc1 766018854 JIFVFHKQTGSOQD-QFBILLFUSA-N 318.420 5.310 30 20 DKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccccc1 853255658 FYBTVHDDCPBCOS-UHFFFAOYSA-N 312.257 5.140 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@@H](C)/N=C/c1ccccc1O 920173631 CWMISWLLMPQWEV-HMHKGCENSA-N 322.433 5.004 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC[C@H]1C 191462129 LKCOWRHUZPPTQA-JKSUJKDBSA-N 314.473 5.191 30 20 DKED C=C[C@H](CC(=O)Nc1cccc(C(C)(F)F)c1)c1ccccc1 440645493 JDORREMXNSTWLZ-CQSZACIVSA-N 315.363 5.097 30 20 DKED CCCN(CCCCC(C)(C)C#N)[C@@H](C)c1ccccc1OC 444609927 NQRLVAUUWOMUSY-KRWDZBQOSA-N 316.489 5.188 30 20 DKED Fc1ccc(-c2ccccc2C(F)(F)F)cc1C(F)(F)F 536957204 DOQFZAYBVLBOTG-UHFFFAOYSA-N 308.196 5.530 30 20 DKED Cc1cccc(CCCNc2ccccc2SCCC#N)c1 539752611 GHHBDSXZRGTROC-UHFFFAOYSA-N 310.466 5.046 30 20 DKED CCCc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550834683 BXDZVJCNLVUDDN-PGRDOPGGSA-N 320.480 5.725 30 20 DKED C/C=C\c1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 554117188 BVAWOYOAZGLVLF-PLNGDYQASA-N 319.408 5.165 30 20 DKED C[C@@H]1[C@H](N[C@@H](CCCC#N)c2ccccc2)C[C@H]1c1ccccc1 559861677 CEAFVAWGUBJPGE-KVJIRVJXSA-N 318.464 5.203 30 20 DKED CC(C)(C)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 565437486 IEHZIZNPMNXDAH-NRFANRHFSA-N 320.480 5.509 30 20 DKED C=CCCCS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 588913441 KZQHGUFKVWMUJT-OAHLLOKOSA-N 305.487 5.145 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccc(Cl)cc1Cl 606933800 DHKNWLHYTAAULG-UHFFFAOYSA-N 315.244 5.204 30 20 DKED O=C(/C=C\c1ccccc1F)c1ccc(SC(F)F)cc1 734980432 KJTQGMWRSFYFGG-YFHOEESVSA-N 308.324 5.037 30 20 DKED C=CCCCCCN(C)C(=S)Nc1c(C)cc(C)cc1Cl 739456039 FKJBZWIYJYOHEP-UHFFFAOYSA-N 324.921 5.332 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cc2ccccc2[nH]1)c1ccccc1 775632329 YISOIGPGHGQUFJ-LPHOPBHVSA-N 304.437 5.526 30 20 DKED C[C@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1cccc(C#N)c1 319660969 BTRBIXRWCPGSOZ-LIRRHRJNSA-N 310.416 5.135 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 340428912 CCRFRKVAAORIPZ-RTBURBONSA-N 322.477 5.248 30 20 DKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)ccc1Cl 353918625 ZGLQDTAUWSKRPR-IBGZPJMESA-N 312.844 5.173 30 20 DKED Cc1nc([C@H](C)SCCC#N)oc1-c1ccc(Cl)cc1 413011759 JRMSFLUQQRVIKF-NSHDSACASA-N 306.818 5.011 30 20 DKED C[C@H](Sc1nc(-c2ccccc2)co1)c1cccc(C#N)c1 436240074 NENCQWQPLGOLEW-ZDUSSCGKSA-N 306.390 5.067 30 20 DKED C[C@H](NCc1ccc(Cl)cc1C#N)c1cccc2ccccc12 480874498 XVFPAPMNZKAXLB-AWEZNQCLSA-N 320.823 5.216 30 20 DKED Cc1c([C@H](C)NCc2ccc(Cl)cc2C#N)oc2ccccc12 481073073 OPJOYFFRZCAFQN-ZDUSSCGKSA-N 324.811 5.117 30 20 DKED CCN(Cc1ccc(C#N)cc1F)[C@@H](C)c1cc2ccccc2o1 513412067 UDGVEGLHYCUQRA-AWEZNQCLSA-N 322.383 5.027 30 20 DKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(C#N)c1 538396674 XVESLENQHQLYGT-VBKZILBWSA-N 324.855 5.404 30 20 DKED C=CCC[C@H](NCc1cc(-c2ccccc2)no1)c1ccccc1 539291033 CALUKXIOUWHKJD-FQEVSTJZSA-N 318.420 5.139 30 20 DKED CC(C)[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1Cl 539495253 JZMPIJZKTHSDQF-IFXJQAMLSA-N 312.844 5.260 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(F)c1)c1ccccc1 540150278 GQGFYPDOENAQKD-DNVCBOLYSA-N 313.416 5.192 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCC2 556198228 QVTBIRZTWNDNCJ-QAPCUYQASA-N 324.493 5.323 30 20 DKED CC[C@@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc(C#N)cc1 582645797 WRKKZRLZEBYXRE-WOJBJXKFSA-N 304.437 5.022 30 20 DKED COc1ccc(O)c(C=Nc2ccc(SC(C)(C)C)cc2)c1 726739936 MOXYZVSFSXRDQG-UHFFFAOYSA-N 315.438 5.042 30 20 DKED O=C(/C=C/c1cnc(C2CCC2)s1)c1cc2ccccc2o1 760265476 SHTOLLWXZNFLMX-CMDGGOBGSA-N 309.390 5.053 30 20 DKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccsc2)cc1 800986303 FUKDDYMUYFZDSF-KBPBESRZSA-N 321.873 5.291 30 20 DKED CC1(C)CCC(=CC(=O)N[C@H](CCCC#N)c2ccccc2)CC1 817318458 ALULCCKUWUCION-LJQANCHMSA-N 324.468 5.064 30 20 DKED O=C1/C(=C\c2csc(-c3ccccc3)n2)CCc2ccccc21 916135722 KYMZAJISIXGJMO-VBKFSLOCSA-N 317.413 5.023 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1ccc(C(=O)O)cc1 1776014296 PLEJZKKOGGYHOV-AWEZNQCLSA-N 304.434 5.169 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(F)c1 189881226 REHJCSAZRFNIDC-UHFFFAOYSA-N 311.400 5.238 30 20 DKED CCc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)s1 194339399 NOMSGCSXAXAKDW-CQSZACIVSA-N 314.454 5.166 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H](C)SC 356222774 SNHQGZIBQDVNGS-AWEZNQCLSA-N 305.487 5.009 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@@H](C)CC[C@@H]1CC 475565852 QRMVDILOYODRQO-RDJZCZTQSA-N 314.473 5.333 30 20 DKED C[C@H](SCc1cccc(C#N)c1)c1ccc(OC(F)F)cc1 524065220 LOWQEETWQTVJMJ-LBPRGKRZSA-N 319.376 5.154 30 20 DKED CC(C)CCc1nc(CSc2ccc(C#N)cc2F)cs1 524987755 IABSUDJBNDVPSY-UHFFFAOYSA-N 320.458 5.035 30 20 DKED CC[C@H](C)[C@@H](NCc1ccc(C#N)s1)c1ccc(Cl)cc1 537328819 FWKRBXDRIJIJES-YVEFUNNKSA-N 318.873 5.150 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C1CCCC1)c1cccc(C#N)c1 539500198 UBTSMRXQQYMODX-KKSFZXQISA-N 304.437 5.140 30 20 DKED C=CCC[C@H](NC(=S)Nc1cc(C)ccc1C)c1ccccc1 771850801 QDXFOJZQHBWIHJ-SFHVURJKSA-N 324.493 5.297 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC1CC1)C(C)C 931058262 BBJPVQZHQLYQQG-UHFFFAOYSA-N 314.473 5.191 30 20 DKED N#Cc1ccc(CSCc2ccc(C(F)(F)F)cc2)cc1 58322128 VPDARABJBPRAPR-UHFFFAOYSA-N 307.340 5.010 30 20 DKED Cc1ccc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)cc1 302906385 AYUJQJNTDWDQHX-ZHACJKMWSA-N 323.392 5.154 30 20 DKED C=CCCc1ccccc1NCc1ncc(-c2cccs2)o1 409865441 FDXPQTLCAXAKCY-UHFFFAOYSA-N 310.422 5.134 30 20 DKED Cc1cc(CS[C@H](C)c2ccc(C#N)cc2)c2ccccc2n1 437273961 GRYUKBHFKOPGHE-OAHLLOKOSA-N 318.445 5.409 30 20 DKED C[C@H](SCc1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 443146507 PUDHGANYPIATRA-AWEZNQCLSA-N 320.417 5.208 30 20 DKED Cc1cccc(Oc2ccccc2CNCC(C)(C)CCC#N)c1 462742453 DXJPGSDSQNXACN-UHFFFAOYSA-N 322.452 5.207 30 20 DKED CC(C)(CCC#N)CNCc1ccccc1Sc1ccccc1 462745580 POHAWEQUPOWARM-UHFFFAOYSA-N 324.493 5.257 30 20 DKED Cc1nc2ccc(NCc3ccccc3C(C)(C)C#N)cc2s1 486458888 SVVIRZWYQBLEKP-UHFFFAOYSA-N 321.449 5.018 30 20 DKED C=CCC[C@H](C(=O)Nc1cccc(C(F)F)c1)c1ccccc1 488709449 BKSYPXDFTKIWOX-KRWDZBQOSA-N 315.363 5.313 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)[C@@H](C)c1ccccc1 559863341 RTUVWVCIGCSIOO-LVCYWYKZSA-N 306.453 5.203 30 20 DKED Cc1nc(-c2ccccc2N[C@H](C)c2cccc(C#N)c2)cs1 600853787 FGWWPFRFOJKPAA-CYBMUJFWSA-N 319.433 5.163 30 20 DKED C[C@@H](SCc1ccnc(C#N)c1)c1cccc2ccccc12 610954548 UIWGPGUBDBMLAW-CQSZACIVSA-N 304.418 5.101 30 20 DKED CC(CCCCC#N)=NNc1nc2cc(Cl)ccc2cc1C 841632774 GWBXIHGCPLEINU-UHFFFAOYSA-N 314.820 5.068 30 20 DKED Clc1cccc(C=NNc2nccc3sccc23)c1Cl 915979574 JXAOULKQEFLBGV-UHFFFAOYSA-N 322.220 5.049 30 20 DKED COc1cc(C(=O)/C=C/C(C)=C/c2ccccc2)ccc1SC 60349794 WEQQSEQIJDXFKQ-PXELCPQFSA-N 324.445 5.260 30 20 DKED CC[C@@H](C)c1ccc([C@H](NCc2ccc(C#N)o2)C(C)C)cc1 236897772 MMVQFQPFPXGXTB-FOIQADDNSA-N 310.441 5.152 30 20 DKED C[C@H](SCCCC1(C#N)CCOCC1)c1cccc(Cl)c1 507694318 KVWJQQMBLQIVLV-AWEZNQCLSA-N 323.889 5.235 30 20 DKED CCC[C@@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 769584879 JYNNLAKEMWMEKA-HNNXBMFYSA-N 321.342 5.654 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(OCC#N)cc1 192990058 JHCJTMOCMVXJHM-UZLBHIALSA-N 322.452 5.027 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@@H]1CCCCC1(C)C 330126913 CHARWKZXPDLXGO-HNNXBMFYSA-N 311.429 5.190 30 20 DKED N#CCCC[C@@H](NCc1cc(F)ccc1Cl)c1ccccc1 433027752 WSPYSQSXJPDLJZ-GOSISDBHSA-N 316.807 5.004 30 20 DKED C=C[C@](C)(CC)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 442963441 GZVATHTVXJKPMJ-IIBYNOLFSA-N 322.452 5.401 30 20 DKED N#C[C@@H]1CCC[C@@H](N[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 463290668 TWULLXWMBLHUPS-CDHQVMDDSA-N 324.855 5.101 30 20 DKED C[C@@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(C#N)cc1 463904478 HYRSLOPLSJCJKB-FOIQADDNSA-N 324.443 5.525 30 20 DKED C=C(C)CCc1noc([C@H](C)Sc2ccccc2Cl)n1 508625226 KBWNDAUUZXQJJV-NSHDSACASA-N 308.834 5.085 30 20 DKED C[C@H]1/C(=C\c2csc(-c3cccs3)n2)C(=O)c2ccccc21 809158236 ZEELTWOAIKZFKW-BTAWCLGRSA-N 323.442 5.255 30 20 DKED Cc1ccc2c(c1)CC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 815635498 DNJIVJFGSXRCQQ-SFTDATJTSA-N 304.437 5.007 30 20 DKED Cc1cc(Cl)ccc1CNc1ccccc1SCCC#N 864005770 LASCYLURUAKMKD-UHFFFAOYSA-N 316.857 5.266 30 20 DKED N#CCCCCNCc1ccc(-c2cccc(Cl)c2Cl)o1 237783332 ZFZWUAYLTXHFAD-UHFFFAOYSA-N 323.223 5.037 30 20 DKED C[C@@H](Sc1snc(Cl)c1C#N)c1ccc(Cl)cc1 301935646 TZIWWUZQVRFVHO-SSDOTTSWSA-N 315.250 5.175 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H](C)c1cccc(Cl)c1 410358667 HPBMCEQERWHNLC-CQSZACIVSA-N 313.828 5.201 30 20 DKED CCCc1ccc([C@H](N[C@@H]2CC[C@H](C#N)C2)c2cccs2)cc1 442640018 ZIZARMWGGFGMQN-HQRMLTQVSA-N 324.493 5.072 30 20 DKED CC(C)c1ccc([C@H](N[C@@H]2CC[C@@H](C#N)C2)c2cccs2)cc1 442647982 LLEGDUPFAHNLCW-ZTNFWEORSA-N 324.493 5.243 30 20 DKED Cc1cccc(Cl)c1CN[C@H](CCCC#N)c1ccccc1 451059238 CILQSAWDTQJBPC-LJQANCHMSA-N 312.844 5.173 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cc(Cl)ccc1F 485758889 RGTODCLIROWUEL-UHFFFAOYSA-N 321.804 5.010 30 20 DKED C[C@H]1CCC[C@H](CCSCCCC2(C#N)CCOCC2)C1 508588653 NTXNEATVYPWIMX-DLBZAZTESA-N 309.519 5.037 30 20 DKED N#CCCCCN[C@@H](c1ccccc1)[C@H]1CCCc2ccccc21 539331366 JDHSCSYRKMWTCP-VXKWHMMOSA-N 318.464 5.131 30 20 DKED N#Cc1ccc(Oc2cccc(NCc3cccc(F)c3)c2)cc1 609221391 UWULOXZKEJCQJP-UHFFFAOYSA-N 318.351 5.102 30 20 DKED Cc1ccccc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 727263478 DGSTZJQMCIZDSO-QXMHVHEDSA-N 305.402 5.015 30 20 DKED C=CCC(F)(F)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 815164348 WEKXOOXBOXMMGT-GFCCVEGCSA-N 313.413 5.036 30 20 DKED CC(C)(CCC#N)CNc1ccccc1SCC(F)(F)F 92143919 OKHGWBGMSMSEOJ-UHFFFAOYSA-N 316.392 5.083 30 20 DKED C[C@H](SCc1ncc(Cl)cc1Cl)c1cccc(C#N)c1 443156699 STPKXZMARKVCGY-JTQLQIEISA-N 323.248 5.254 30 20 DKED N#CCCC[C@H](NC1CC(c2cccc(F)c2)C1)c1ccccc1 559864155 SDVGHVNCCQYZRH-MNLRITNHSA-N 322.427 5.096 30 20 DKED C/C=C/c1ccc(N[C@@H](CCC#N)c2ccc(OC)cc2)cc1 562055558 FATBVXDQDVYCGU-GECPCNCSSA-N 306.409 5.185 30 20 DKED C=CCC[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccco1 573143531 PASCDVQSNJPNEG-CHWSQXEVSA-N 307.846 5.279 30 20 DKED CC(C)Oc1ccc([C@@H](C)NCC(C)(C)CCC#N)cc1Cl 577667386 NIMLIDLZGXFERM-CQSZACIVSA-N 322.880 5.108 30 20 DKED C=CCCC(=O)N[C@@H](c1ccccc1)c1ccc2ccccc2c1 597607247 MBINNAKIRUEMFQ-QFIPXVFZSA-N 315.416 5.012 30 20 DKED CCCCCCCCCC[C@H](C)Nc1cc(C(=O)O)ccn1 1776785269 MVBJGTDPMNXJSB-HNNXBMFYSA-N 306.450 5.111 30 20 DKED C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 21009058 YNFQDZBBGSOGGL-RYUDHWBXSA-N 319.235 5.277 30 20 DKED C=C[C@H](CC(=O)Nc1c(Cl)ccc(C)c1C)c1ccccc1 434031168 LVDBUAWZLBNNLA-OAHLLOKOSA-N 313.828 5.255 30 20 DKED C[C@H](SCc1ccc2ccccc2n1)c1cccc(C#N)c1 443134516 PMIHGEWKJXISQQ-AWEZNQCLSA-N 304.418 5.101 30 20 DKED CC[C@H](N[C@@H](CC)c1cccc(Cl)c1)c1ccc(C#N)cc1 447542050 HZAXFSMKABBRBN-OALUTQOASA-N 312.844 5.404 30 20 DKED C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1cccc2ccccc12 467813931 PPKBLVROAHXZCF-OAQYLSRUSA-N 319.448 5.272 30 20 DKED C=CCC[C@H](C(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 478056640 ZNXSXKILORFWGY-YYWHXJBOSA-N 317.432 5.155 30 20 DKED CC(C)c1cccc(CN[C@H](CCCC#N)c2ccccc2)c1 595503075 PLJMNUDXSNIWKG-OAQYLSRUSA-N 306.453 5.335 30 20 DKED C=CC1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2C)CC1 601112386 OMCLIMNGNMIABE-UHFFFAOYSA-N 320.436 5.092 30 20 DKED CC[C@@H](NCC1CCC(C#N)CC1)c1cccc2ccccc12 619673719 WYQSTIPGPRWCIA-MYKUNDNFSA-N 306.453 5.210 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2ccccc2)cc1F 683780415 HMYLUMXLWGEJTE-KRWDZBQOSA-N 324.399 5.065 30 20 DKED Cc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)ccc1F 745990101 JXLWMPNUJILCJF-OQFOIZHKSA-N 317.363 5.092 30 20 DKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1nccc2ccccc12 792106442 QRUPHTHWHTWYPZ-MAUKXSAKSA-N 308.425 5.018 30 20 DKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccsc2)cc1 800986309 FUKDDYMUYFZDSF-KGLIPLIRSA-N 321.873 5.291 30 20 DKED N#Cc1cccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c1 917518060 RKDSQBPYGKVOER-KTKRTIGZSA-N 315.397 5.183 30 20 DKED CC1=C(/C(O)=N/[C@@H](C#N)c2cccc(Cl)c2Cl)CCC1 330560233 BDVBLCMDLJHYNP-ZDUSSCGKSA-N 309.196 5.015 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc2occ(C)c2c1 486566818 PJKMZJPBLSIUDL-UHFFFAOYSA-N 323.417 5.272 30 20 DKED CC(C)(C#N)CCCNc1cccc(-c2ccc3c(c2)CCO3)c1 540076961 CKUQOYFSQWBJQZ-UHFFFAOYSA-N 320.436 5.030 30 20 DKED CC(C)c1ccc([C@@H](NCc2cccc(C#N)c2)C(C)C)cc1 611567104 VBIRSDYBEMXNSV-NRFANRHFSA-N 306.453 5.169 30 20 DKED CCCCCCCCCC(=O)Nc1cccnc1C(F)(F)F 809330736 WHIDHJXHUJVHJT-UHFFFAOYSA-N 316.367 5.180 30 20 DKED CC(=O)c1c(C)cc(C)c(CSCc2ccc(C#N)cc2)c1C 32794359 JMANAEHPHBWVET-UHFFFAOYSA-N 323.461 5.120 30 20 DKED C=C[C@H](CC(=O)N1CCCCC[C@@H]1c1ccco1)c1ccccc1 135275358 ZZFMWEOUHJACJH-IEBWSBKVSA-N 323.436 5.083 30 20 DKED Cc1cc(N[C@@H](C)c2ccc(C#N)cc2)ccc1-c1ccncc1 427825060 HAWBVSUOSXZFIG-INIZCTEOSA-N 313.404 5.102 30 20 DKED C[C@@H](NCC1(CC#N)CC1)c1ccc(SC2CCCC2)cc1 430745784 FKJVRBQYCQDMHC-OAHLLOKOSA-N 314.498 5.066 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cccc(C(C)(F)F)c1 444952752 ZNRJHUHBFIQZQR-UHFFFAOYSA-N 310.388 5.008 30 20 DKED Cc1ccc(C)c(Sc2ccc(NC(=O)CCCC#N)cc2)c1 461781358 WPLNQCJVRRSRAS-UHFFFAOYSA-N 324.449 5.087 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccccc1)C(C)(C)C 487381106 SMXALOJKQYUPAJ-FQEVSTJZSA-N 320.480 5.365 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C)c1cccc(C#N)c1 538407101 IVBAMARMAUAXHE-BBNYVJOESA-N 324.855 5.260 30 20 DKED C[C@@H](N[C@H](c1cccc(F)c1)C1CCCC1)c1ccc(C#N)cc1 540593400 IAIXAZORSMNAMR-VFNWGFHPSA-N 322.427 5.279 30 20 DKED N#CCCCCCC(=O)Nc1cccc(Sc2ccccc2)c1 588925550 VMENDJPQJUDGKG-UHFFFAOYSA-N 324.449 5.250 30 20 DKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/C1CCCCC1 735426680 RXXRZQKXUZOWAW-DHZHZOJOSA-N 323.889 5.053 30 20 DKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc2ccccc2c1 746345287 CHDYUEDLQNTROT-BENRWUELSA-N 318.420 5.130 30 20 DKED CSc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 340449327 UOTOQBQPHIHHOB-UZLBHIALSA-N 324.493 5.494 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCC2 340449473 VISPDJMUFYZLIT-VGOFRKELSA-N 318.464 5.261 30 20 DKED CC1(C#N)CCC(N[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1 414253498 ZIZXEQKKBNYMMA-IZIZEDOESA-N 316.876 5.038 30 20 DKED N#CCCCS[C@@H](c1ccccc1)c1ccc(F)c(F)c1 479505928 SXZVAIAKRZGTEW-KRWDZBQOSA-N 303.377 5.091 30 20 DKED CC(C)[C@@H]1C[C@@H](N[C@H]2CCc3cc(C#N)ccc32)c2ccccc21 618802158 CZEZDFQXZNQKBZ-FDFHNCONSA-N 316.448 5.020 30 20 DKED O=C(/C=C\c1ccnc(Cl)c1Cl)c1cc2ccccc2o1 791435127 PQJGCCQUCUDYCZ-WAYWQWQTSA-N 318.159 5.031 30 20 DKED C[C@H](Nc1cc(Cl)cc(Cl)c1)c1ccc(OCC#N)cc1 37199529 DRKVPKUWNMKHPL-NSHDSACASA-N 321.207 5.069 30 20 DKED Cc1ccc2cc([C@H](C)N[C@H](CCC#N)c3ccccc3)oc2c1 426014784 DLBKWJCFBKOLQP-QFBILLFUSA-N 318.420 5.437 30 20 DKED N#C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)C1CCCCC1 522629549 SQMPSEVMIXCFAZ-OALUTQOASA-N 324.493 5.094 30 20 DKED CCc1c([C@H](C)NCc2cccc(C#N)c2)oc2ccc(C)cc12 539500128 QKGXETPEGMVMNF-HNNXBMFYSA-N 318.420 5.026 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2cccc(-c3cccnc3)c2)c1 763287408 CJFYBBXGJZIZTO-NTMALXAHSA-N 317.363 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(C)o1 789719380 ORBXMUCFUWMPLF-HNNXBMFYSA-N 311.425 5.182 30 20 DKED CC(C)CCCCCC(=O)[C@H](C#N)c1nccc2ccccc12 792105985 OWKROMKIOLTYRV-SFHVURJKSA-N 308.425 5.018 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1cccc2cccnc12 818197746 GHBITQHZOGERBP-UHFFFAOYSA-N 323.399 5.407 30 20 DKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C(C)C)cc1 1776783962 BTQMHTXZEAJJJP-LJQANCHMSA-N 319.489 5.103 30 20 DKED CC1(C)C[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 358337028 DXZIBHCBKYTYNP-WOJBJXKFSA-N 304.437 5.044 30 20 DKED CC[C@H](Nc1cccc(COCC2CC2)c1)c1ccc(C#N)cc1 447579094 IYXPVLXIMOMEIX-NRFANRHFSA-N 320.436 5.048 30 20 DKED N#CCCCCN[C@H](CCCc1ccccc1)c1ccccc1 532215946 FUMFOZLHZGJXSO-OAQYLSRUSA-N 306.453 5.034 30 20 DKED CC[C@@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1 579412991 DSZASJNKJFYKSW-HUUCEWRRSA-N 316.857 5.001 30 20 DKED C[C@@H](CC(=O)Nc1ccccc1SCCC#N)CC(C)(C)C 609375568 RJZIGONDKYTWOH-AWEZNQCLSA-N 318.486 5.093 30 20 DKED COCc1ccc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cc1 741840415 TZZFCARGBMYFHA-RMKNXTFCSA-N 321.203 5.036 30 20 DKED CC(=NNc1cccc(F)c1F)c1cccc(Cl)c1Cl 743443052 OKXWWGXPWZALSY-UHFFFAOYSA-N 315.150 5.108 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCSCCCC 189901330 HFFXSASBHGSPQM-UHFFFAOYSA-N 319.514 5.400 30 20 DKED CC(C)C[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 192995055 PTULBWUGIFNNBK-LAUBAEHRSA-N 322.452 5.027 30 20 DKED C=CC[C@@H](C(=O)Nc1cc(SC)ccc1C)c1ccccc1 489602346 FNWKQAIQXAPTJP-QGZVFWFLSA-N 311.450 5.015 30 20 DKED C=C(C)CCSCc1csc(-c2ccccc2OC)n1 507115102 DIIWPQHWUUESGD-UHFFFAOYSA-N 305.468 5.018 30 20 DKED CC1(C)C[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 520850944 MZILGMGQJGDVJK-RTWAWAEBSA-N 318.464 5.434 30 20 DKED C=CC[C@@H](CC)NC(=S)Nc1c(C(C)C)cccc1C(C)C 798376269 UIEGNMNHZPAMJE-OAHLLOKOSA-N 318.530 5.575 30 20 DKED CC[C@H](C)c1cccc(NC(=O)c2ccccc2SCC#N)c1 862487648 SNXSSXAUBOYRBY-AWEZNQCLSA-N 324.449 5.068 30 20 DKED CCC[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 25437524 ZJHLNQRLAHTEIR-IBGZPJMESA-N 320.436 5.010 30 20 DKED N#C[C@@H]1CC[C@@H](Nc2cccc(CSCc3ccccc3)c2)C1 442852765 IHEYTWKPMIHZQK-YLJYHZDGSA-N 322.477 5.224 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccsc1 476124863 YSAILJXOELQLQL-CQSZACIVSA-N 313.466 5.342 30 20 DKED C=CC[C@H](C)N[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 542493471 BCMNNIPKRSXZKO-BTYIYWSLSA-N 320.411 5.018 30 20 DKED C[C@H](S[C@H](C#N)Cc1ccccc1)c1ccc(Cl)cc1 604485849 VXMITCZOSUXRLY-GUYCJALGSA-N 301.842 5.269 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H](C)C2CCCCC2)n1 747196156 HEZQJGNAMJTBRV-DZGCQCFKSA-N 318.486 5.049 30 20 DKED C=CC[C@@H](N[C@@H](CC)c1ccc(Cl)s1)c1ccncc1 766017372 ASQIJLCCFJFJCY-UONOGXRCSA-N 306.862 5.155 30 20 DKED C=C[C@H](CC(=O)Nc1ccccc1NC(C)(C)C)c1ccccc1 466455822 OHTQUJLUUFSTPY-MRXNPFEDSA-N 322.452 5.195 30 20 DKED C[C@@H](N[C@@H](c1ccccc1F)C1CCCC1)c1cccc(C#N)c1 540591029 DDPWIPWTEIBDAZ-QVKFZJNVSA-N 322.427 5.279 30 20 DKED Cc1ccsc1C(=O)/C=C\c1ccc(-c2ccncc2)cc1F 751534819 JSLWQCYXNGOQSO-PLNGDYQASA-N 323.392 5.154 30 20 DKED C#CC[C@@H](N[C@H](C)c1cc2ccc(C)cc2o1)c1ccccc1 756040277 JBMFMBKRJVLDJX-VQIMIIECSA-N 303.405 5.156 30 20 DKED Cc1c(CSC(C)C)cccc1NCc1cc(C#N)cs1 236616663 RTPJCEUHJOTZQC-UHFFFAOYSA-N 316.495 5.182 30 20 DKED N#CCCCOc1cccc(CNc2ccc(C3CCC3)cc2)c1 487163359 KCNTWQYTEHAWLJ-UHFFFAOYSA-N 320.436 5.249 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccsc1Cl 594704866 GGGMJZIDDRMNAL-LLVKDONJSA-N 322.886 5.265 30 20 DKED CC(C)c1nc2ccc(N[C@H](C)c3cccc(C#N)c3)cc2s1 600847403 CYTLTSIBYQOGPH-CYBMUJFWSA-N 321.449 5.464 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(Cl)c1 487360552 DPYVBOMUCZEYPW-ZDUSSCGKSA-N 316.857 5.346 30 20 DKED CCCC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1 537293558 WXHKVZCGFAAPMN-IIBYNOLFSA-N 322.452 5.149 30 20 DKED CCC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1 538141923 YQVBOIGZOSTVMZ-HXUWFJFHSA-N 306.453 5.119 30 20 DKED CCCCCCCC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 742131707 MSIPOHFGQODACL-QAPCUYQASA-N 305.437 5.096 30 20 DKED CC[C@@H](C)c1ccccc1OC(=O)C[C@@H](CC#N)c1ccccc1 796523073 CCCPWXJECJRDBO-SJLPKXTDSA-N 321.420 5.193 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCC(F)(F)C1 798000092 KUKPJSVPDZYQNE-AWEZNQCLSA-N 321.411 5.303 30 20 DKED CC(C)Sc1ccc([C@@H](C)NCCCC(C)(C)C#N)cc1 182098418 VKRJOBONEAFEQO-OAHLLOKOSA-N 304.503 5.168 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1C1CC1 280982629 AAMTWYQESIEHHO-UHFFFAOYSA-N 309.409 5.261 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(C)cc1 475575139 QFRRFZPRSVXQSS-UHFFFAOYSA-N 308.425 5.491 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccco1 529137247 QELZPXSBQJIFEJ-HNNXBMFYSA-N 311.425 5.264 30 20 DKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(-c2cccs2)cc1 557729188 UIBYLOCLJQUDJC-CYBMUJFWSA-N 324.474 5.199 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(=C)C2 666866480 RGDONAHYRUFMRQ-ROUUACIJSA-N 324.468 5.253 30 20 DKED C=CCN(Cc1ccccc1)C(=S)Nc1cccc(C(C)C)c1 917577681 YYGZQYLAFCPFAO-UHFFFAOYSA-N 324.493 5.195 30 20 DKED N#CCC[C@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1 130461312 BSZZDVSCALNBMG-KRWDZBQOSA-N 319.235 5.128 30 20 DKED N#CCc1ccc(NCc2ccc(Cl)c(C(F)(F)F)c2)cc1 185144840 KECNIZRWLMMQFE-UHFFFAOYSA-N 324.733 5.037 30 20 DKED N#CCCC[C@@H](NCc1ccc(Cl)c(F)c1)c1ccccc1 353916629 QXIXEODOOBTYRI-GOSISDBHSA-N 316.807 5.004 30 20 DKED Cc1c(CSC(C)C)cccc1NCc1ccc(C#N)s1 537718923 RXJIDNKZPOBSHO-UHFFFAOYSA-N 316.495 5.182 30 20 DKED C[C@H](N[C@@H](c1cccc(F)c1)C1CCCC1)c1ccc(C#N)cc1 540593402 IAIXAZORSMNAMR-YCRPNKLZSA-N 322.427 5.279 30 20 DKED C=CCOc1cccc(CN[C@@H](C)c2csc3ccccc23)c1 730019936 VCYDGWXTYFJPHV-HNNXBMFYSA-N 323.461 5.317 30 20 DKED CC1(C)CCCC[C@H]1CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 752472907 CECGAODKISMNLE-IRXDYDNUSA-N 320.436 5.018 30 20 DKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 753389611 GKPPYBBRFCDSDZ-CYBMUJFWSA-N 314.454 5.079 30 20 DKED C#CC[C@H](N[C@H](C)c1ccc(SCC)cc1)c1ccccc1 773117264 VANFVVHKWUQMHU-UZLBHIALSA-N 309.478 5.214 30 20 DKED CCCCCCCC[C@H](C)CC(=O)N1CC2(C1)CC(F)(F)C2 775617186 SDWRMIVGXYRBST-HNNXBMFYSA-N 315.448 5.021 30 20 DKED CCCCCCCC(=O)N1CCC[C@H]1c1ccc(OCC)cc1 887048905 BFSCVSLZRJUFSS-IBGZPJMESA-N 317.473 5.109 30 20 DKED C[C@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 37220687 BDPYDSDDHHMMKF-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C[C@H](C#N)CSc1ccccc1NCC1CCC(F)(F)CC1 417042055 WIJUXIPAYIIEMZ-CYBMUJFWSA-N 324.440 5.176 30 20 DKED CC[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc(C#N)cc1 447576310 XUNBCJDBMRJMRW-KRWDZBQOSA-N 317.392 5.140 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1sccc1Cl 453089260 NQRJLCWIGNTTDB-LLVKDONJSA-N 322.886 5.265 30 20 DKED C[C@H](Nc1ccccc1SCCC#N)c1ccccc1F 600846455 GCYOQJRINAIXLS-ZDUSSCGKSA-N 300.402 5.005 30 20 DKED CC(=NNc1ccccc1)c1sc(-c2ccc(C)cc2)nc1C 727650791 UJUHWPUJVSLKLW-UHFFFAOYSA-N 321.449 5.263 30 20 DKED Cc1ccsc1C(Cc1ccccc1)=NOCc1ccccc1 735971950 DTVHMTKDEFOXSI-UHFFFAOYSA-N 321.445 5.220 30 20 DKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nc2ccccc2s1 744016358 LPGQSZJHJYDSRF-KBPBESRZSA-N 314.454 5.079 30 20 DKED CCCCCCC[S@](=O)Cc1c(C)cc(C)c(C(C)=O)c1C 764452098 KZUXLZZVNSJHHY-QFIPXVFZSA-N 322.514 5.034 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1csc2ccccc12 776154879 CKHWFVCRXHYZTC-KGLIPLIRSA-N 306.434 5.185 30 20 DKED O=C(/C=C/c1ccc(F)nc1)c1cc2c(ccc3ccccc32)o1 777465778 HZESVVSYJURNNV-VMPITWQZSA-N 317.319 5.016 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccncc1 815580044 AZLVXTRCESMQNL-QVKFZJNVSA-N 320.411 5.342 30 20 DKED CCCCCCCCCCCN(C)CCC(C)(C)CC(=O)O 1776784588 LZJFRQCGVDFADR-UHFFFAOYSA-N 313.526 5.340 30 20 DKED C[C@@H](Nc1ccc(SC(F)F)cc1)c1cccc(C#N)c1 37271214 KIHQTVBMHQLKMI-LLVKDONJSA-N 304.365 5.046 30 20 DKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCc2ccccc21 63275145 IQWFTKMZTLGIRY-LCYFTJDESA-N 323.442 5.084 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1F 90665876 JCJCEUFYBBAZJN-MOPGFXCFSA-N 314.379 5.051 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C#N)cc1C 191540073 UPEVIJSDHHNXIS-UHFFFAOYSA-N 320.436 5.195 30 20 DKED CCC(CC)[C@@H](NCc1cccc(F)c1C#N)c1cccs1 428321966 RVEUFJZRUBHJAY-GOSISDBHSA-N 316.445 5.026 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2ccsc2Cl)CCCC1(C)C 445160185 SITJDLKJZPITRV-LBPRGKRZSA-N 312.866 5.000 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CCC)cc1 476106660 GJPXPINOPFYYNJ-UHFFFAOYSA-N 321.464 5.743 30 20 DKED CC(C)(C#N)CCC[S@](=O)c1ccc(C2CCCCC2)cc1 531341251 AGEVTKOJZFKRHP-QFIPXVFZSA-N 317.498 5.172 30 20 DKED C=CCC[C@H](C(=O)Nc1cc(F)ccc1Cl)c1ccccc1 547952156 WOAQNUSYRPIIHC-HNNXBMFYSA-N 317.791 5.168 30 20 DKED C[C@H](CC#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 597362026 JEHQBCZMZQHCBQ-HUUCEWRRSA-N 324.449 5.028 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2[nH]1 926481588 UUQRBMFIKVNZHD-QFBILLFUSA-N 317.436 5.254 30 20 DKED C[C@H](S[C@H](C)c1nc2ccccc2o1)c1cccc(C#N)c1 190822417 JIVWYIMWZSZLKV-QWHCGFSZSA-N 308.406 5.255 30 20 DKED C[C@@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340444764 JKFPBDIJIGWWKB-CZAAIQMYSA-N 304.437 5.260 30 20 DKED Cc1cc(CS[C@@H](C)c2ccc(C#N)cc2)c2ccccc2n1 437273957 GRYUKBHFKOPGHE-HNNXBMFYSA-N 318.445 5.409 30 20 DKED CC1=C(C(=O)N[C@@H](CCCC#N)c2ccccc2)CCC(C)(C)C1 452138702 JXTHLBHQLYAUFM-IBGZPJMESA-N 324.468 5.064 30 20 DKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(-c2ccccc2)cc1 557665593 WGJVNDDVXVCINZ-OAHLLOKOSA-N 318.445 5.138 30 20 DKED CCCC[C@@H](CC)CC(=O)Nc1ccccc1SCCC#N 609754821 IAVQSEXODVOMPB-OAHLLOKOSA-N 318.486 5.237 30 20 DKED CC[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1 618572659 BNJDGOMBEMAUEM-HXUWFJFHSA-N 322.452 5.437 30 20 DKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1csc(Cl)c1 789146596 ADSGATGDSIQOKR-ONEGZZNKSA-N 321.810 5.014 30 20 DKED O=C(/C=C\c1ccc(C(F)F)cc1)c1cccc(OC(F)F)c1 794934832 WHTLELPFIALMCU-TWGQIWQCSA-N 324.273 5.122 30 20 DKED C[C@@H](SCc1ccc2ncccc2c1)c1cccc(C#N)c1 527198019 SDVKZXNVRCQCQC-CQSZACIVSA-N 304.418 5.101 30 20 DKED Cc1c([C@@H](NCc2ccccc2C#N)C(C)C)oc2ccccc12 538159189 DXEUFQYPZPMVNG-FQEVSTJZSA-N 318.420 5.100 30 20 DKED CCC(C)(C)OCc1ccccc1N[C@H](C)c1ccc(C#N)cc1 543450251 ZSOIVOPNLVRATA-MRXNPFEDSA-N 322.452 5.437 30 20 DKED CC[C@@H](C)Oc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1 559878805 SUCWXNKDRLIOTC-ZIAGYGMSSA-N 312.388 5.048 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC2(CC1)CC2 613901409 PZSYMPMBNCLCLR-UHFFFAOYSA-N 311.469 5.447 30 20 DKED Cc1cc2ccccc2nc1NN=C1CCC(C(F)(F)F)CC1 766026219 CZGSVUZAGQLYFA-UHFFFAOYSA-N 321.346 5.064 30 20 DKED C#CCCCCCC(=O)N1CCC[C@H]1c1cccc2ccccc12 780701342 WXYIWMDLPLRRBH-NRFANRHFSA-N 319.448 5.087 30 20 DKED C=CC[C@@H](N[C@@H](CC)c1sccc1Cl)c1ccncc1 883190256 YOHYFMZZONDGCD-LSDHHAIUSA-N 306.862 5.155 30 20 DKED CCCOc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 181574169 FTGBZRYQHLKTJH-DYESRHJHSA-N 322.452 5.171 30 20 DKED Cc1cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc(C)c1F 358336082 CBRSIPXGEAFNMY-APWZRJJASA-N 310.416 5.138 30 20 DKED CSc1ccccc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 417354939 AELAIHCEEAKYJY-LIRRHRJNSA-N 322.477 5.008 30 20 DKED CC(C)[C@@H]1C[C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc21 447539384 ADOABYMEPJYDPZ-ONGXBYRLSA-N 304.437 5.093 30 20 DKED C[C@@H]1CC[C@H](N[C@H](CCC#N)c2ccccc2)c2sccc21 453183380 YDJUZEHRCAWJEI-OLMNPRSZSA-N 310.466 5.321 30 20 DKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(C3CCC3)cc2)cc1 477102471 SGLRTPMUTUCPKQ-UHFFFAOYSA-N 318.420 5.008 30 20 DKED Cc1ccc(C[C@H](C#N)SC2=Nc3ccccc3CS2)cc1 729931558 MDXHTAGESGLRLN-MRXNPFEDSA-N 324.474 5.097 30 20 DKED CCCCCCCCCC(=O)N(c1nc(C)cs1)C1CC1 741951506 UZMXWCLFHHFUDZ-UHFFFAOYSA-N 308.491 5.088 30 20 DKED CCCCCCCCCC(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1 754503650 VPNQKJZYWRYUQN-PKOBYXMFSA-N 316.489 5.132 30 20 DKED CC(C)n1nccc1/C=C/C(=O)c1ccc(-c2ccccc2)cc1 794925844 DYJYCRURFOYWCS-OUKQBFOZSA-N 316.404 5.027 30 20 DKED N#C[C@@H]1CC[C@@H](Nc2ccccc2SCc2ccccc2)C1 799721952 BQLUPKXEAHVBGK-IAGOWNOFSA-N 308.450 5.083 30 20 DKED C[C@@H](Sc1ncc(-c2ccc(F)cc2)o1)c1ccc(C#N)cc1 303716450 QVCFGTCGHHVGAO-GFCCVEGCSA-N 324.380 5.206 30 20 DKED CC[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1ccc(C#N)cc1 517278345 KYBMWQDXSOIGFN-YVEFUNNKSA-N 316.807 5.153 30 20 DKED Cc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)c1 521280922 HDSWHWTYOACEMF-GHTZIAJQSA-N 306.453 5.389 30 20 DKED C[C@@H](CCN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 574791039 HXRYSFKADPOHCT-RXVVDRJESA-N 306.453 5.205 30 20 DKED C[C@@H](NCc1ccc(-c2cccs2)cc1)c1cccc(C#N)c1 618302233 JHHLGXPRLZDEKD-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc(Cl)s1 742437279 SEWVSAQCEUVHDH-FSEMZKDTSA-N 312.868 5.224 30 20 DKED C=CC[C@H](N[C@H](C)c1oc2ccccc2c1C)c1ccncc1 766019231 KZMUHBTZWMQYCR-QAPCUYQASA-N 306.409 5.104 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1coc2ccccc12 926478759 CNMRSWPHWBXWDD-OXQOHEQNSA-N 318.420 5.519 30 20 DKED Cc1nc(-c2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2)cs1 74336704 CKSNIMVHVUASOG-CYBMUJFWSA-N 319.433 5.163 30 20 DKED Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H](CCC#N)c1ccccc1 90665683 WYYDKHJKBASRAL-LSTHTHJFSA-N 304.437 5.178 30 20 DKED C=CCCc1ccccc1NCc1coc(-c2ccccc2)n1 409870912 PZEJTWASLASJLH-UHFFFAOYSA-N 304.393 5.072 30 20 DKED CC(C)(C#N)CCCCN[C@@H](c1ccc(F)cc1)C(C)(C)C 444652234 XIDNWKSHGXAODS-KRWDZBQOSA-N 304.453 5.223 30 20 DKED CC[C@@H](N[C@H](C)c1cc2ccccc2o1)c1ccc(C#N)cc1 447517600 SWQTUIIFNSSMAQ-RDTXWAMCSA-N 304.393 5.106 30 20 DKED C=C(C)[C@@H](NCc1coc2ccccc12)c1ccc(F)c(F)c1 479410094 QQFFBSLNDOXVDS-LJQANCHMSA-N 313.347 5.118 30 20 DKED C=CCC[C@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccccc1 502405178 LGHFHADYEOYIOP-UTKZUKDTSA-N 323.484 5.356 30 20 DKED C=CCC(C)(C)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 550034433 LYACDAOFJULOQM-INIZCTEOSA-N 322.452 5.401 30 20 DKED CCc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)s1 551204873 GNHJQZUVAASPMX-CRAIPNDOSA-N 312.482 5.396 30 20 DKED C[C@H](SCc1ccnc(C#N)c1)c1ccc2ccccc2c1 610954197 HAEAWVARGHJIHB-AWEZNQCLSA-N 304.418 5.101 30 20 DKED CSc1ccccc1[C@H](C)NCc1ccc(C(C)(C)C#N)cc1 619654630 ABLCMWPHKWDSCO-HNNXBMFYSA-N 324.493 5.060 30 20 DKED CCCCCCCC(=O)Nc1ccccc1SC[C@@H](C)C#N 730990087 RRVLGEMBXXLDJD-HNNXBMFYSA-N 318.486 5.237 30 20 DKED COc1ccccc1-c1ccc(C(C)=NNc2ccccc2)cc1 741450777 AUIDLPNFDMVUIS-UHFFFAOYSA-N 316.404 5.198 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 746047346 MGOXUVUKOJKITO-DYVFJYSZSA-N 320.358 5.068 30 20 DKED CCCCCC1=CCCC1=NNc1ncccc1C(F)(F)F 915050406 OBPZAUYZHGOOLG-UHFFFAOYSA-N 311.351 5.169 30 20 DKED CCCCCCCCNc1nc2ccccc2c(C)c1C(=O)O 1776785410 WSZUQJYNKIYFMX-UHFFFAOYSA-N 314.429 5.014 30 20 DKED C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 464516197 CCPPJRVNMYJVHP-RYUDHWBXSA-N 314.256 5.115 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1cc2ccccc2o1 486551953 UQLIUNKLBKBTOE-CQSZACIVSA-N 322.433 5.439 30 20 DKED CC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C)cc1 540355494 GCDKPSZVWCCHLL-HXUWFJFHSA-N 306.453 5.037 30 20 DKED N#CCCC[C@H](N[C@H]1CC[C@@H](c2ccccc2)C1)c1ccccc1 559861906 DLTUDCRLALAWPB-FSSWDIPSSA-N 318.464 5.347 30 20 DKED C=CCOc1ccc(/C=C(/Cl)c2nc3ccccc3o2)cc1 747161555 PRJWZYIZQIARFT-NTCAYCPXSA-N 311.768 5.130 30 20 DKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)cc1 170991783 OFEFNUXCKXYOGS-ZIAGYGMSSA-N 314.429 5.251 30 20 DKED C=CCCc1ccccc1NC(=O)c1c(Cl)cccc1Cl 410343217 DVLCEZXDLPQYID-UHFFFAOYSA-N 320.219 5.364 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)cc1 540705562 TZPSNTLPFSBAKT-SGTLLEGYSA-N 316.807 5.153 30 20 DKED C=CCC[C@H](NCc1cccc(-c2cccnc2)c1)c1ccco1 552065489 BYMIXLRKLUDCPP-FQEVSTJZSA-N 318.420 5.139 30 20 DKED CC[C@@H](Cc1ccccc1)N[C@@H](CCCC#N)c1ccccc1 574059314 LCPSEMDOGWJTAG-SFTDATJTSA-N 306.453 5.032 30 20 DKED Cc1cccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)c1 751514128 WPUHULHMOOOHOP-BQYQJAHWSA-N 311.431 5.076 30 20 DKED CC1(C)CCC/C(=C/c2csc(-c3ccsc3)n2)C1=O 757533697 HWMRBYHOIQDZBG-FLIBITNWSA-N 303.452 5.034 30 20 DKED C(=NNc1ccccc1)c1ccc(-c2nc3ccccc3s2)o1 916245901 JKEBWEQRYRXPCL-UHFFFAOYSA-N 319.389 5.002 30 20 DKED N#CCCCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1 255941876 WBAQDIPKCGFTDI-UHFFFAOYSA-N 319.433 5.140 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccncc1Cl)c1ccccc1 421831305 DSGGGRZEOMSRCU-KBXCAEBGSA-N 300.833 5.093 30 20 DKED Cc1c([C@H](C)NCc2ccc(C#N)cc2Cl)oc2ccccc12 439449623 IQEXFAFXJTUJCY-ZDUSSCGKSA-N 324.811 5.117 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC2CCC1CC2 506046172 RQJQSTZVELZVDY-LADRWXRNSA-N 311.469 5.303 30 20 DKED CC(C)(C)[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1 563330084 JQACLYQMAXVVNU-WOJBJXKFSA-N 322.427 5.062 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(C)c(C)c1 732625382 NHJMWTISWXLFOU-UHFFFAOYSA-N 316.514 5.069 30 20 DKED CCCCCCCCCC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 754503648 VPNQKJZYWRYUQN-IEBWSBKVSA-N 316.489 5.132 30 20 DKED C=CCCCCC[C@H](C)N[C@@H]1CCO[C@@H](c2cccs2)C1 825086104 PWQPAMOAINHWIX-GVDBMIGSSA-N 307.503 5.083 30 20 DKED Cc1ccccc1[C@@H](NCc1ccccc1C(C)(C)C#N)C1CC1 539493099 JERSSJORCFOCPI-NRFANRHFSA-N 318.464 5.037 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC2(CC2)C1 613902272 YZABYOIVSUSXJW-KRWDZBQOSA-N 311.469 5.447 30 20 DKED C=CCCCCCN(C)C(=S)Nc1cccc(Cl)c1C 739455938 DBCBOLURAHWYBI-UHFFFAOYSA-N 310.894 5.023 30 20 DKED C=CCCN(C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 786053913 QIXFGALIMBERRV-UHFFFAOYSA-N 308.385 5.142 30 20 DKED CC(C)Oc1ccc(N[C@@H](C)c2cccc(C#N)c2)c(Cl)c1 864009896 AVMNDKGAMAKHAK-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1 916134355 ORKTUMUQAJTXKH-QXMHVHEDSA-N 305.402 5.015 30 20 DKED CC(C)[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccccc1Cl 539495254 JZMPIJZKTHSDQF-KUHUBIRLSA-N 312.844 5.260 30 20 DKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc2ccccc2c1 560269168 PKEAFERLCKJVJE-INIZCTEOSA-N 312.416 5.051 30 20 DKED CCCCCCCC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F 742780172 DOQRXZVKOUTHSI-YJBOKZPZSA-N 305.437 5.096 30 20 DKED CC(C)(C)[C@@H](NCc1ccc(C#N)cc1)c1cc2ccccc2o1 779392959 PKTGDWLREWPPIE-FQEVSTJZSA-N 318.420 5.181 30 20 DKED CC(F)(F)c1cccc(NCc2ccccc2C(C)(C)C#N)c1 187572115 WCWKFQJMVZWUJN-UHFFFAOYSA-N 314.379 5.212 30 20 DKED CCC(CC)n1ccc(CS[C@@H](C)c2ccc(C#N)cc2)n1 433625577 RPEQWBLPYGKUKA-AWEZNQCLSA-N 313.470 5.110 30 20 DKED CC[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc(Cl)c1 439426765 BYCIOQHAYKFZTO-QGZVFWFLSA-N 319.235 5.106 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1c(F)cccc1Oc1ccccc1 466865027 NONKBKONDBNSFI-AWEZNQCLSA-N 313.372 5.159 30 20 DKED CCCc1ccc(-c2ccc(NC[C@H](C#N)CCC#N)cc2)cc1 566997348 LYPINRBHTILMSZ-SFHVURJKSA-N 317.436 5.162 30 20 DKED CC[C@H](CNc1ccccc1S[C@@H](C)CC#N)CC(F)F 594704643 CCHGMACTUYEXAA-STQMWFEESA-N 312.429 5.174 30 20 DKED CC(CSC(C)(C)C)=NNc1ccnc2cc(Cl)ccc12 729633333 NKIJKCIFYCBDCL-UHFFFAOYSA-N 321.877 5.208 30 20 DKED C=CCC[C@@H](NCc1nc(Cl)ccc1Cl)c1ccccc1 766853171 QCPGQBPOBAYOEJ-OAHLLOKOSA-N 321.251 5.186 30 20 DKED C#CCCCCC(=O)Nc1ccc(S[C@H](C)CC)cc1C 773292584 ZGVWZRBKENNVMI-OAHLLOKOSA-N 303.471 5.018 30 20 DKED CCCCC[C@H](CC)C(=O)Nc1ccccc1SCCC#N 775726014 OFHMLWSIXJPBDG-HNNXBMFYSA-N 318.486 5.237 30 20 DKED CCCCCCCC(=O)N(Cc1ccccc1)Cc1ccco1 106276749 XXJHTFWUMHMKAU-UHFFFAOYSA-N 313.441 5.169 30 20 DKED CC1(C)C[C@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 539626471 QFPOEWSIVKJXGM-FQEVSTJZSA-N 320.436 5.204 30 20 DKED CC(C)(C)C[C@@H](N[C@H](C#N)Cc1ccccc1)c1ccc(F)cc1 610294676 QXNSCJAHVAXPSP-VQTJNVASSA-N 324.443 5.027 30 20 DKED Oc1ccc(Cl)cc1C=Nc1cccc(SC(F)F)c1 727264072 LVSHJBBLPIBFKF-UHFFFAOYSA-N 313.756 5.111 30 20 DKED N#Cc1ccc(CNc2cccc(Cl)c2SC(F)F)cc1 742261519 FBGYCRXGECQTEU-UHFFFAOYSA-N 324.783 5.138 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(OCC(C)C)cc1)c1ccncc1 766018158 GETHOKUVJQRLBW-UWJYYQICSA-N 324.468 5.084 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2c1CCC2 189870431 CVRGOSLHZRQSED-UHFFFAOYSA-N 319.448 5.280 30 20 DKED Cc1c([C@@H](NCc2ccc(C#N)cc2)C(C)C)oc2ccccc12 236787112 RPHBTNIFEQLGCS-FQEVSTJZSA-N 318.420 5.100 30 20 DKED C=CCCC[C@@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 540326081 IASCICZOXHQYEJ-QZTJIDSGSA-N 324.468 5.056 30 20 DKED C=CCCc1ccccc1NC(=O)Cc1coc2cc(C)ccc12 548838491 RGVRVCYFHOSOEM-UHFFFAOYSA-N 319.404 5.041 30 20 DKED CC(C)Sc1ccc([C@H](C)NCC(C)(C)CCC#N)cc1 554364349 AGMFTBQBJJCBPK-HNNXBMFYSA-N 304.503 5.168 30 20 DKED O=C(/C=C\c1ccccc1Cl)c1ccc(-c2ccncc2)cc1 745990831 ZBPMMEIHNPQUBO-KTKRTIGZSA-N 319.791 5.298 30 20 DKED CSc1ccc(/C=C/C(=O)c2ccc(Cl)s2)s1 798232344 RTOKVTOBAGCLSH-DUXPYHPUSA-N 300.857 5.081 30 20 DKED C=CC[C@@H](N[C@H]1CCCc2ccc(SC)cc21)c1ccncc1 842842356 XFKZNBZCGARJFI-UXHICEINSA-N 324.493 5.088 30 20 DKED CCCCCCCCC(=O)Nc1cc(NC(=O)CC)ccc1C 915650588 MZQLDOWMYZXKFO-UHFFFAOYSA-N 318.461 5.033 30 20 DKED C=CC[C@@H](N[C@H](C)c1c(C)oc2ccccc12)c1ccncc1 925074522 ICTOQFCPZSKCHD-RDTXWAMCSA-N 306.409 5.104 30 20 DKED CCC(CC)(NCc1cccc(C#N)c1)c1ccc(Cl)cc1 110334086 ORWFIRZZJARSPB-UHFFFAOYSA-N 312.844 5.017 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CCC1CC1 475567753 YDHJVLSWJZEUJH-OAHLLOKOSA-N 314.473 5.239 30 20 DKED CC(/C=C\c1ccncc1C#N)=C\c1ccccc1C(F)(F)F 504720039 GTRWELQFJZMYLH-MZAZUOCOSA-N 314.310 5.089 30 20 DKED Cc1ccccc1[C@H](N[C@H](C)c1ccc(C#N)cc1)C(C)(C)C 539494778 PCOKRCRCGKKAIL-UZLBHIALSA-N 306.453 5.305 30 20 DKED Cc1cc(C)cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 556197542 JTNUPBABADYTNA-NQIIRXRSSA-N 306.453 5.389 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 578562905 CWEFZKUSIAARCS-DYESRHJHSA-N 306.453 5.506 30 20 DKED CSc1ccc(C(=O)/C=C\c2cnc(C3CCC3)s2)cc1 760261987 IAAHSRWLXNURPB-KTKRTIGZSA-N 315.463 5.029 30 20 DKED CC[C@@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)cc1 774329161 JDNJSSRTEVMPOS-MRXNPFEDSA-N 318.392 5.436 30 20 DKED CC(C)c1ccc(C=NOCc2cc(F)cc3cccnc23)cc1 914684042 YTFJQAQTKFNWDI-UHFFFAOYSA-N 322.383 5.048 30 20 DKED CC(C)(C)[C@H](NCc1ccc(C#N)cc1Cl)c1ccccc1 439444419 UTYQDSDBMROZGA-GOSISDBHSA-N 312.844 5.089 30 20 DKED CCCC[C@@H](CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 521734347 MFNSGKGVMQUXOA-LSDHHAIUSA-N 318.486 5.093 30 20 DKED CC(C)C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 537400343 XCMPREVWTRZBNH-FOIQADDNSA-N 310.416 5.135 30 20 DKED Cc1c([C@@H](NCc2ccc(C#N)s2)C(C)C)oc2ccccc12 540598546 GUSDHOCARSCLJR-SFHVURJKSA-N 324.449 5.161 30 20 DKED N#C[C@@H](Sc1ncc(-c2ccc(F)cc2)o1)C1CCCCC1 609649009 SOOXMMSVZKAGRW-MRXNPFEDSA-N 316.401 5.045 30 20 DKED CCCCCCCCC(=O)N[C@@H](C)c1nc2ccccc2s1 734112468 KOMPJASLNFMHJV-AWEZNQCLSA-N 318.486 5.224 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccc(-c3c(F)cccc3F)o2)o1 734366865 BQMCCFJHKJEWOC-SOFGYWHQSA-N 314.287 5.022 30 20 DKED N#CCOc1ccc(Cl)cc1CSc1ccccc1Cl 735230504 DBEWJWBSUFHICS-UHFFFAOYSA-N 324.232 5.188 30 20 DKED C#CC[C@H](N[C@@H](CC)c1ccc(Cl)s1)c1ccccc1 773114749 JMENAINIQTYAMC-GJZGRUSLSA-N 303.858 5.207 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccccc1CF 901383185 HZMQIYOAIDAFIJ-CQSZACIVSA-N 314.429 5.162 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340430927 AIKZQFRWVDZYON-FCHUYYIVSA-N 318.464 5.397 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1cccc(C#N)c1)CC2 427854779 BNHXDXNWTOECBD-QVKFZJNVSA-N 304.437 5.020 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@H](C)c1ccc(C#N)cc1 463919872 NRNJRMNDBSBLHK-MRXNPFEDSA-N 324.493 5.681 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC[C@@H]1CC 477000684 JQNKJWWCVFDBOU-LPHOPBHVSA-N 313.485 5.693 30 20 DKED C=CCCCC(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 480846939 PEAHSDZEIPZEEV-INIZCTEOSA-N 309.409 5.121 30 20 DKED C[C@@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1cccc(C#N)c1 539496862 NFGAMXWXWYRXNU-KUHUBIRLSA-N 310.416 5.135 30 20 DKED CC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C)cc1 540355493 GCDKPSZVWCCHLL-FQEVSTJZSA-N 306.453 5.037 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1F 609825725 PWZKLXZNAGNWBA-NEPJUHHUSA-N 303.377 5.392 30 20 DKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1cccs1 737405233 HBHRGYVZRZWSOZ-LLVKDONJSA-N 323.870 5.298 30 20 DKED COc1cccc2cc(C(=O)/C=C\c3cc4ccccc4o3)oc12 750901346 DUORBBQSLCEUFN-KTKRTIGZSA-N 318.328 5.084 30 20 DKED C=CCC[C@H](N[C@H]1CCc2ccc(Cl)nc21)c1ccccc1 788673807 YHGLOMYPOIAHTQ-IRXDYDNUSA-N 312.844 5.019 30 20 DKED C[C@@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1 195614542 AAGPACDQCUUSMF-KUHUBIRLSA-N 310.416 5.135 30 20 DKED C=CC[C@H](CC)NC(=O)Nc1c(C(C)C)cccc1C(C)C 466409387 XEXDGKJBZYSKJP-HNNXBMFYSA-N 302.462 5.410 30 20 DKED C[C@@H](Nc1ccc(CC#N)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474937500 VOAAOSJVHZBMFQ-BYCMXARLSA-N 316.857 5.072 30 20 DKED C=CCC[C@@H](NCc1cc(Cl)sc1Cl)c1ccco1 513690998 PNKFAQUBYVJOLW-LLVKDONJSA-N 316.253 5.445 30 20 DKED N#C[C@H](Sc1nc2cc(Cl)ccc2o1)C1CCCCC1 524532473 WAUKBMLNZYRVBR-AWEZNQCLSA-N 306.818 5.046 30 20 DKED CC(C)(CCC#N)CNCc1ccc(-c2ccc(Cl)cc2)o1 553513504 WPWRZTDRSZFRQL-UHFFFAOYSA-N 316.832 5.020 30 20 DKED CC(C)c1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 578562906 CWEFZKUSIAARCS-LAUBAEHRSA-N 306.453 5.506 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(Cl)nc2)cc1 748997119 FPGVLYFGXUWZIQ-OQFOIZHKSA-N 317.841 5.132 30 20 DKED O=C1/C(=C/c2cnc(C3CCC3)s2)[C@@H]2CCCc3cccc1c32 763288662 IPPCUHTWRHTZMV-ADFUCPMPSA-N 321.445 5.110 30 20 DKED C=CCC[C@@H](NCc1cccc(C(F)(F)F)c1)c1ccco1 514105307 QKLIJKGSEOUCGW-OAHLLOKOSA-N 309.331 5.096 30 20 DKED C=C[C@@H](CC(=O)N(C1CC1)[C@@H](C)c1ccccc1)c1ccccc1 559681235 LJEMHHGFMSQCRO-ROUUACIJSA-N 319.448 5.099 30 20 DKED Cc1ccccc1C(=O)/C=C\c1cnc(-c2cccs2)s1 751513107 NURIHCCXDFYURI-HJWRWDBZSA-N 311.431 5.076 30 20 DKED CC(C)(C)Nc1ccccc1NCc1ccc(C(C)(C)C#N)cc1 766134296 YXUBUVGRLOZGDS-UHFFFAOYSA-N 321.468 5.310 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)ccc1C 189868416 KDGMPSUFRKIXKB-UHFFFAOYSA-N 307.437 5.408 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)CC(F)(F)F 457748871 NLAJZABZQINPCH-GFCCVEGCSA-N 313.363 5.066 30 20 DKED C=C(C)[C@@H](NCc1ccc(SC)cc1)c1ccc(F)c(F)c1 479399345 VNQJAXFSUFHDKP-GOSISDBHSA-N 319.420 5.094 30 20 DKED C=CCC[C@@H](NCc1ccc(-c2cccnc2)cc1)c1ccco1 560528769 QXOYYKYPZCFCQR-HXUWFJFHSA-N 318.420 5.139 30 20 DKED CC(C)(CCC#N)CN[C@@H](Cc1ccccc1F)c1ccccc1 574185273 RTQFXLBPPSCAFW-FQEVSTJZSA-N 324.443 5.029 30 20 DKED C[C@@H](CCN[C@H](CCCC#N)c1ccccc1)c1ccccc1 574791032 HXRYSFKADPOHCT-GHTZIAJQSA-N 306.453 5.205 30 20 DKED C[C@@H](c1ccccc1)N(C(=O)CCCCCC#N)c1ccccc1 588890370 HUNYQCZRGBVQCQ-SFHVURJKSA-N 320.436 5.255 30 20 DKED CCCCCCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1 742964429 AKOXXHHGGRXUNK-DOTOQJQBSA-N 305.462 5.248 30 20 DKED C=CC[C@H](N[C@H]1C[C@H](C(C)C)c2ccccc21)c1ccncc1 774185413 BOQJGSIOXFLXCI-HKBOAZHASA-N 306.453 5.173 30 20 DKED C[C@H](N[C@H](C)c1csc2ccccc12)c1cccc(C#N)c1 776154882 CKHWFVCRXHYZTC-UONOGXRCSA-N 306.434 5.185 30 20 DKED O=C(/C=C/c1ccc(-c2ccccc2F)o1)c1ccccc1F 917030875 LCDIXHDUEHWAHK-PKNBQFBNSA-N 310.299 5.121 30 20 DKED CC[C@@H](C)c1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1 1776698208 IJIPXTNPQUKLHA-ICDLMJIXSA-N 322.404 5.103 30 20 DKED N#Cc1c[nH]c2nc(Cl)cc(-c3ccc(Cl)cc3Cl)c12 43193968 AKLPIRULQXYNJS-UHFFFAOYSA-N 322.582 5.062 30 20 DKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(-c2cccs2)cc1 453291638 MMCLFXURNDPIIZ-VKJFTORMSA-N 310.466 5.148 30 20 DKED CC(C)(CCC#N)CNCC1(c2ccc(Cl)cc2)CCCC1 462360903 RFCVFEGLMALSJS-UHFFFAOYSA-N 318.892 5.071 30 20 DKED COc1ccc(C#N)cc1N[C@@H](C)c1ccc(Cl)c(Cl)c1 493838108 XFHMVPHGCMFFMY-JTQLQIEISA-N 321.207 5.047 30 20 DKED CC[C@H](C)Sc1ccc(N[C@@H](C#N)Cc2ccccc2)c(C)c1 604526570 OCLLPYUUJKGRPD-FUHWJXTLSA-N 324.493 5.432 30 20 DKED C#Cc1cccc(NC(=S)N(C)CCCCCCCCC)c1 726474961 MWRQOPYBADBGQB-UHFFFAOYSA-N 316.514 5.047 30 20 DKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nc(C(C)C)cs1 747197639 LBHNWSLYHDRYKP-KBPBESRZSA-N 306.475 5.049 30 20 DKED N#Cc1csc(/C=C2/CCc3c(sc4ccccc34)C2=O)c1 763099851 GCAHTRHAPUBBJO-WQLSENKSSA-N 321.426 5.047 30 20 DKED N#CC1(CCCCOc2ccccc2-c2nccs2)CCC1 902727082 NFJIFJKVGIFAKL-UHFFFAOYSA-N 312.438 5.053 30 20 DKED CCCCCCCC(=O)O[C@@H](c1ccccc1)c1ccccn1 912909200 JBDPBBSDCQAUQV-FQEVSTJZSA-N 311.425 5.075 30 20 DKED CC(CCCCCCC(=O)O)=NNc1ccc(C(C)C)cc1 1776060443 VQWSARCCJLOKSQ-UHFFFAOYSA-N 304.434 5.023 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1c(C)cccc1C(C)C 43281456 MDSQRKBIKFHQSJ-UHFFFAOYSA-N 322.452 5.339 30 20 DKED Cc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1 206843132 VVZWIAGFEQNBJE-QXMHVHEDSA-N 305.402 5.015 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1Cl)c1ccccc1Cl 433172087 BZQRMULTOHDQMQ-NWDGAFQWSA-N 319.235 5.277 30 20 DKED CC[C@@H](N[C@H](CC)c1ccc(F)cc1F)c1ccc(C#N)cc1 447542409 OZXIYKCXSWHZML-RTBURBONSA-N 314.379 5.028 30 20 DKED C=CC[C@H]1N(C(=O)Nc2ccsc2Cl)CCCC1(C)C 445160182 SITJDLKJZPITRV-GFCCVEGCSA-N 312.866 5.000 30 20 DKED CC[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 447525572 ARAIATSKDGGPDP-RDTXWAMCSA-N 320.461 5.575 30 20 DKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 735395739 AXAFSJQVDWMECL-UONOGXRCSA-N 314.454 5.079 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2cccc3ccccc23)s1 736430685 DUWORAKBCRDKHQ-QXMHVHEDSA-N 321.445 5.490 30 20 DKED COc1c(Cl)cc(N[C@@H](C)c2cccc(C#N)c2)cc1Cl 777669462 AQISFEJYDTUNHZ-JTQLQIEISA-N 321.207 5.047 30 20 DKED C=CCCC[C@H](c1ccccc1)c1nc(CCC(F)(F)F)no1 904865342 ANUJCSCDOGCPFC-CQSZACIVSA-N 324.346 5.053 30 20 DKED N#CCCSc1ccccc1NCc1cc(F)ccc1Cl 187282245 PITIWOPZDPMJKR-UHFFFAOYSA-N 320.820 5.097 30 20 DKED CCC[C@@H](NCc1ccc(C#N)o1)c1ccc(Cl)c(Cl)c1 540600930 DUGTVNGJHDIYCY-MRXNPFEDSA-N 323.223 5.089 30 20 DKED C[C@@H](N[C@@H](C#N)c1ccc(Cl)cc1)c1c(F)cccc1Cl 585719312 NULGHPLVZIZSDR-BMIGLBTASA-N 323.198 5.048 30 20 DKED CC(C)(C)[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1 589340644 NHWLVSNKKLLTKL-WOJBJXKFSA-N 322.427 5.062 30 20 DKED C#Cc1cccc(NC(=O)N(CCC)[C@@H](CC)c2ccccc2)c1 746658098 BBUMCPQRHASUSW-FQEVSTJZSA-N 320.436 5.063 30 20 DKED C=CCCCCC[C@H](C)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 793556289 WPUNMWSCXMUIJH-VDGAXYAQSA-N 319.464 5.160 30 20 DKED C=CCC(F)(F)c1nc(-c2ccc(-c3ccccc3)cc2)no1 904551728 XUUMEUGXFRNVRF-UHFFFAOYSA-N 312.319 5.072 30 20 DKED CCCOc1ccc(Cl)cc1N[C@H](C)c1cccc(C#N)c1 315618452 SAILVUGUVHWBSR-CYBMUJFWSA-N 314.816 5.174 30 20 DKED CC[C@@H](N[C@@H](c1ccc(F)c(C)c1)C1CC1)c1ccc(C#N)cc1 447583584 CACWCXIOGOZNNK-NHCUHLMSSA-N 322.427 5.198 30 20 DKED CC(C)C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1 512625760 QHGOMBIYZHDBSD-YWZLYKJASA-N 310.416 5.135 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(CCCC)cc1)c1ccncc1 766018061 FRDBZSGMHCWNQI-UTKZUKDTSA-N 308.469 5.392 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1ccncc1 766018855 JIFVFHKQTGSOQD-VQIMIIECSA-N 318.420 5.310 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC[C@H](F)C1 424784576 ABQSWJJUFAFQLZ-CVEARBPZSA-N 303.421 5.005 30 20 DKED CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 531950922 DSNZCFCBASUJBX-HOTGVXAUSA-N 324.493 5.471 30 20 DKED C[C@H](N[C@H](C)c1ccc(C(F)(F)F)s1)c1ccc(C#N)cc1 902766428 KIRAHFKFFYKGQY-WDEREUQCSA-N 324.371 5.050 30 20 DKED C=C1CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)CC1 929141136 LEWMPPVMSLVDHZ-UHFFFAOYSA-N 300.446 5.117 30 20 DKED CC[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1 447528945 IXSSLGFVBGGQAK-SFTDATJTSA-N 322.427 5.279 30 20 DKED C[C@@H](Nc1cccc(OC2CCCC2)c1)c1ccc(C#N)cc1 540839983 SLWMWSAGIYDQPD-OAHLLOKOSA-N 306.409 5.053 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCC2 556198227 QVTBIRZTWNDNCJ-MAUKXSAKSA-N 324.493 5.323 30 20 DKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1c(C)cccc1C(C)C 768224536 QUCXHQAKFZESND-QGZVFWFLSA-N 318.461 5.028 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 237575562 PWIICXFDXCLFPG-KRWDZBQOSA-N 312.416 5.076 30 20 DKED C=CCC[C@@H](NCc1cccc(SCC)c1)c1ccco1 426348748 BXGSNICFLKRDLT-QGZVFWFLSA-N 301.455 5.189 30 20 DKED CCC(CC)n1ccc(CS[C@@H](C)c2cccc(C#N)c2)n1 443130541 JBYJHNLFRFEFDK-AWEZNQCLSA-N 313.470 5.110 30 20 DKED CC(C)(C#N)CCCCN1CCCC[C@@H]1c1ccc(F)cc1 444648088 MOJBRISFODRBSK-GOSISDBHSA-N 302.437 5.073 30 20 DKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)CCCCC(C)(C)C#N 444674678 KXSVVVGQLVSLHO-OAHLLOKOSA-N 321.534 5.288 30 20 DKED C=C(C)[C@@H](N[C@@H](C)CCCC(F)(F)F)c1ccc(F)c(F)c1 480669018 NXADLOAJXOAQQM-XHDPSFHLSA-N 321.333 5.293 30 20 DKED Cc1cc(C)c(CNc2ccccc2SC[C@H](C)C#N)c(C)c1 520826380 QMOGDWBCGRQRML-OAHLLOKOSA-N 324.493 5.476 30 20 DKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cc2ccccc2s1 568936762 WRJYOHZFYRHISA-SCLBCKFNSA-N 318.445 5.111 30 20 DKED C=CCN(C(=O)Nc1ccc(SC(C)(C)C)cc1C)C(C)C 726080153 LQJMTXLPGWTVST-UHFFFAOYSA-N 320.502 5.314 30 20 DKED CCCCCCCCC(=O)Nc1ccc(F)cc1C(F)(F)F 728006841 SBMOJQDSKZDNKN-UHFFFAOYSA-N 319.342 5.534 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(F)cc1 170991782 OFEFNUXCKXYOGS-KBPBESRZSA-N 314.429 5.251 30 20 DKED C[C@H](Nc1cccc(Oc2ccccc2)c1)c1ccc(C#N)cc1 324370797 JMISMXVCGWUZRR-INIZCTEOSA-N 314.388 5.524 30 20 DKED Cc1ccc(C)c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 581622061 RRGJIBNLWVUBBT-RXVVDRJESA-N 306.453 5.389 30 20 DKED Clc1oc2ccccc2c1C=NNc1cccc2cnccc12 761259575 WCTDHLHXYHRSAN-UHFFFAOYSA-N 321.767 5.080 30 20 DKED Cc1c(C(=O)/C=C/c2ccc3cnccc3c2)oc2ccccc12 782315436 VYVZFGHUYLPHIR-VQHVLOKHSA-N 313.356 5.186 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2ccccc2c1 915303867 CKFRNBKLRZCBFI-UHFFFAOYSA-N 322.433 5.121 30 20 DKED N#CCCC[C@H](N[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 340453003 QDUGJGPGSUQIMU-ULQDDVLXSA-N 324.390 5.132 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1ccc(C#N)cc1F)CC2 427865331 NIQSNPDOJKUSPX-SPLOXXLWSA-N 322.427 5.159 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C)c1O 436988957 KZCIIEOFJJWCIO-UHFFFAOYSA-N 323.436 5.113 30 20 DKED CCc1ccccc1CNc1ccccc1S[C@@H](C)CC#N 438291923 CRYZMRQTLIOQLZ-HNNXBMFYSA-N 310.466 5.255 30 20 DKED CC[C@H](C)[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462759492 CRJGTIFLWLEIRJ-IFXJQAMLSA-N 312.844 5.089 30 20 DKED C[C@@H](SCc1cc(-c2ccccc2)no1)c1ccc(C#N)cc1 609825298 PRDXQURRWQNZMI-CQSZACIVSA-N 320.417 5.208 30 20 DKED Cc1nc(SCCC(C)(C)C#N)n(C2CCCCC2)c1C 610166887 VZFXDRCTZKQWCL-UHFFFAOYSA-N 305.491 5.037 30 20 DKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccsc3)cs2)cc1 749105547 UVBQDKYJVZYHOF-VOTSOKGWSA-N 311.431 5.076 30 20 DKED CC(=O)c1ccc2ccccc2c1N[C@H](C)c1cccc(C#N)c1 864033962 PDLUPGMWEZOTAG-CQSZACIVSA-N 314.388 5.087 30 20 DKED CC(C)Oc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665037 YUHKEQQMBFXXLR-DYESRHJHSA-N 322.452 5.169 30 20 DKED C=CC1CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)CC1 111701515 JCVCWZRYJAJFGO-UHFFFAOYSA-N 314.473 5.363 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@H](CCCC#N)c1ccccc1)CC2 340451835 PDRRLQXBDJUIHP-NHCUHLMSSA-N 304.437 5.007 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1cccc(CSC(C)C)c1C 466425176 JCJDAXFBIBNHOL-AWEZNQCLSA-N 305.487 5.177 30 20 DKED C=CCC(C)(C)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 507320971 WAXOPPDFGWWZPG-UHFFFAOYSA-N 313.363 5.067 30 20 DKED C=CCC[C@@H](NCc1ccc2[nH]c(C)c(C)c2c1)c1ccco1 552047548 QFZMPOSDFHRJDZ-LJQANCHMSA-N 308.425 5.175 30 20 DKED CC(C)Sc1ccc([C@@H](C)NCC(C)(C)CCC#N)cc1 554364350 AGMFTBQBJJCBPK-OAHLLOKOSA-N 304.503 5.168 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](C)c1cccc(Cl)c1Cl 614407425 QJZGEVBMSCCUMX-GFCCVEGCSA-N 319.235 5.024 30 20 DKED O=C(/C=C/c1ccccc1F)c1cc(Cl)sc1Cl 744868999 QAGCNIVDCZKLBU-AATRIKPKSA-N 301.169 5.090 30 20 DKED Cc1c(C(=O)/C=C\c2cnc(C(C)C)s2)oc2ccccc12 758431215 VZFDRDSAMGOBDK-HJWRWDBZSA-N 311.406 5.217 30 20 DKED CC/C(C)=C(\C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 779836732 FVOOZBFBNIORKG-APHAIJBRSA-N 318.420 5.027 30 20 DKED O=C(/C=C/c1csc2ccccc12)c1cc(F)ccc1F 810231562 FVARYIMNDRTBNB-VMPITWQZSA-N 300.329 5.076 30 20 DKED N#CCCC[C@H](NCc1ccc(F)c(Cl)c1)c1ccccc1 353917919 VZSXZMMLCIBJJR-SFHVURJKSA-N 316.807 5.004 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(-c2ccc(C)o2)ccc1C 432991858 LSTDLQBFEQJTLN-QGZVFWFLSA-N 324.424 5.136 30 20 DKED C=C(C)[C@@H](N[C@H]1CCCc2sccc21)c1ccc(F)c(F)c1 480683859 SDWCUDWFSZIYPC-FUHWJXTLSA-N 319.420 5.311 30 20 DKED CCSc1ccc(Cl)cc1N[C@H](C)c1ccc(C#N)cc1 522842467 XUZIQTXGMKYTKZ-GFCCVEGCSA-N 316.857 5.497 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1ncc(C(C)(C)C)o1 532856311 QFFAGRFSMYOCTG-SNVBAGLBSA-N 320.845 5.350 30 20 DKED C=CCC[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccco1 552274875 DUFAYDDACBABOV-OAHLLOKOSA-N 308.381 5.418 30 20 DKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cccc2ccccc12 560260932 FBFQHVZNFFTVDK-MRXNPFEDSA-N 312.416 5.051 30 20 DKED N#C[C@H](Cc1ccccc1)Sc1cc(Cl)ccc1Cl 603452837 NJKMKABGLINCAE-ZDUSSCGKSA-N 308.233 5.220 30 20 DKED C[C@H](C#N)Oc1ccccc1NC1CCC(c2ccccc2)CC1 780746591 OYDHEYATJAMFGQ-IPJUCJBFSA-N 320.436 5.116 30 20 DKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 175982646 DIINXWHQPSUYLZ-CYBMUJFWSA-N 306.475 5.049 30 20 DKED C=CCC[C@@H](NCc1cnc(-c2ccco2)s1)c1ccccc1 193173409 UWFYYFAWRQUJDJ-QGZVFWFLSA-N 324.449 5.200 30 20 DKED Cc1ccc(OC(F)F)c(CSCCCC(C)(C)C#N)c1 427662110 HNUVXNQSOCUONA-UHFFFAOYSA-N 313.413 5.160 30 20 DKED CC(C)Sc1ccc([C@H](C)NCC2CCC(C#N)CC2)cc1 442848671 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30 20 DKED C=CCC[C@@H](NCc1ccc(C(C)C)nc1C)c1ccccc1 559147610 AMWQVVUFFAPCHE-OAQYLSRUSA-N 308.469 5.311 30 20 DKED CC[C@@H](CC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 609427790 LRGQCFLMCKDSOC-GJZGRUSLSA-N 318.486 5.092 30 20 DKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc2ccccc2c1 782303359 XBJGEJMAVUSLAL-UXBLZVDNSA-N 309.368 5.284 30 20 DKED Cc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(O)c1C 815635338 ATXJFENZLHLXPD-FXAWDEMLSA-N 322.452 5.095 30 20 DKED C[C@@H](Nc1ccc(OC(C)(C)C)c(C#N)c1)c1ccccc1F 864017831 BJVABPRTPANZQY-CYBMUJFWSA-N 312.388 5.048 30 20 DKED CC(C)(C#N)CCCCSCc1noc(C2CCCCC2)n1 435885159 GGTKRDIDXQCUMF-UHFFFAOYSA-N 321.490 5.071 30 20 DKED CC(C)(C#N)CCCCN(Cc1ccoc1)C1CCCCC1 444655836 YLWBGDHHQJRLSD-UHFFFAOYSA-N 302.462 5.134 30 20 DKED CCC(C)(C)OCc1cccc(NCc2cccc(C#N)c2)c1C 530686510 ADFNYNRAQTVDME-UHFFFAOYSA-N 322.452 5.184 30 20 DKED C[C@@H](SCc1cccc2cccnc12)c1ccc(C#N)cc1 609825615 IVHXQIICEJZZHR-CQSZACIVSA-N 304.418 5.101 30 20 DKED Cc1c([C@@H](C)OC(=O)CCCCCC#N)sc2ccccc12 805918657 APRNMTBJYUASIB-CQSZACIVSA-N 315.438 5.288 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1Cl 192358763 RCQGZZVCCJQQCB-UHFFFAOYSA-N 303.789 5.037 30 20 DKED CC[C@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(C#N)cc1 447579919 MKZMRVXPSCCVLJ-KRWDZBQOSA-N 318.342 5.226 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccc(C(C)(F)F)cc1 512777890 ANEIENVVDHYFAW-UHFFFAOYSA-N 315.363 5.169 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](c1ccccc1Cl)C(C)C 614407500 SLAPMQSBUDNVMF-LJQANCHMSA-N 312.844 5.007 30 20 DKED Cc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)s1 727264051 MUUCQCJMWHXLRZ-HJWRWDBZSA-N 311.431 5.076 30 20 DKED N#Cc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cc1 747188034 GEAYNJFVCMRPSS-ZHACJKMWSA-N 315.397 5.183 30 20 DKED C[C@@H](Nc1ccc(C2CCC2)cc1)c1ccc(OCC#N)cc1 786970195 OTSOXRAOGKZMLY-OAHLLOKOSA-N 306.409 5.030 30 20 DKED Cc1ccc2c(C)cc(NN=C3CCC(C)(C#N)CC3)nc2c1C 834935470 MZYWMAQRVQCNSE-UHFFFAOYSA-N 320.440 5.032 30 20 DKED CC[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1Cl 37748833 HWXJUURWRQULFI-KRWDZBQOSA-N 319.235 5.106 30 20 DKED C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 537296919 YAIBBZFGQLEHRC-IFXJQAMLSA-N 310.416 5.135 30 20 DKED CC(C)COc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 610829782 KTFLLMBBRNKARX-IAGOWNOFSA-N 322.452 5.005 30 20 DKED C=CCC[C@H](NCc1ccc2cnccc2c1)c1ccccc1 683773753 RXYNJDZOASUESA-NRFANRHFSA-N 302.421 5.032 30 20 DKED O=C(/C=C/c1nccc2ccccc12)c1ccc2ccccc2c1 740764165 MZKSOUDVJFFEHQ-VAWYXSNFSA-N 309.368 5.284 30 20 DKED C#CCCCCCC(=O)Nc1ccccc1Oc1ccccc1 779715262 JXFVRUYORZWYGG-UHFFFAOYSA-N 307.393 5.001 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1ccc(Cl)c(Cl)c1 782301861 NHRXUBQMCRBUGK-AATRIKPKSA-N 324.232 5.223 30 20 DKED C[C@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571914 XCHQMEFUHXXITE-OLZOCXBDSA-N 320.502 5.079 30 20 DKED COc1cccc2cc(C(=O)/C=C\c3ccc(Cl)s3)oc12 834766304 SOPFKGDMNBTIBX-ALCCZGGFSA-N 318.781 5.052 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)s1 902827759 OOPUZLRDVREHIM-MNOVXSKESA-N 324.371 5.050 30 20 DKED Cc1nc(-c2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 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C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1C(C)C 62372762 URFYBQZGWBQCID-UHFFFAOYSA-N 322.452 5.073 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(C)ccc1OC 90665148 WDESSFVDQZWPRJ-UXHICEINSA-N 322.452 5.089 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1CC 189872655 ZYRLJEJNDDPIFE-UHFFFAOYSA-N 307.437 5.353 30 20 DKED Cc1cc(Cl)cc(C)c1CN[C@H](CCC#N)c1ccccc1 344833563 XJRMNNVMRQCNTR-LJQANCHMSA-N 312.844 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CC1CCC1 432584862 QEIBULTVPCDFJV-UHFFFAOYSA-N 314.473 5.192 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccc(CC)o1)c1ccc(F)c(F)c1 480691476 BVKLICGZAMZAIZ-KZULUSFZSA-N 305.368 5.088 30 20 DKED COc1cc(C)ccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 556202712 RONHNNWEQGWZCW-YLJYHZDGSA-N 322.452 5.089 30 20 DKED CCCCCCCCCC[C@H](C)Nc1ncc(C(=O)O)s1 1776785219 IKTMOIXWQNYGCD-ZDUSSCGKSA-N 312.479 5.173 30 20 DKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 175982659 DIINXWHQPSUYLZ-ZDUSSCGKSA-N 306.475 5.049 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)cc(F)c1 340444223 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N#C[C@@H]1CC[C@H](Nc2cccc(CSCc3ccccc3)c2)C1 442852764 IHEYTWKPMIHZQK-XLIONFOSSA-N 322.477 5.224 30 20 DKED Cc1nc(-c2cccc(NC3CCC(C)(C#N)CC3)c2)cs1 453179982 QJOKJJGVOVEVBK-UHFFFAOYSA-N 311.454 5.003 30 20 DKED C=CCCCC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 479543785 OWQFSRPUVNYKKX-MRXNPFEDSA-N 308.425 5.155 30 20 DKED N#CCCCCN[C@@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 531960760 JFVGBEBZUXAKDD-IAGOWNOFSA-N 324.390 5.015 30 20 DKED CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc(CC#N)cc2)cc1 609973504 TYEYSMDTALUSJA-INIZCTEOSA-N 320.436 5.008 30 20 DKED Cc1cc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)c(C)s1 614180134 YRNSWICEUAUTSP-CQSZACIVSA-N 312.482 5.017 30 20 DKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1cc2ccccc2o1 779358614 SNKORYNJADJBAS-ALCCZGGFSA-N 318.159 5.031 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1O 815636137 PRVRQCGWXYIOCT-VQTJNVASSA-N 322.452 5.177 30 20 DKED C[C@H](Sc1ccc(Br)cc1)c1ccc(C#N)cc1 303726653 TXCYWPCPJHITSJ-NSHDSACASA-N 318.239 5.174 30 20 DKED CC[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccc(C#N)cc1 447576311 XUNBCJDBMRJMRW-QGZVFWFLSA-N 317.392 5.140 30 20 DKED CC(C)(C)c1ccc(CN[C@@H](CCC#N)c2ccccc2)cc1 533496308 HGIWKZQADNWORN-FQEVSTJZSA-N 306.453 5.119 30 20 DKED CC[C@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1 554367011 QNYPMUSFESVJFR-HNNXBMFYSA-N 313.272 5.364 30 20 DKED O=C1/C(=C\c2csc(-c3ccccc3)n2)CCc2sccc21 726890201 DSTLVQQOFXXWLX-RAXLEYEMSA-N 323.442 5.084 30 20 DKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)CCc2sccc21 727267485 VMJJKSKNLOELDQ-RAXLEYEMSA-N 323.442 5.084 30 20 DKED CCCCCCCCC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 914509167 DVKCGUGPSKEJBT-QGZVFWFLSA-N 314.473 5.218 30 20 DKED N#CCCC[C@H](NCc1cccc(F)c1Cl)c1ccccc1 339240027 YPFWPIDMECHMLX-KRWDZBQOSA-N 316.807 5.004 30 20 DKED N#CCCC[C@H](NC1CC(c2ccccc2F)C1)c1ccccc1 340448073 RBNIRONQYXWMPC-NGICGMGXSA-N 322.427 5.096 30 20 DKED N#CCCCCN[C@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 581419987 LNMZLTQZJDAUCS-MSOLQXFVSA-N 304.865 5.040 30 20 DKED CCc1nc(C)c(C(C)=NNc2cccc3ccccc23)s1 735229740 POWAPGLTQAMYRX-UHFFFAOYSA-N 309.438 5.003 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(SCC)cc1)c1ccncc1 756925686 GRUBPZQWAGTHPK-HNAYVOBHSA-N 312.482 5.162 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1cccnc1 917092652 VAHCBYUTWANGFU-LJQANCHMSA-N 316.489 5.276 30 20 DKED Cc1sc(N=C(O)c2ccc(C(C)C)s2)c(C#N)c1C 330848012 CUIZMDKUSNYKCN-UHFFFAOYSA-N 304.440 5.058 30 20 DKED CC(C)(c1ccc(NCc2ccccc2C#N)cc1)C(F)(F)F 428531980 AZRDELJGBYDFPF-UHFFFAOYSA-N 318.342 5.010 30 20 DKED C=CCCCCCNc1ccc(C)c(NC(=O)C(C)(C)C)c1 447407031 HBKNSHAMXOEACM-UHFFFAOYSA-N 302.462 5.138 30 20 DKED CC(C)[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccccc1Cl 539495252 JZMPIJZKTHSDQF-AUUYWEPGSA-N 312.844 5.260 30 20 DKED CSc1ccc2c(c1)[C@@H](N[C@H](C)c1cccc(C#N)c1)CCC2 592387616 YFNXJRRVYLEOSS-VLIAUNLRSA-N 322.477 5.008 30 20 DKED Cc1ccccc1C(=O)/C=C\c1csc(-c2cccs2)n1 728439470 LLTSXLZPAUFVRS-HJWRWDBZSA-N 311.431 5.076 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2csc(Cl)c2)s1 787186587 PIJPUXWPNDDDDZ-PLNGDYQASA-N 311.859 5.052 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C[C@@H]1CCC[C@@H](C)C1 330173551 HMBCGUIUPDELAQ-UKRRQHHQSA-N 311.429 5.190 30 20 DKED C[C@H](S[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C#N)c1 443159505 AUIWOPDHKKVXFE-STQMWFEESA-N 312.394 5.022 30 20 DKED Cc1ccc2c(c1)[C@H](Nc1cccc(OCCCC#N)c1)[C@H](C)C2 494952532 OTVFLPBPZDASCW-IIBYNOLFSA-N 320.436 5.023 30 20 DKED O=C1/C(=C/c2ccsc2)CCc2cc(SC(F)F)ccc21 750916009 JSQVYIOJWUELAW-KPKJPENVSA-N 322.401 5.275 30 20 DKED CCCCCCCC(=O)N(Cc1ccco1)Cc1cccs1 829770171 SLHGWRGLEIINOW-UHFFFAOYSA-N 319.470 5.230 30 20 DKED Cc1ccccc1C1CC(N[C@@H](CCCC#N)c2ccccc2)C1 340458546 YJCCDYZSUOQDJW-AOMIVXANSA-N 318.464 5.266 30 20 DKED C[C@H](NCCCC(C)(C)C#N)c1cc(F)c(Cl)cc1Cl 539241825 OIMCIFZNNHDYMG-JTQLQIEISA-N 317.235 5.113 30 20 DKED CC(C)(CCC#N)CN[C@@H](Cc1ccc(F)cc1)c1ccccc1 554359738 PPOWIRIRCAATNH-FQEVSTJZSA-N 324.443 5.029 30 20 DKED Cc1cc(C)c2c(c1)CC[C@H]2N[C@@H](CCCC#N)c1ccccc1 594505956 GJUODJOQGPUPEX-LEWJYISDSA-N 318.464 5.316 30 20 DKED CCCCCC[C@H](CC)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 735203182 CHFJKZNATMAATO-WMZOPIPTSA-N 322.452 5.408 30 20 DKED CC(C)c1ccc(C=NOCc2ncc(-c3ccccc3)o2)cc1 823536482 DPMZNMIAMCALKY-UHFFFAOYSA-N 320.392 5.016 30 20 DKED Cc1cc(CNc2cccc(C(F)F)c2Cl)ccc1C#N 444000218 GFKXUFCRQPEGHA-UHFFFAOYSA-N 306.743 5.070 30 20 DKED CCN(CCCC(C)(C)C#N)Cc1ccc(Cl)c(Cl)c1 472436917 JWOWFGXUBBOHHM-UHFFFAOYSA-N 313.272 5.145 30 20 DKED N#CCCC[C@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccccc1 556203099 ZXTNXIKXPFZMTI-VQTJNVASSA-N 324.855 5.352 30 20 DKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1 618806350 QTTQRGYEYYVWKO-IVZQSRNASA-N 312.416 5.050 30 20 DKED O=C(/C=C/c1ccsc1)c1ccc(SCC(F)F)cc1 741844888 WIPDAXFURNCFSI-LZCJLJQNSA-N 310.390 5.001 30 20 DKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(C#N)cc1 751253916 FWWDKMUJYXXAGK-UHFFFAOYSA-N 324.449 5.010 30 20 DKED C=CC[C@@H](N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccncc1 779406371 WKVMBHLMUSGCOQ-NHCUHLMSSA-N 322.427 5.064 30 20 DKED CCc1cnc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)s1 783700412 DCJWHVQLBJQJEU-XQRVVYSFSA-N 317.797 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccccc1F 789720307 WDRWKJKPWIRQDT-YPKPFQOOSA-N 323.411 5.330 30 20 DKED CCc1oc2ccccc2c1C=NNc1nccc2sccc12 915978857 BBWVLNKDRJYGTG-UHFFFAOYSA-N 321.405 5.051 30 20 DKED CCCCCCCCCC[C@@H](C)Nc1ccc(C(=O)O)cn1 1776785306 SDXCYNOAQZSREN-OAHLLOKOSA-N 306.450 5.111 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCCCCC(F)(F)F 151920729 XEXRAWCSFSSKQG-LBPRGKRZSA-N 316.392 5.083 30 20 DKED CCC[C@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 154329346 JGXXMIALUOWSSO-GJZGRUSLSA-N 318.486 5.092 30 20 DKED CC[C@@H](NCc1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 447520046 SAFYGGKAKDHODZ-QGZVFWFLSA-N 319.235 5.106 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 531950923 DSNZCFCBASUJBX-HZPDHXFCSA-N 324.493 5.471 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc2ccccc2n1)c1ccccc1 537946264 XHWBJDUIJGASRT-LAUBAEHRSA-N 316.448 5.593 30 20 DKED C[C@H](N[C@@H](C)c1cc2cc(Cl)ccc2o1)c1cccc(C#N)c1 611438794 SNRWHGKYZUVEMD-STQMWFEESA-N 324.811 5.370 30 20 DKED O=C(/C=C/c1cccnc1Cl)c1cc2cc(Cl)ccc2o1 728700032 KYWBTMVWYOGFBV-HWKANZROSA-N 318.159 5.031 30 20 DKED Cc1ncccc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 728785679 JMTGOMKUNOYKGE-CSKARUKUSA-N 313.356 5.186 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(CC)cc1 732624712 DKZNEKMJKFQBDC-UHFFFAOYSA-N 316.514 5.014 30 20 DKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccccc2)cc1 741465652 WYPLFVLEYMXTEQ-SSZFMOIBSA-N 314.384 5.258 30 20 DKED CCCCCCCCC[C@@H](C)CC(=O)N1CCC(C)(C#N)CC1 787510410 LOBBRJGTORKNHY-GOSISDBHSA-N 320.521 5.306 30 20 DKED C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1cccc(C#N)c1 182333089 JTOYCLDKMUCUIE-CYBMUJFWSA-N 318.342 5.226 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC12CCC2 365676833 YNLKBOVVIREUFU-UHFFFAOYSA-N 312.457 5.089 30 20 DKED N#C[C@H]1CC[C@H](Sc2ccc(Cl)c(C(F)(F)F)c2)C1 430089431 NHTYACKMCHLQRV-IUCAKERBSA-N 305.752 5.143 30 20 DKED C=CCCCSCc1csc(-c2ccc(OC)cc2)n1 522756992 PMMFKTXNQXMTNP-UHFFFAOYSA-N 305.468 5.018 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 539610628 IITVQAVILIKLBH-FOIQADDNSA-N 308.400 5.055 30 20 DKED CCCCCCCCC(=O)N(C)[C@H](C)c1sc(C)nc1C 730201926 GACXSCBPSCFRHA-CQSZACIVSA-N 310.507 5.030 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3C)o2)o1 734305884 HDUUCBYPQDCLND-YVMONPNESA-N 310.324 5.192 30 20 DKED C[C@H](CCc1ccc(F)cc1)N[C@H](CCCC#N)c1ccccc1 577271090 UYYBSGOVDNEYLC-DYESRHJHSA-N 324.443 5.172 30 20 DKED CC(C)c1nc2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2s1 600847411 CYTLTSIBYQOGPH-ZDUSSCGKSA-N 321.449 5.464 30 20 DKED C[C@H](SCc1ccccc1C#N)c1ccc(OC(F)F)cc1 604435808 ZQDSSAMSNAPPGX-LBPRGKRZSA-N 319.376 5.154 30 20 DKED CC(C)c1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619746882 PWSGEQYZMZOUMV-CQSZACIVSA-N 312.844 5.186 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)F)o1 626633514 ALOXXRVWYYGOKV-UHFFFAOYSA-N 319.351 5.321 30 20 DKED Cc1ccccc1C(=O)/C=C/c1csc(-c2cccs2)n1 728439469 LLTSXLZPAUFVRS-CMDGGOBGSA-N 311.431 5.076 30 20 DKED Cc1ccc2cc(C(=O)/C=C/c3cccc4cnccc34)oc2c1 754828138 FKPUPBAVOCKOQD-BQYQJAHWSA-N 313.356 5.186 30 20 DKED Cc1ccc(C(C)C)c(OC(=O)C[C@@H](CC#N)c2ccccc2)c1 796627974 AEGOQROVCBPKKA-GOSISDBHSA-N 321.420 5.111 30 20 DKED N#Cc1c(F)cccc1/C=C(\Cl)c1nc2ccccc2s1 811689073 VXAGXWGQXCITGJ-WQLSENKSSA-N 314.772 5.044 30 20 DKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842941908 UIRJQRYNSMDMRV-LRDDRELGSA-N 324.449 5.024 30 20 DKED C[C@H](S[C@@H](C)c1nc2ccccc2o1)c1cccc(C#N)c1 190822382 JIVWYIMWZSZLKV-STQMWFEESA-N 308.406 5.255 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCC(C)(C)C 303346950 MRPZFEKKANZBGD-AWEZNQCLSA-N 318.486 5.236 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340456196 VVTFPEZXVVODHT-AUUYWEPGSA-N 314.379 5.051 30 20 DKED CCc1ccccc1CNc1ccccc1SC[C@H](C)C#N 438324835 FZHIIOBIOYSOBI-OAHLLOKOSA-N 310.466 5.113 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)cc1 476076304 BAXNWDFSCBIKRH-UHFFFAOYSA-N 321.464 5.914 30 20 DKED CCSc1ccccc1[C@H](C)N[C@@H](C)c1cccc(C#N)c1 610830042 ZBLADQATMRSWBE-GJZGRUSLSA-N 310.466 5.082 30 20 DKED CCC[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccccn1 729149305 IPIWMDSWEVPZDP-IPZKOZABSA-N 323.223 5.054 30 20 DKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1cc2ccccc2o1 761474701 MPUODOHUUUMOLC-BQYQJAHWSA-N 323.348 5.078 30 20 DKED O=C(/C=C\c1cccc2cnccc12)c1cc2ccccc2s1 780188240 HSWBMMGSCQIQCD-HJWRWDBZSA-N 315.397 5.346 30 20 DKED N#C[C@H]1CCC[C@H](Nc2ccccc2SC2CCCC2)C1 463288677 NQANDYIXSRNJBX-GJZGRUSLSA-N 300.471 5.216 30 20 DKED Cc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1C 516199289 XLYYEUSPRWJUDT-NQIIRXRSSA-N 306.453 5.389 30 20 DKED N#CCCCCCC(=O)Nc1ccccc1Sc1ccccc1 588834463 BNOSNCOWHDEEAJ-UHFFFAOYSA-N 324.449 5.250 30 20 DKED C=CC1CCN(C(=O)Nc2ccc(SC(C)(C)C)cc2)CC1 732432181 NTPIRDKCXDURLY-UHFFFAOYSA-N 318.486 5.007 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccc(C)c(C)c1 799899873 DGAMZDBMFSJUET-UHFFFAOYSA-N 310.466 5.231 30 20 DKED CCCCCCCC[C@@H](O)CCCCCCCCC(=O)OC 85885640 ZWOMTUQOMSFPSL-GOSISDBHSA-N 314.510 5.392 30 20 DKED N#CCCC[C@H](NCCCCc1ccccc1)c1ccccc1 433019195 MAMIWRCEKWOWHE-NRFANRHFSA-N 306.453 5.034 30 20 DKED CC[C@H](N[C@H](c1ccccc1)C1CCC1)c1ccc(C#N)cc1 447531394 PTKQGFWOVSUZRY-LEWJYISDSA-N 304.437 5.140 30 20 DKED Cc1cc(C)cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 556197543 JTNUPBABADYTNA-RXVVDRJESA-N 306.453 5.389 30 20 DKED CC[C@H](NCC(C)(C)CCC#N)c1ccc2cc(OC)ccc2c1 580360959 GZWMLWFYAHIQTI-FQEVSTJZSA-N 324.468 5.219 30 20 DKED N#CCCCCN(Cc1cccc2ccccc12)C1CCCC1 609075639 LVZHWSDGKAEECH-UHFFFAOYSA-N 306.453 5.278 30 20 DKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1nc2ccccc2s1 735395737 AXAFSJQVDWMECL-KBPBESRZSA-N 314.454 5.079 30 20 DKED Clc1scc(C=NNc2cccc3cnccc23)c1Cl 761808221 OKHINNQSELICMI-UHFFFAOYSA-N 322.220 5.049 30 20 DKED CC(C)c1nc2cc(N[C@@H](C)c3ccc(C#N)c(F)c3)ccc2o1 776844567 NZCHWUYSQTWKPT-LBPRGKRZSA-N 323.371 5.135 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CC)cc1 189897977 PPFSDIAFQGOHLU-UHFFFAOYSA-N 307.437 5.353 30 20 DKED C=CCC[C@H](NCc1ccc2nc(C)ccc2c1)c1ccccc1 437773774 JZKHPLFSPITMBB-NRFANRHFSA-N 316.448 5.340 30 20 DKED C[C@H]1C[C@H]1c1ccc(CN(CCCCC(C)(C)C#N)C2CC2)o1 444597691 ODCLDEIVJNATQC-MAUKXSAKSA-N 314.473 5.087 30 20 DKED CCc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)s1 551204875 GNHJQZUVAASPMX-QAPCUYQASA-N 312.482 5.396 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1cccs1 588574405 QQEDVWOVTALOOR-QXMHVHEDSA-N 311.450 5.252 30 20 DKED C[C@H](Nc1ccccc1N(C)C1CCCC1)c1cccc(C#N)c1 611483224 MRPUGJYHYSIYOI-INIZCTEOSA-N 319.452 5.110 30 20 DKED CCSc1ccc([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618803852 IXGYXCAGWTUHBP-VBKZILBWSA-N 322.477 5.008 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccc(C)c(C)c1Cl 410353170 LWWNFQPICMNACB-UHFFFAOYSA-N 313.828 5.328 30 20 DKED N#Cc1ccc(SCc2sc3ccccc3c2Cl)nc1 498163931 BZSRSTGCYMYPEY-UHFFFAOYSA-N 316.838 5.114 30 20 DKED CCCC[C@@H](CC)CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 609754460 YUWUGXDLZLMKTE-IAGOWNOFSA-N 314.473 5.074 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1cccc(Cl)c1 732625356 NAWSNXMFIOAUAT-UHFFFAOYSA-N 322.905 5.105 30 20 DKED CC[C@H]1C[C@@H](C=NN(c2ccccc2)c2ccccc2)CCO1 779751037 AYDADCTVTGJHEY-PXNSSMCTSA-N 308.425 5.016 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C\c1cnc(-c3ccco3)s1)C2=O 789149533 ZJHRBFWSSZPONE-KMHUVPDISA-N 321.401 5.095 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340456199 VVTFPEZXVVODHT-LIRRHRJNSA-N 314.379 5.051 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)CC2 427870574 VMMLVCBLWAGRPG-QKKBWIMNSA-N 322.427 5.159 30 20 DKED CN(CCCCC(C)(C)C#N)Cc1csc2ccccc12 444592548 FFQOUEPXKZPUOM-UHFFFAOYSA-N 300.471 5.053 30 20 DKED CCC[C@H](Nc1ncccc1C#N)c1ccc(Cl)c(Cl)c1 462870184 YZWIVRXOWJNTBR-HNNXBMFYSA-N 320.223 5.213 30 20 DKED Cc1c(COC(C)(C)C)cccc1N[C@H](C)c1ccc(C#N)cc1 531336788 SAKYFGAJSGZDRE-MRXNPFEDSA-N 322.452 5.355 30 20 DKED C=C[C@@H](CC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 535406842 MQBQLCGHFYQWHF-KRWDZBQOSA-N 307.437 5.417 30 20 DKED CC[C@H](C)CCCCC(=O)Nc1ccccc1SCCC#N 612041944 IZPQLFZDUVIGJR-HNNXBMFYSA-N 318.486 5.237 30 20 DKED CC[C@@H](Nc1cccc(N2CCCCC2)c1)c1ccc(C#N)cc1 774283465 LTCVYMKTCWQZIF-OAQYLSRUSA-N 319.452 5.112 30 20 DKED C=CC[C@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1ccncc1 795795035 LHHHPTYYMBAFFV-VQTJNVASSA-N 306.453 5.101 30 20 DKED N#CCCCOc1cccc(/C=C/c2ccc3ccccc3n2)c1 110424263 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CC(/C=C\c1ccncc1C#N)=C/c1cccc(C(F)(F)F)c1 486144529 GDXOZTFSKMBLDR-TWEXEISSSA-N 314.310 5.089 30 20 DKED CO[C@H](CSCCCC(C)(C)C#N)c1ccc(Cl)cc1 509130999 DHIUFZYOZGWSLG-OAHLLOKOSA-N 311.878 5.091 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 560907967 DCKAVGMAQGIMPW-SCLBCKFNSA-N 316.807 5.175 30 20 DKED CC[C@@H](Cc1cccs1)N[C@H](CCCC#N)c1ccccc1 590257333 LDRIZCQYRVVCDF-PKOBYXMFSA-N 312.482 5.094 30 20 DKED CC(C)n1cc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cn1 732713657 JUVBHMJMYMZMBE-JYRVWZFOSA-N 316.404 5.027 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 736954066 KUMMGNIPVCJQIB-UHFFFAOYSA-N 322.412 5.532 30 20 DKED CCCC(=CC(=O)N[C@@H](CCCC#N)c1ccccc1)CCC 817312404 CIDJNVFRHDFMAC-IBGZPJMESA-N 312.457 5.064 30 20 DKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1F 181082259 YEWBZIWERAGRHR-IBGZPJMESA-N 312.388 5.071 30 20 DKED CC(C)(C#N)CCCSCCOc1cccc2ccccc12 480364325 MKARNPBCBOLQBF-UHFFFAOYSA-N 313.466 5.282 30 20 DKED Cc1ccc(CCCNc2ccccc2SCCC#N)cc1 544100803 LYFKZSIAUJWITI-UHFFFAOYSA-N 310.466 5.046 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)CCCC2CCCCC2)n1 747195807 ACNJARJXCFTGRA-HNNXBMFYSA-N 318.486 5.193 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1ccc2ccccc2c1 782301358 LKJHYTSZQJHSEF-MDZDMXLPSA-N 305.402 5.070 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 784877378 AVACIAWSMNKEOH-ZIAGYGMSSA-N 306.475 5.049 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC[C@H]1C 191462116 LKCOWRHUZPPTQA-HZPDHXFCSA-N 314.473 5.191 30 20 DKED C[C@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(OCC#N)cc1 192990072 JHCJTMOCMVXJHM-OXJNMPFZSA-N 322.452 5.027 30 20 DKED CC[C@@H](N[C@H](c1ccccc1C)C1CC1)c1ccc(C#N)cc1 447526555 CXBNMMIZFPNZEV-RTWAWAEBSA-N 304.437 5.059 30 20 DKED CC[C@H](Nc1ccc(C)c(-c2ncco2)c1)c1ccc(C#N)cc1 447596474 CLLCPSYRPCFRQS-IBGZPJMESA-N 317.392 5.085 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(/C=C/C)cc1 497329435 PKEHAFFMYKTYPC-ZZXKWVIFSA-N 312.438 5.001 30 20 DKED C=CCOc1cccc(CN[C@@H](CC)c2ccc(Cl)s2)c1 512220637 XCKGNUSCOTYGDU-HNNXBMFYSA-N 321.873 5.207 30 20 DKED N#CCCCS[C@@H](c1ccccc1)c1ccc(Cl)cc1 515359653 ZNYZFLDTAUQCPH-KRWDZBQOSA-N 301.842 5.466 30 20 DKED CC(=NNc1ccccc1Cl)c1cccc(-c2ccncc2)c1 741452124 YJQHOSQGHKDQDB-UHFFFAOYSA-N 321.811 5.238 30 20 DKED FC(F)(F)C1CCC(C=NNc2cccc3cnccc23)CC1 767378599 SJVRIFJGLDMHBV-UHFFFAOYSA-N 321.346 5.001 30 20 DKED C[C@H](N[C@@H](C)c1csc2ccccc12)c1cccc(C#N)c1 776154867 CKHWFVCRXHYZTC-KBPBESRZSA-N 306.434 5.185 30 20 DKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(F)c1 186842613 IZTGDRMMNZPUHC-IBGZPJMESA-N 312.388 5.071 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 340448058 ISMMMNOSAWONJF-RTWAWAEBSA-N 306.453 5.471 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(F)cc1F 447542404 OZXIYKCXSWHZML-MOPGFXCFSA-N 314.379 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCC(C)(C)C1 475556779 SOCXYPYCOVGMRO-MRXNPFEDSA-N 314.473 5.239 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCC1(C)C 475568661 DVHAFCKLGYFGQG-KRWDZBQOSA-N 314.473 5.239 30 20 DKED N#CC1(CS[C@@H](c2ccccc2)c2ccc(F)c(F)c2)CC1 539520781 HJIUSQHPFYHBCD-KRWDZBQOSA-N 315.388 5.091 30 20 DKED C[C@H](S[C@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1 609825854 XQILJTBVZOAKDW-NWDGAFQWSA-N 303.377 5.392 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](c1ccc(Cl)cc1)C(C)C 614396148 ZNNDLTXIPFCFOH-IBGZPJMESA-N 312.844 5.007 30 20 DKED CC(C)c1nc(C(=O)/C=C/c2ccc(C(F)F)cc2)cs1 812243277 IIZBSDPTKBXFRH-VMPITWQZSA-N 307.365 5.100 30 20 DKED CC(C)(C)CCNN=C(CCC(F)(F)F)CCC(F)(F)F 853332461 IQDSEBUJQIQEMS-UHFFFAOYSA-N 320.321 5.053 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 237427076 PWIICXFDXCLFPG-QGZVFWFLSA-N 312.416 5.076 30 20 DKED Cc1coc(-c2cc(N=C(O)[C@@H]3CC34CCCC4)ccc2C)n1 330117973 XTRRXHZOVCRKFK-INIZCTEOSA-N 310.397 5.127 30 20 DKED C=CCCCN(C)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 477763610 WBALNYQOBCEJGN-CQSZACIVSA-N 318.848 5.262 30 20 DKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCC1CCCC1 511145671 OKCWRNUINXJDIJ-UHFFFAOYSA-N 324.449 5.196 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc2c(c1)oc1ccccc12 517895887 GKDSXCBUQFZYQR-UHFFFAOYSA-N 308.381 5.016 30 20 DKED CC(C)(C#N)CCCN[C@H](c1ccc(Cl)cc1)C1CCC1 539304899 RCAGWWOSXGNBGM-KRWDZBQOSA-N 304.865 5.101 30 20 DKED CC(C)(C#N)CCN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 540664814 IHWUJQMUFYDUEM-MRXNPFEDSA-N 324.390 5.172 30 20 DKED C[C@@H](NCc1ccc(C#N)cc1)c1cccc(-c2ccccc2)c1 765008357 BFELEUWRBAFTSG-QGZVFWFLSA-N 312.416 5.076 30 20 DKED CC(C)=CCC[C@H](C)CC=NNc1ccc(Cl)c(C(=O)O)c1 1776033150 DXKOVZTVMIMAMS-ZDUSSCGKSA-N 322.836 5.209 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccccc1F 108407644 VEZOSUIYWJIDGL-KBPBESRZSA-N 314.429 5.251 30 20 DKED CSc1ccccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 340447323 PQZJLDPRLAITFA-VQIMIIECSA-N 324.493 5.494 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1F 512630008 LENDNXRROQSOBD-BTYIYWSLSA-N 322.427 5.279 30 20 DKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(C#N)cc1 514529479 FVGINRJJTYEPHC-LBPRGKRZSA-N 319.235 5.058 30 20 DKED Cc1cc2cc([C@H](C)N[C@H](C)c3ccc(C#N)cc3)oc2cc1C 532206438 RKADQQSCPCXWDB-CVEARBPZSA-N 318.420 5.333 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1 538508361 JUWQEYZAEIPHGO-KPZWWZAWSA-N 316.807 5.153 30 20 DKED C[C@H](Nc1ccc(F)cc1OC(C)(C)C)c1cccc(C#N)c1 600847101 GXAMZPUIUFQSPW-ZDUSSCGKSA-N 312.388 5.048 30 20 DKED CC[C@H](CC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 609427792 LRGQCFLMCKDSOC-LSDHHAIUSA-N 318.486 5.092 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@H](C)c3cccc(C#N)c3)oc2c1 617304720 YFDAHQPXRRDGBZ-HUUCEWRRSA-N 304.393 5.025 30 20 DKED COCc1cccc(/C=C/C(=O)c2ccc(Cl)cc2Cl)c1 742429699 VPBYIDUIVVBQMS-VMPITWQZSA-N 321.203 5.036 30 20 DKED C[C@H](N[C@@H](C)c1csc2ccccc12)c1ccc(C#N)cc1F 781421939 IXZZSYNOTFIYLE-STQMWFEESA-N 324.424 5.324 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(F)c1F 340442034 DTRSYSARJZWBJY-RDTXWAMCSA-N 314.379 5.051 30 20 DKED CCOc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 340445164 LKROZEBFMSQLCU-DYESRHJHSA-N 322.452 5.171 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)c2ccccc12 462465511 FBKCUFAWOUYAFK-CQSZACIVSA-N 320.823 5.216 30 20 DKED O=C(/C=C/C1=Cc2ccccc2OC1)c1ccc2ccccc2c1 726741267 DECHQKUCDIMLHE-FMIVXFBMSA-N 312.368 5.055 30 20 DKED O=C(/C=C\c1ccsc1)c1ccc(SCC(F)F)cc1 741844887 WIPDAXFURNCFSI-BHQIHCQQSA-N 310.390 5.001 30 20 DKED CCc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 321676330 VNJUALANIUBTIA-INIZCTEOSA-N 308.425 5.105 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@@H](CCCC#N)c1ccccc1)CC2 340451834 PDRRLQXBDJUIHP-LEWJYISDSA-N 304.437 5.007 30 20 DKED CC(C)(C#N)CCCNc1ccc(OCc2ccccc2)cc1 380909438 KCEYITMVUSDZFN-UHFFFAOYSA-N 308.425 5.007 30 20 DKED CC[C@H](C)[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462751734 BFGMYHONWHYJHS-IFXJQAMLSA-N 312.844 5.089 30 20 DKED N#C[C@@H]1CCC[C@H](Nc2ccc(SC3CCCC3)cc2)C1 463290609 WOTDNQUOFOEKAF-ZBFHGGJFSA-N 300.471 5.216 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(C)cc(C)cc1C 471133897 SCXMPMUOLMTTGW-UHFFFAOYSA-N 322.452 5.222 30 20 DKED CC(C)(C#N)CCSCCOc1c(Cl)cccc1Cl 573478116 MQXOMVSTVZXBCB-UHFFFAOYSA-N 318.269 5.045 30 20 DKED CC[C@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc(C#N)cc1 582645794 WRKKZRLZEBYXRE-PMACEKPBSA-N 304.437 5.022 30 20 DKED C[C@H](SCc1ccc(OC(F)F)cc1)c1ccc(C#N)cc1 609825740 QNYQXIWPWITCCU-LBPRGKRZSA-N 319.376 5.154 30 20 DKED CC(C)c1ccc(C[S@@](=O)CCC(C)(C)C#N)c(C(C)C)c1 616181884 JAVYMSCYCMUEGQ-QFIPXVFZSA-N 319.514 5.122 30 20 DKED CCC[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccccn1 729149302 IPIWMDSWEVPZDP-FHOUHHFSSA-N 323.223 5.054 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2nc(-c3ccccc3)cs2)c1 763293363 XKKDCXUWDBZXFI-KTKRTIGZSA-N 323.392 5.154 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccccc1SCC)c1ccncc1 766022988 YVEDNZQOMBYQIA-MAUKXSAKSA-N 312.482 5.162 30 20 DKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1cccc2ccccc12 779713414 SQQRCZIYMFXUFB-JKSUJKDBSA-N 316.404 5.304 30 20 DKED CC1(C#N)CCC(N[C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1 449773272 MQNWFXSKBSXQFB-BARLLCKDSA-N 316.876 5.038 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(Cl)c1F 484972746 ORNDQPGSBNAEGE-UHFFFAOYSA-N 324.827 5.079 30 20 DKED C[C@@H](Nc1cccc(SC(F)(F)F)c1)c1ccc(C#N)cc1 864021489 MPCVWLFXFBIELD-LLVKDONJSA-N 322.355 5.343 30 20 DKED N#CCC[C@H](NCc1ccc(Cl)cc1Cl)c1ccccc1 130607205 NTDIKKCZIHYROD-KRWDZBQOSA-N 319.235 5.128 30 20 DKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3)c2)oc1C 183015121 PMAIWPDHDDUMJX-CQSZACIVSA-N 317.392 5.003 30 20 DKED CC(C)(C#N)CCCCSCc1nc2ccccc2s1 435883700 MJYXLUCAQMBSQJ-UHFFFAOYSA-N 304.484 5.250 30 20 DKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(-c2ccccc2)s1 453287420 FTPDVXNLJXOHAU-ZOBUZTSGSA-N 310.466 5.148 30 20 DKED C=C(C)[C@H](NCc1cc(Cl)cs1)c1ccc(F)c(F)c1 487567154 COZOKMWDCPQVHK-HNNXBMFYSA-N 313.800 5.087 30 20 DKED C[C@H](Sc1ccc(C#N)cc1Cl)c1ncc(C(C)(C)C)o1 532856310 QFFAGRFSMYOCTG-JTQLQIEISA-N 320.845 5.350 30 20 DKED C[C@H](Nc1ccccc1S[C@H](C)CC#N)c1cccc(C#N)c1 600847426 SHSQCRHFZXDBDU-CABCVRRESA-N 321.449 5.126 30 20 DKED Cc1c(C(=O)/C=C\c2cncc3ccccc23)oc2ccccc12 772795530 ATMGVJAUALLJIQ-KHPPLWFESA-N 313.356 5.186 30 20 DKED C#CCCCCC(=O)Nc1cc(-c2ccccc2)ccc1Cl 791973666 BTQMYQWOCPSFDE-UHFFFAOYSA-N 311.812 5.139 30 20 DKED CC[C@@H](C)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 795206042 VLPQEDCEQDKYSN-OXQOHEQNSA-N 320.436 5.107 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc2ccccc12 74335973 PDQRPFQNCQUTAM-CVEARBPZSA-N 300.405 5.123 30 20 DKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCC(C)(C)C 303346953 MRPZFEKKANZBGD-CQSZACIVSA-N 318.486 5.236 30 20 DKED CC[C@@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 447522959 RNUZBWDZKUECSK-KSFYIVLOSA-N 314.432 5.513 30 20 DKED CC(=O)c1c(C)cc(C)c(CSCCCC(C)(C)C#N)c1C 480416736 MOHFJUQVMZTQKY-UHFFFAOYSA-N 317.498 5.378 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Cl)cc1 571628081 CPTHIPSHRRKBBA-CYBMUJFWSA-N 316.857 5.204 30 20 DKED CCCCCCC[C@@H](NCc1nccs1)c1ccccc1 765240803 BMCKMTDOTXMTFA-QGZVFWFLSA-N 302.487 5.335 30 20 DKED C[C@H](Nc1ccccc1CCC(F)(F)F)c1ccc(C#N)cc1 89099323 RTCYDSFOVBQSQW-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED CC(C)(C#N)CCCSCc1csc(C2CCCC2)n1 161676567 OLQOPXFJOWEFIE-UHFFFAOYSA-N 308.516 5.364 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@H]1CCC[C@H](C#N)C1 463299338 DUYSNCGMSGVOFN-RDJZCZTQSA-N 302.487 5.131 30 20 DKED C[C@H](Nc1cccc(OC2CCCC2)c1)c1cccc(C#N)c1 537537620 XNDFMXPDWDTOKA-HNNXBMFYSA-N 306.409 5.053 30 20 DKED CC[C@@H](C)Sc1ccc(NC(=O)C(C#N)(CC)CC)c(C)c1 599230999 RBYOXVTXJPUPTN-CQSZACIVSA-N 318.486 5.154 30 20 DKED Cc1cc(C)c(CNc2ccccc2SCCC#N)c(C)c1 609386040 XQDRIKTVOLBXIV-UHFFFAOYSA-N 310.466 5.230 30 20 DKED COc1ccccc1-c1ccc([C@@H](C)N(C)CCCCC#N)cc1 610216353 VOOHHXUZGWCXFU-QGZVFWFLSA-N 322.452 5.049 30 20 DKED C[C@H](SCCC(C)(C)C#N)[C@H](C)SCCC(C)(C)C#N 790283086 PFIZVDMLYIEMKJ-KBPBESRZSA-N 312.548 5.110 30 20 DKED CC(C)n1nccc1/C=C\C(=O)c1cccc(-c2ccccc2)c1 794934385 JTXNKANBGFWVOX-QXMHVHEDSA-N 316.404 5.027 30 20 DKED N#CC1CCC(CNc2ccc([C@@H](F)C(F)(F)F)cc2)CC1 902128970 KLVARNKLMLGXFO-KOHJWAIASA-N 314.326 5.001 30 20 DKED CC(C)c1ccc(NC(=S)Nc2ccc(CCC#N)cc2)cc1 905644388 JPWIXVCNYWKLPY-UHFFFAOYSA-N 323.465 5.075 30 20 DKED C[C@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 127687986 RQRNZBVHOQENKF-XHDPSFHLSA-N 316.857 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCCCC1 191483642 KZKAUEUPXOHSPT-UHFFFAOYSA-N 314.473 5.337 30 20 DKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(C#N)cc1 539496817 MESCNTHNZCZESR-VBKZILBWSA-N 324.855 5.404 30 20 DKED N#CCCC[C@@H](N[C@H]1CCc2ccc(Cl)cc21)c1ccccc1 551212328 ZJTDQMFEIINTNC-UXHICEINSA-N 324.855 5.352 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1cccc(-c2ccccc2)c1 558244441 WWHXFDNYOJIYKS-QGZVFWFLSA-N 306.453 5.334 30 20 DKED C=CCCCCCN(C)C(=S)Nc1ccc(CCCC)cc1 739456634 HXUWJSSELHUODP-UHFFFAOYSA-N 318.530 5.404 30 20 DKED CCCCCCC[C@H](NCc1cc(C)no1)c1ccccc1 765781683 AXWPHBSYGKCJMI-IBGZPJMESA-N 300.446 5.174 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(OC(C)(C)C)cc1)c1ccncc1 765805207 VDWVPHJZMDKVFS-OXJNMPFZSA-N 324.468 5.227 30 20 DKED CC(C)c1ccccc1CNc1cccc(OCCCC#N)c1 864019626 KCOFSMZQVPELJD-UHFFFAOYSA-N 308.425 5.105 30 20 DKED CC(C)(C(O)=Nc1csc(-c2ccncc2)n1)C1CCCC1 330308564 SWEDCXYZNPSJPA-UHFFFAOYSA-N 315.442 5.010 30 20 DKED Cc1cccc2c1CC[C@H]2N[C@H](CCCC#N)c1ccccc1 340453968 SMVILZRNSQZBDD-NHCUHLMSSA-N 304.437 5.007 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1C(F)F 425689407 CFBPXLIXUDPVFI-UHFFFAOYSA-N 322.399 5.224 30 20 DKED CC1(C#N)CCC(Nc2ccc(COC3CCCC3)cc2)CC1 453163149 IPSLGILQMCKGEF-UHFFFAOYSA-N 312.457 5.030 30 20 DKED C=CCC[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccccc1 594954800 JSTSLAASDAWGLQ-OAQYLSRUSA-N 316.448 5.039 30 20 DKED COc1ccc(/C=C\C(=O)c2sccc2C)c2ccccc12 733748560 CEPNGUTYINEOSO-CLFYSBASSA-N 308.402 5.114 30 20 DKED CCCCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915084943 BLURDLPCHBESNX-HXUWFJFHSA-N 320.436 5.251 30 20 DKED C[C@H](c1nc2ccccc2s1)N(C)CCCCC(C)(C)C#N 277787318 SFWZNOHUXLDOMH-CQSZACIVSA-N 315.486 5.009 30 20 DKED CC[C@H](CC(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 410443463 LFMBNJVGVUYNKT-HUUCEWRRSA-N 318.486 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)C(CC)CC 476090848 NBJHJZXLMYFJGG-OAHLLOKOSA-N 301.474 5.549 30 20 DKED C=CCC[C@H](N[C@H](C)c1cnc2ccsc2c1)c1ccccc1 536831048 GGZJAAWWNDSJDG-QAPCUYQASA-N 322.477 5.654 30 20 DKED C[C@H](OC(=O)CCCCCC#N)c1ccc(Cl)c(Cl)c1 805696472 GYRKPKCWTKNZLT-NSHDSACASA-N 314.212 5.072 30 20 DKED C[C@H](SCc1cc(Cl)nc(Cl)c1)c1cccc(C#N)c1 808365563 CXCYHMAUCKTXNX-JTQLQIEISA-N 323.248 5.254 30 20 DKED N#Cc1ccc(CSCc2csc(C3CCCC3)n2)cc1 63898704 NSYXOMYEQWRHQI-UHFFFAOYSA-N 314.479 5.106 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1c(C)noc1C1CC1 129298959 WGXTUSDBXRCPSX-UHFFFAOYSA-N 321.465 5.075 30 20 DKED N#CCc1ccc(N[C@@H](Cc2ccccc2)c2ccccc2)cc1 324842822 INMZBLARORVTHR-QFIPXVFZSA-N 312.416 5.149 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC[C@H]1CC 477000680 JQNKJWWCVFDBOU-APWZRJJASA-N 313.485 5.693 30 20 DKED N#Cc1ccc(CNc2cccc(-c3cccs3)c2)cc1F 479459691 YYLXNTIUVJDDDQ-UHFFFAOYSA-N 308.381 5.038 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cc(C)c(C)o1)c1ccc(F)c(F)c1 502433314 VNTWZZUFVUOADL-XIKOKIGWSA-N 305.368 5.143 30 20 DKED C=C[C@@H](CC(=O)Nc1c(CC)cccc1CC)c1ccccc1 533965730 RDMGFDSKNYGPJQ-SFHVURJKSA-N 307.437 5.110 30 20 DKED N#CCCC[C@@H](NCc1ccccc1C1CC1)c1ccccc1 590069262 LWOGBFDDYJNUAE-OAQYLSRUSA-N 304.437 5.089 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@@H](C#N)Cc1ccccc1 610294716 ZKAPZDARUREGCQ-LJQANCHMSA-N 324.493 5.183 30 20 DKED CCCCCCCC[S@@](=O)Cc1ccc(C(F)F)cc1 790139643 UVNUGKXIIUQKIE-HXUWFJFHSA-N 302.430 5.233 30 20 DKED C=CC[C@H](N[C@H]1CCCc2ccc(SC)cc21)c1ccncc1 842842354 XFKZNBZCGARJFI-PMACEKPBSA-N 324.493 5.088 30 20 DKED CCC/C(C)=C\C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 920225391 YUPJQACMQYQCAK-SQFISAMPSA-N 320.392 5.035 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 192995218 KIIISJIOQNVSBW-SJORKVTESA-N 322.452 5.124 30 20 DKED CCC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1 340448702 JBVOJRXZPWENMZ-NHCUHLMSSA-N 306.453 5.553 30 20 DKED C[C@H](SCc1cc(-c2ccccc2)no1)c1cccc(C#N)c1 443150109 ZBEGTKUDMZUJIX-AWEZNQCLSA-N 320.417 5.208 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1Cl 539495690 DBZNRJYCTCNXJN-NEPJUHHUSA-N 319.235 5.277 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)cc1 540705561 TZPSNTLPFSBAKT-KZULUSFZSA-N 316.807 5.153 30 20 DKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccccc2)s1 742432660 ZGYXMPXMFAGUCL-BQYQJAHWSA-N 311.431 5.076 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)cc1 512658968 BGHOUUJIYXBSFG-XIKOKIGWSA-N 316.807 5.153 30 20 DKED C=CC[C@H](N[C@@H](C)c1oc2ccccc2c1C)c1ccncc1 766019237 KZMUHBTZWMQYCR-YJBOKZPZSA-N 306.409 5.104 30 20 DKED CC(C)(C)c1cnc(/C=C\C(=O)c2csc(Cl)c2)s1 790608191 DQVLNZVNYPNDMS-PLNGDYQASA-N 311.859 5.052 30 20 DKED C[C@@H]1/C(=C/c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 809155867 HCMPDGJUHLHPLV-FSKGUYTJSA-N 323.442 5.255 30 20 DKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc2ncsc2c1 915978983 LAMNCGASRZRLPE-UHFFFAOYSA-N 323.204 5.059 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](C)c1ccc(Cl)cc1Cl 165173739 VQKKNACKGBQSFL-GFCCVEGCSA-N 319.235 5.024 30 20 DKED C=CCCNc1ccccc1Oc1ncc(Cl)cc1Cl 303899615 SODAQLYANIFPRJ-UHFFFAOYSA-N 309.196 5.169 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccncc1Cl)c1ccccc1 421831313 DSGGGRZEOMSRCU-KSSFIOAISA-N 300.833 5.093 30 20 DKED CC[C@@H](Nc1ccc(C)c(-c2ncco2)c1)c1ccc(C#N)cc1 447596476 CLLCPSYRPCFRQS-LJQANCHMSA-N 317.392 5.085 30 20 DKED COc1ccc(C#N)cc1N[C@H](C)c1ccc(Cl)c(Cl)c1 493838109 XFHMVPHGCMFFMY-SNVBAGLBSA-N 321.207 5.047 30 20 DKED C[C@@H](Oc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 507076617 YIYNEWUISMRMQY-GFCCVEGCSA-N 324.767 5.007 30 20 DKED CC(C)CCOc1ccc([C@@H](C)NCC(C)(C)CCC#N)cc1 576852008 ROKVRTJTGDIVRR-QGZVFWFLSA-N 316.489 5.092 30 20 DKED C[C@H](Nc1snc(Cl)c1C#N)c1csc2ccccc12 729987419 YTMIMCIFZOYLNX-QMMMGPOBSA-N 319.842 5.056 30 20 DKED CC[C@@H](Nc1ccc(N2CCCCC2)cc1)c1ccc(C#N)cc1 774270345 DNBINYRRRHIULQ-OAQYLSRUSA-N 319.452 5.112 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cc(C)ccc1C 858377062 UVLGZZFICQLNLB-UWJYYQICSA-N 322.452 5.008 30 20 DKED CC(/C=C\C1=C(C)CCCC1(C)C)=NNc1cncc(Cl)n1 914557868 ZLBBKWDWSQTCLZ-IRUSHPATSA-N 318.852 5.001 30 20 DKED CCCCCCC[C@H](CC(=O)O)NCC1CCCCCCC1 1776783327 QHQCKEKCKGWZGF-GOSISDBHSA-N 311.510 5.140 30 20 DKED CCN(Cc1ccc(F)cc1C#N)[C@@H](C)c1cc2ccccc2o1 489544511 CNJVPJNAZXXTRW-AWEZNQCLSA-N 322.383 5.027 30 20 DKED C[C@H](S[C@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1 522962109 XAICEMQQMAMIJA-NWDGAFQWSA-N 303.377 5.392 30 20 DKED CCC(CC)[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccs1 561453979 AXCIWVBCIPTVEK-LIRRHRJNSA-N 312.482 5.448 30 20 DKED C#CC[C@H](N[C@@H](C)c1ccccc1SCC)c1ccccc1 773103970 CVUWCGSBPCSLQY-LPHOPBHVSA-N 309.478 5.214 30 20 DKED CCCCCCCCC(=O)[C@H](C#N)c1nc2ccccc2s1 916846348 QLSZPLCAUIAZDG-AWEZNQCLSA-N 314.454 5.223 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 90664897 KJNOOYKOOUMJMQ-SCLBCKFNSA-N 316.807 5.175 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccc(C)s1)c1ccc(F)c(F)c1 480672720 ZVQNVMPREKCPBX-SJCJKPOMSA-N 307.409 5.303 30 20 DKED C=C(C)[C@@H](N[C@@H]1CCCc2sccc21)c1ccc(F)c(F)c1 480683860 SDWCUDWFSZIYPC-SJLPKXTDSA-N 319.420 5.311 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 551204111 ABEVUWNBBPVBSB-UKRRQHHQSA-N 318.873 5.487 30 20 DKED C=CCC[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1 611394433 JAFRVYRWEUUUAB-YADHBBJMSA-N 316.448 5.233 30 20 DKED Cc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)s1 734981719 SHVWTQXCYPGCTJ-HJWRWDBZSA-N 310.390 5.267 30 20 DKED C#CCCCNc1ccccc1Oc1ncc(Cl)cc1Cl 766724730 LLPDUJOXSOIJJX-UHFFFAOYSA-N 321.207 5.006 30 20 DKED C[C@@H](Nc1ccc(OC2CCCC2)c(F)c1)c1cccc(C#N)c1 863996120 PQEJIUMKFPNICW-CQSZACIVSA-N 324.399 5.192 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1ncc(C(C)(C)C)o1 85228667 ARVLLHACOQACMB-OLZOCXBDSA-N 314.454 5.399 30 20 DKED C[C@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccc(C#N)cc1 156835284 LQZQEPLBHOZCJY-JKSUJKDBSA-N 322.452 5.147 30 20 DKED C[C@@H](N[C@H]1CCCc2sc(Cl)cc21)c1cccc(C#N)c1 426321379 CLMHKIMMAQQSJR-ABAIWWIYSA-N 316.857 5.001 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)s1 475041242 PYBQKPAMERXCNF-LLVKDONJSA-N 322.886 5.408 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(-c2ccccc2)o1 531951502 OHGFTKGNKNOZEJ-CVEARBPZSA-N 316.404 5.230 30 20 DKED C=C[C@H](CC(=O)Nc1ccccc1OC(C)(C)C)c1ccccc1 533941913 SLPRNLQLZBVXFM-MRXNPFEDSA-N 323.436 5.162 30 20 DKED C=CCCC[C@H](C)N[C@H](C)c1cccc(OCc2ccccn2)c1 539257196 QVZJPCYUSDJIRK-ZWKOTPCHSA-N 324.468 5.056 30 20 DKED C[C@H](c1ccccc1)N(C(=O)CCCCCC#N)c1ccccc1 588890367 HUNYQCZRGBVQCQ-GOSISDBHSA-N 320.436 5.255 30 20 DKED CCC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 733680661 BAMRQTMUVLFYOH-HOTGVXAUSA-N 324.424 5.001 30 20 DKED CCCCCCCC(=O)Nc1cnn([C@H](C)CC)c1C1CC1 762722411 VUENTSWOXBHHNY-CQSZACIVSA-N 305.466 5.031 30 20 DKED C[C@@H]1C[C@H]1c1ccc(CN(CCCCC(C)(C)C#N)C2CC2)o1 444597690 ODCLDEIVJNATQC-CRAIPNDOSA-N 314.473 5.087 30 20 DKED C=CCCCCCSCC(=O)Nc1c(C)cc(C)cc1C 485582446 RMBFKWHZUAYKMO-UHFFFAOYSA-N 305.487 5.030 30 20 DKED Cc1c([C@@H](NCCCC(C)(C)C#N)C(C)C)oc2ccccc12 537057847 XCAFXPZZHOLWAK-SFHVURJKSA-N 312.457 5.358 30 20 DKED C=CCC[C@H](NCc1ccc(-c2cccnc2)cc1)c1ccco1 560528764 QXOYYKYPZCFCQR-FQEVSTJZSA-N 318.420 5.139 30 20 DKED C[C@@H](CCc1ccc(F)cc1)N[C@@H](CCCC#N)c1ccccc1 577271097 UYYBSGOVDNEYLC-UWJYYQICSA-N 324.443 5.172 30 20 DKED CSc1ccc(Cl)c(N[C@H](C)c2cccc(C#N)c2)c1 600852024 KNDQMLORVWUUAP-LLVKDONJSA-N 302.830 5.107 30 20 DKED CCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 781505703 AMOCGSVUJZYNNE-KDOFPFPSSA-N 320.502 5.439 30 20 DKED CCc1cnc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)s1 783700411 DCJWHVQLBJQJEU-GQCTYLIASA-N 317.797 5.001 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 21799126 RPUJFOAUDJVGNT-NEPJUHHUSA-N 319.235 5.277 30 20 DKED N#CCCCOc1cccc(N[C@@H]2CC[C@H](c3ccccc3)C2)c1 438125215 VUBOYTOPSUIDJE-AZUAARDMSA-N 320.436 5.117 30 20 DKED N#Cc1ccc(CN[C@H](c2ccccc2)C2CCCCC2)s1 561355800 MCUSTUBSRWTPSG-LJQANCHMSA-N 310.466 5.031 30 20 DKED CCCc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 570521642 YAHFJRQMZJTQPO-OAQYLSRUSA-N 306.453 5.164 30 20 DKED Cc1ccc(CN[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 578874637 CVEISFBQAZBQCK-IBGZPJMESA-N 312.844 5.173 30 20 DKED Cc1ccc2c(c1)C/C(=C\c1csc(-c3cccs3)n1)C2=O 728440166 KUBMOUJSNIMDMV-UKTHLTGXSA-N 323.442 5.002 30 20 DKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccccc2)cc1 741465651 WYPLFVLEYMXTEQ-DTQAZKPQSA-N 314.384 5.258 30 20 DKED N#CCc1ccnc(NCc2c3ccccc3cc3ccccc23)c1 767292549 WLGDPZUFOMVROR-UHFFFAOYSA-N 323.399 5.066 30 20 DKED Cc1ccc([C@H](C)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 49185828 FIRNXPXIWWBCPF-JTQLQIEISA-N 310.344 5.120 30 20 DKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1 192988786 GBDZXFBVRSYNMA-YJYMSZOUSA-N 310.828 5.014 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(CC)CC 475580915 MJWLISDSUNEYNU-UHFFFAOYSA-N 302.462 5.096 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2ccccc2)cc1C 516699788 WPOWTVOREOHSSB-LJQANCHMSA-N 320.436 5.234 30 20 DKED N#CCC[C@@H](Nc1ccnc2c(Cl)cccc12)c1ccccc1 553510449 CUAPWKJJKAENLM-QGZVFWFLSA-N 321.811 5.345 30 20 DKED CC[C@H](CN[C@H](CCCC#N)c1ccccc1)c1ccccc1 560563618 BJWRWYYRKWIYPJ-WIYYLYMNSA-N 306.453 5.205 30 20 DKED N#CCCC[C@@H](NC/C=C\c1ccc(Cl)cc1)c1ccccc1 590069146 CKLUNJUVPFNPBM-PXDRNWIDSA-N 324.855 5.378 30 20 DKED Cc1ccsc1C(=O)/C=C/c1ccc(-c2ccncc2)cc1F 751534820 JSLWQCYXNGOQSO-SNAWJCMRSA-N 323.392 5.154 30 20 DKED COc1cc(C(=O)/C=C\c2sccc2Cl)ccc1SC 782330375 YXCXLSWDAATQSM-XQRVVYSFSA-N 324.854 5.028 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1F 823045004 PJGZVLRPJRYSDE-UHFFFAOYSA-N 324.399 5.196 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(-c2cccnc2)cc1 278580465 CQAHDNCHCRBWPY-QGZVFWFLSA-N 321.468 5.119 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C)c1 340450379 XYMNLQJLESLAAS-LEWJYISDSA-N 306.453 5.471 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H](C)[C@@H]1C 417035373 FYKKECBNHGOUSZ-JYJNAYRXSA-N 314.473 5.047 30 20 DKED N#CCCC[C@H](NCC/C=C\c1ccccc1)c1ccccc1 451067471 XCASCRCYLHICPQ-LUTRRODMSA-N 304.437 5.115 30 20 DKED CC[C@@H](NCCCCC#N)c1ccc(Oc2ccccc2)cc1 482457378 QNKXPHBMXBPGHI-HXUWFJFHSA-N 308.425 5.213 30 20 DKED C=CCCC(=O)N[C@H](C)c1ccccc1-c1ccc(Cl)cc1 523501324 UYDNPYUBRTXOGG-CQSZACIVSA-N 313.828 5.150 30 20 DKED CC(C)CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccoc1 586794286 MLKRYBQUEMEDGV-SFHVURJKSA-N 316.832 5.072 30 20 DKED CN(Cc1ccccc1)c1ccc(NCC(C)(C)CCC#N)cc1 770529947 IOZHTFILSPDZQF-UHFFFAOYSA-N 321.468 5.065 30 20 DKED Cc1cccc(C(C)C)c1NC(=O)Nc1ccc(CCC#N)cc1 929188188 CIJVHUHCRFDKGG-UHFFFAOYSA-N 321.424 5.219 30 20 DKED COc1ccc2cc(/C=C/C(=O)c3cc(F)ccc3F)ccc2c1 7717613 FNHFIMYHYNHUKT-YCRREMRBSA-N 324.326 5.023 30 20 DKED N#CCCCOc1cccc(N[C@@H]2CC[C@@H](c3ccccc3)C2)c1 438125220 VUBOYTOPSUIDJE-UYAOXDASSA-N 320.436 5.117 30 20 DKED C=C[C@@](C)(CC)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 468012581 WMVIRWKXCCKTGS-IBGZPJMESA-N 312.413 5.006 30 20 DKED CCCCCCCC(=O)O[C@H](c1ccccc1)c1cccnc1 728416319 KYBGUTBMWPWZKN-HXUWFJFHSA-N 311.425 5.075 30 20 DKED C[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)CC(C)(C)C 797569348 PKYPMOZNUAZOMN-CHWSQXEVSA-N 320.502 5.079 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccn2c1 189900828 ADFNYZRQSMSXQB-UHFFFAOYSA-N 318.420 5.044 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccccc1 189902458 RLGFYARIUABVJL-INIZCTEOSA-N 307.437 5.281 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)cc1C 276501958 XDIMVDFZMZGFJW-UHFFFAOYSA-N 323.436 5.108 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C=C(C1CC1)C1CC1 276513793 ZZRLRKALIWPAOV-UHFFFAOYSA-N 309.453 5.223 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C2CC2)c1 340445487 DUDDDBYHASELKJ-VGSWGCGISA-N 318.464 5.650 30 20 DKED C[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1cccc(C#N)c1 427874783 IIVXNJPQSBCNHK-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(C)c1 476118020 LBRVRWZMGWPDGH-KRWDZBQOSA-N 321.464 5.589 30 20 DKED N#Cc1cnc(Oc2ccc(Oc3ccccc3)cc2)c(Cl)c1 513639854 GSWJPUAUHUYYBG-UHFFFAOYSA-N 322.751 5.191 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(C(F)F)c1 626633666 GOHJBTWFIHGAGC-UHFFFAOYSA-N 319.351 5.321 30 20 DKED O=C(/C=C/c1ccc(O)cc1)c1ccc(-c2ccc(F)cc2)s1 844255457 CGMDYMDPFLJCBJ-XCVCLJGOSA-N 324.376 5.156 30 20 DKED FC(F)(F)[C@@H]1CCC[C@@H](C=NNc2cccc3ncccc23)C1 853290299 VTYRRZSTSLZKIL-CHWSQXEVSA-N 321.346 5.001 30 20 DKED C=C(C)CSc1nnc(-c2ccc(F)cc2)c2ccccc12 301147133 QPOMUVZOMVKJDG-UHFFFAOYSA-N 310.397 5.104 30 20 DKED CC(F)(F)c1ccccc1NCc1ccccc1C(C)(C)C#N 453159765 NWFZYXYRTRCEAA-UHFFFAOYSA-N 314.379 5.212 30 20 DKED C[C@@H](C#N)CSc1ccccc1NC[C@@H]1C[C@H]1c1ccccc1 461765130 DAXMBVQKGQGHFN-SZMVWBNQSA-N 322.477 5.154 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(SC)cc1)c1ccc(C#N)cc1 467417924 MHWYJCHXFQJUDI-IFXJQAMLSA-N 310.466 5.082 30 20 DKED C=CCC[C@@H](Nc1ccc2cnn(C(C)C)c2c1)c1ccco1 552281612 DLBRRAFJDXZFIF-QGZVFWFLSA-N 309.413 5.330 30 20 DKED N#CCCCCCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 590979802 QAGPDSNORBRXNG-UHFFFAOYSA-N 319.619 5.059 30 20 DKED C=CCN(CC=C)C(=O)Nc1ccc(SC(C)(C)C)cc1C 726079652 GTQDCHTZKBQFIW-UHFFFAOYSA-N 318.486 5.092 30 20 DKED C=CC[C@@H](C)NC(=S)Nc1c(C(C)C)cccc1C(C)C 734988064 VPDZUJHQEPIRIN-CQSZACIVSA-N 304.503 5.184 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(CF)cc1 777541683 QDQMNFUSXAWLGN-AWEZNQCLSA-N 314.429 5.020 30 20 DKED CCSc1ccc(C(=O)/C=C/c2ccc3cnccc3c2)cc1 782347740 MYBJOEDHVPEJOR-ONNFQVAWSA-N 319.429 5.243 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@H]1c1ccsc1 915628596 FPUBDEHHIBMMKZ-KRWDZBQOSA-N 307.503 5.552 30 20 DKED Cc1c([C@H](C)N[C@@H](CCC#N)c2ccccc2)oc2ccccc12 90665256 GTIAEBHWVBXECV-LPHOPBHVSA-N 318.420 5.437 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(C)c1C 189896298 CHOOTWHAIGHXEL-UHFFFAOYSA-N 313.466 5.469 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H]1CCCc2sccc21 360876054 YRXOOGSIWNKYKQ-MOPGFXCFSA-N 322.477 5.054 30 20 DKED O=C(/C=C\c1cccc(F)c1F)c1cccc(Cl)c1Cl 734981761 SXDJSCBQOHOXDG-FPLPWBNLSA-N 313.130 5.168 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc3ccccc3c2)s1 736432883 JJRNCLKHQKPIBM-ZHACJKMWSA-N 321.445 5.490 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 766019288 LKNXUZSFCJAKQJ-PXAZEXFGSA-N 321.251 5.356 30 20 DKED C=CCC[C@H](N[C@@H](C)c1sc(C)nc1C)c1ccccc1 181507428 KSUNFAOIDKYXIV-YOEHRIQHSA-N 300.471 5.118 30 20 DKED N#CCCC[C@H](N[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 340453004 QDUGJGPGSUQIMU-ZACQAIPSSA-N 324.390 5.132 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccccc1 502405172 LGHFHADYEOYIOP-DYESRHJHSA-N 323.484 5.356 30 20 DKED C[C@@H](NCc1ccc(-c2ccsc2)cc1)c1ccc(C#N)cc1 549166683 SZWFLFYYLROKNK-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C=CCCCCCN(C)C(=O)Nc1c(C)cc(C)cc1Cl 606938360 PQNKTYWPZZLIJU-UHFFFAOYSA-N 308.853 5.167 30 20 DKED C#CC[C@H](N[C@@H]1C[C@H](C)Sc2sccc21)c1ccccc1 773113792 DUMKEDRWFLKBDW-RRQGHBQHSA-N 313.491 5.028 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1c(C)cccc1C 799901929 LDZIYDNVMSKJRF-UHFFFAOYSA-N 310.466 5.231 30 20 DKED C=CCC[C@H](N[C@H](C)c1sccc1OC)c1ccccc1 471578777 RUBHDBOKZZMIFH-ZBFHGGJFSA-N 301.455 5.115 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccccc1)C(C)(C)C 487381107 SMXALOJKQYUPAJ-HXUWFJFHSA-N 320.480 5.365 30 20 DKED C=CCCc1ccccc1NC(=O)N(C1CC1)[C@@H](C)c1ccco1 505051189 IVGJELQKKZOINC-HNNXBMFYSA-N 324.424 5.156 30 20 DKED C=C(C)CCc1noc([C@@H](C)Sc2ccccc2Cl)n1 508625225 KBWNDAUUZXQJJV-LLVKDONJSA-N 308.834 5.085 30 20 DKED C[C@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1cccc(C#N)c1 538407919 OWHIFMWRUNNUTR-MGPUTAFESA-N 304.437 5.022 30 20 DKED C=CCC[C@@H](Nc1ccc(NC(C)=O)c(Cl)c1)c1ccco1 560545973 OTYWLFBBPUYEPI-MRXNPFEDSA-N 318.804 5.011 30 20 DKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 574027228 HLSMESWSOVEXQU-IAQYHMDHSA-N 316.857 5.001 30 20 DKED C[C@H](C=NOCc1ccc(C(F)(F)F)cc1)c1ccccc1 746576324 ILMKOKGXYUJTGO-CYBMUJFWSA-N 307.315 5.012 30 20 DKED C#CC[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccccc1 773117374 VPIQOZUNDLOYTP-KBXCAEBGSA-N 317.354 5.121 30 20 DKED C[C@@H](OC(=O)CCCCCC#N)c1ccc(Cl)c(Cl)c1 805696471 GYRKPKCWTKNZLT-LLVKDONJSA-N 314.212 5.072 30 20 DKED O=C(/C=C\c1csc2ccccc12)c1ccc(F)cc1F 810228806 ZCNKKLWZGCIRFK-YVMONPNESA-N 300.329 5.076 30 20 DKED O=C(/C=C/c1cccc(Cl)c1Cl)c1cc(F)ccc1F 916133517 VDRDUUSLKXKRRO-QPJJXVBHSA-N 313.130 5.168 30 20 DKED Cc1ccc2nc(/C=C\c3ccc(O[C@@H](C)C#N)cc3)ccc2c1 208259548 JWHVUCIFJXERBK-FAOGRTBUSA-N 314.388 5.005 30 20 DKED Cc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)cc1C(=N)O 329083659 SVHRFVNSIMUMEP-FVQBIDKESA-N 314.429 5.073 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 340448056 ISMMMNOSAWONJF-NHCUHLMSSA-N 306.453 5.471 30 20 DKED C[C@@H](c1ccc(CSCCCCC#N)cc1)C(F)(F)F 419514693 HVFVSLPQJHGKDM-LBPRGKRZSA-N 301.377 5.279 30 20 DKED C[C@@H](NC1CCC(C)(C#N)CC1)c1ccc(F)c2ccccc12 449331284 YBEGUGBTHYWGKI-ZUIJCZDSSA-N 310.416 5.102 30 20 DKED C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 464516195 CCPPJRVNMYJVHP-NEPJUHHUSA-N 314.256 5.115 30 20 DKED CC(C)(C)c1ccc(Cl)cc1NC(=O)CCCCCC#N 588989909 VGHFNAMUTQYAMP-UHFFFAOYSA-N 306.837 5.050 30 20 DKED O=C(/C=C\c1ccc(F)c(F)c1)c1cccc(Cl)c1Cl 734981927 ZMEPCWWPJIBSCT-ALCCZGGFSA-N 313.130 5.168 30 20 DKED CCCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2o1 735205836 HGZXIGXIOWNKFI-LSDHHAIUSA-N 312.413 5.001 30 20 DKED Cc1nc([C@@H](C)SCCC#N)oc1-c1ccc(Cl)cc1 413011751 JRMSFLUQQRVIKF-LLVKDONJSA-N 306.818 5.011 30 20 DKED CC(C)(C#N)CCCCSCc1ncccc1C(F)(F)F 435886762 BDMXOPXQNBTESU-UHFFFAOYSA-N 316.392 5.054 30 20 DKED CC(C)(C#N)CCCCN1CCC(c2c[nH]c3ccccc23)CC1 444597185 NEPJDAMOESVCAF-UHFFFAOYSA-N 323.484 5.067 30 20 DKED Cc1cc(NCc2cccc(OCCCC#N)c2)ccc1C1CC1 479416688 OAPAASIUVLFCHB-UHFFFAOYSA-N 320.436 5.167 30 20 DKED CCSc1ccc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)cc1 520294067 QFHJZWFCDIWMST-VBKZILBWSA-N 322.477 5.008 30 20 DKED C[C@@H](N[C@@H](c1ccccc1F)C1CCCC1)c1ccc(C#N)cc1 537289228 RKPDJLRVRZNQCB-QVKFZJNVSA-N 322.427 5.279 30 20 DKED Cc1cc(C)cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1 556197544 JTNUPBABADYTNA-WIYYLYMNSA-N 306.453 5.389 30 20 DKED COc1cc(C)ccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 556202702 RONHNNWEQGWZCW-FXAWDEMLSA-N 322.452 5.089 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 559859772 OHMVVBXKDGXXSH-HNAYVOBHSA-N 312.844 5.426 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)C(F)(F)F 626633886 OAKDRTWUUWDLPN-LBPRGKRZSA-N 313.363 5.066 30 20 DKED C=CCN(C(=O)c1cc(-c2ccccc2)ccc1Cl)C(C)C 731969225 IBRGPOKAJUAMGC-UHFFFAOYSA-N 313.828 5.044 30 20 DKED CCCCCC[C@@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 741900869 XKEQDYHKSLKUEF-IAGOWNOFSA-N 314.473 5.074 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(SCC)cc1)c1ccncc1 756925687 GRUBPZQWAGTHPK-KXBFYZLASA-N 312.482 5.162 30 20 DKED C[C@@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)c(F)c1 776739070 LPVMAZKGIQKCOH-CHWSQXEVSA-N 324.424 5.324 30 20 DKED CC(C)C(=NNc1ccc(Cl)c(C(=O)O)c1)C1CCCCC1 1776033462 LYKZWDHUQTVZBC-UHFFFAOYSA-N 322.836 5.042 30 20 DKED C[C@H](N[C@@H](C)c1ccc(OC(C)(C)C)cc1)c1ccc(C#N)cc1 156834990 LQZQEPLBHOZCJY-HOTGVXAUSA-N 322.452 5.147 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)cc(F)c1 340444226 HACBJPUFBNYFSE-LIRRHRJNSA-N 314.379 5.051 30 20 DKED N#CCCCOc1cccc(N[C@H]2CC[C@H](c3ccccc3)C2)c1 438125217 VUBOYTOPSUIDJE-ICSRJNTNSA-N 320.436 5.117 30 20 DKED C=CC[C@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1ccccc1 440646864 ZPZXJQKRAUNXFW-KRWDZBQOSA-N 315.363 5.097 30 20 DKED Cc1cc(N2CCCC[C@H]2C)ccc1NCC(C)(C)CCC#N 537718527 QRXAYNSEAJJWNZ-QGZVFWFLSA-N 313.489 5.116 30 20 DKED CC[C@@H](CNc1ccccc1S[C@@H](C)CC#N)CC(F)F 594704641 CCHGMACTUYEXAA-QWHCGFSZSA-N 312.429 5.174 30 20 DKED C=CCC[C@@H](NCc1ccc2cnccc2c1)c1ccccc1 683773754 RXYNJDZOASUESA-OAQYLSRUSA-N 302.421 5.032 30 20 DKED CCC(=CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC 759146357 ZHFGXWFVNOZUEW-HXUWFJFHSA-N 318.420 5.027 30 20 DKED C=CC[C@@H](N[C@H](C)c1oc2ccccc2c1C)c1ccncc1 766019225 KZMUHBTZWMQYCR-CRAIPNDOSA-N 306.409 5.104 30 20 DKED CC(C)(C)c1cnc(/C=C\C(=O)c2coc3ccccc23)s1 790601256 SKJMQPGOKCWHAK-HJWRWDBZSA-N 311.406 5.083 30 20 DKED C=CC[C@H](N[C@@H](C)[C@@H](C)c1ccc(Cl)cc1)c1ccncc1 792989097 WMOILSHAQKEDBX-VCBZYWHSSA-N 314.860 5.134 30 20 DKED CCCCCCCC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1 887048906 BFSCVSLZRJUFSS-LJQANCHMSA-N 317.473 5.109 30 20 DKED C=CCN(Cc1cc2ccc(SC)cc2nc1Cl)C(C)C 917069772 VHAPSWMLDXVJEQ-UHFFFAOYSA-N 320.889 5.007 30 20 DKED CC[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 37748881 HRUHKZQPKJAWNU-KRWDZBQOSA-N 319.235 5.106 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccccc1 189885866 CCNGBAFZIGRIHE-CCEZHUSRSA-N 305.421 5.190 30 20 DKED N#C[C@H](/N=C(/O)[C@@H]1CC12CCCC2)c1cccc(Cl)c1Cl 328979713 CZBBFPYDHQSMHJ-AAEUAGOBSA-N 323.223 5.095 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc2ccccc2n1)c1ccccc1 537946265 XHWBJDUIJGASRT-UTKZUKDTSA-N 316.448 5.593 30 20 DKED CC(C)(C)c1cc(OC[C@H](C#N)CCC#N)cc(C(C)(C)C)c1 554295318 DFWBCPOMRZGSRC-HNNXBMFYSA-N 312.457 5.104 30 20 DKED CC(C)c1ccc(C=NOc2ccccc2C(F)(F)F)cc1 754712762 SHGBIRBEHYFLQE-UHFFFAOYSA-N 307.315 5.242 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H]1CC 191518678 WXFZYOCFXNSWCQ-MAUKXSAKSA-N 314.473 5.191 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(Cl)s1)c1ccc(C#N)cc1 447526014 BSRSNJWATAMUPI-LSDHHAIUSA-N 318.873 5.465 30 20 DKED C=CCCC1(C(=O)Nc2ccc(-c3ncc(C(C)C)o3)cc2)CC1 476059208 AYUMUOMBWMFIEC-UHFFFAOYSA-N 324.424 5.150 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC=C(C)C 484648956 FIJCIQMYHASLII-UHFFFAOYSA-N 300.446 5.016 30 20 DKED CC(C)(C#N)c1ccccc1CN(Cc1ccco1)C1CCCC1 487394798 KAVKKFXRHJUTNP-UHFFFAOYSA-N 322.452 5.026 30 20 DKED Cc1cc(C)cc(CNc2ccccc2SC[C@H](C)C#N)c1 487399430 XNDDCIASNHQKKC-MRXNPFEDSA-N 310.466 5.167 30 20 DKED COc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1cccc(C#N)c1 539494943 WZQMEEGHCPPGOI-OXQOHEQNSA-N 322.452 5.005 30 20 DKED C[C@@H](SCc1nc2ccccc2s1)c1ccc(C#N)cc1 609825105 GQBJVLMPSGJBHX-GFCCVEGCSA-N 310.447 5.162 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1cc(F)cc(F)c1O)c1ccccc1 756759015 HBZHKIKLOKIEBW-SCLBCKFNSA-N 317.379 5.029 30 20 DKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc(Cl)s1 760264268 MQBHGQQPXLCBNP-SNAWJCMRSA-N 309.843 5.022 30 20 DKED CC(C)c1ccccc1CNc1ccccc1SCCC#N 864005993 NEKFCDZJDCTEHS-UHFFFAOYSA-N 310.466 5.428 30 20 DKED C=CCCc1ccccc1NC(=O)c1scc(C)c1Cl 410348264 VRHCAGUQHZOJJA-UHFFFAOYSA-N 305.830 5.081 30 20 DKED C[C@@H](Sc1nc(-c2ccccc2)co1)c1ccc(C#N)cc1 436257600 GDYTZEIFBVLODR-CYBMUJFWSA-N 306.390 5.067 30 20 DKED CN(CCCCC(C)(C)C#N)Cc1cccc(Cl)c1Cl 444589681 BQPMSAAIAWTKOV-UHFFFAOYSA-N 313.272 5.145 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cccc(F)c1)c1ccc(F)c(F)c1 480662863 KOGMBZMZVZMONL-SGTLLEGYSA-N 305.343 5.072 30 20 DKED Cc1cc(C)c([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1C 540151859 BJGWRPMIILPTAS-WIYYLYMNSA-N 306.453 5.308 30 20 DKED CC[C@@H]1C[C@@H](C=NN(c2ccccc2)c2ccccc2)CCO1 779751033 AYDADCTVTGJHEY-FXAWDEMLSA-N 308.425 5.016 30 20 DKED C[C@@H](NC(c1cccs1)c1cccs1)c1cccc(C#N)c1 181980698 KKVYWEWQPFJTBT-CYBMUJFWSA-N 324.474 5.121 30 20 DKED CCc1ccc([C@@H](CC)N[C@H](CCC#N)c2ccccc2)cc1 358340933 MZSUJDDOMWLQDW-NHCUHLMSSA-N 306.453 5.335 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccccc21 448024721 ZWKXPVKFHHBOTC-YFZFPPMRSA-N 322.427 5.233 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(Cl)ccc1F 484973637 QHHIIGNLRDYJOP-UHFFFAOYSA-N 324.827 5.079 30 20 DKED N#Cc1ccccc1-c1ccc(CN[C@H]2CCc3ccccc32)cc1 538113911 QSSODUREFNDHTO-QHCPKHFHSA-N 324.427 5.002 30 20 DKED C[C@H](CCc1ccccc1)N[C@@H](CCCC#N)c1ccccc1 559866093 UNDFQTWDWAXFMI-NQIIRXRSSA-N 306.453 5.032 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccccc1 657929477 HXCTUKVLJPGWBJ-PBHICJAKSA-N 316.395 5.377 30 20 DKED CCCCCCCC(=O)N1CCCC[C@@H]1c1ccccc1OC 729955881 MGUUKCLTHFUGBJ-GOSISDBHSA-N 317.473 5.109 30 20 DKED CCCCCCCCCCCN(C)[C@@H](C)c1ccc(C(=O)O)o1 1776784585 LWPXXSZLCLFCSA-INIZCTEOSA-N 323.477 5.501 30 20 DKED Cc1coc2ccc(N=C(O)C[C@H]3CCO[C@H](C(C)C)C3)cc12 330043178 FBAVBQOBGMQWIL-KSSFIOAISA-N 315.413 5.171 30 20 DKED CC[C@@](C)(/N=C(/O)c1cc(C(C)C)oc1C)c1nc(C)cs1 330612464 QFCOEVKJUFLRTL-QGZVFWFLSA-N 320.458 5.106 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 460038593 YFMWAGWSVIAHFE-MRVPVSSYSA-N 306.620 5.188 30 20 DKED C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 535498844 XJYPMFZXVCSIMI-HXUWFJFHSA-N 311.469 5.242 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1 537016005 STAFQFYHBYJNQV-KRWDZBQOSA-N 312.416 5.076 30 20 DKED CCC(C)(C)OCc1ccccc1NCCCC(C)(C)C#N 541799348 FMILTBCWAFOULX-UHFFFAOYSA-N 302.462 5.134 30 20 DKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2s1 776075427 XQFBVRPMZHEORS-KBPBESRZSA-N 314.454 5.079 30 20 DKED N#CCc1ccc(NC(=O)c2ccc(C3CCCCC3)cc2)cc1 15030149 WPCQBCMMVWVFFV-UHFFFAOYSA-N 318.420 5.053 30 20 DKED CC[C@H](N[C@@H](c1ccc(F)c(C)c1)C1CC1)c1ccc(C#N)cc1 447583582 CACWCXIOGOZNNK-LEWJYISDSA-N 322.427 5.198 30 20 DKED CC#CCCCC(=O)Nc1cc(Cl)ccc1-c1ccc(C)o1 477893834 ICXBEPXQYINPKY-UHFFFAOYSA-N 315.800 5.041 30 20 DKED CCCCC(CC)=NNc1nc(C(F)(F)F)nc2ccccc12 732923375 AEGFPLOROMMHQD-UHFFFAOYSA-N 324.350 5.017 30 20 DKED CC(C)C[C@@H](NCc1cc(C#N)cs1)c1ccc(Cl)cc1 236620132 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N#C[C@H](Cc1ccccc1)Sc1nc(-c2ccccc2)cs1 855897168 FZWXVHYOFCRDCD-INIZCTEOSA-N 322.458 5.037 30 20 DKED Cc1cc(C)c(C(=O)/C=C\c2ccc3ncccc3c2)cc1C 916155904 LUKHFSLMJXKPRM-CLFYSBASSA-N 301.389 5.056 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccccc1 189883059 RKVGTPKSHXSJGC-KRWDZBQOSA-N 321.464 5.356 30 20 DKED CC(C)Oc1cccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)c1 303472016 NHAXDCJYDWAIEZ-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED CCOc1ccccc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 340447185 PFJAWFUPHOQSBY-PXNSSMCTSA-N 322.452 5.171 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(C)c(C)cc1Cl 410344742 LLNGGUJVXQWFIY-UHFFFAOYSA-N 313.828 5.328 30 20 DKED C[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1cccc(C#N)c1 426321381 CLMHKIMMAQQSJR-NHYWBVRUSA-N 316.857 5.001 30 20 DKED C=CCC[C@H](NC(=O)c1ccc(C(F)F)cc1)c1ccccc1 435301088 ICHZBEWDXQEUKD-KRWDZBQOSA-N 315.363 5.062 30 20 DKED CC[C@@H](NCCCCC(C)(C)C#N)C(C)(C)c1ccccc1 444691519 ZSTSJPKCDAMDQF-GOSISDBHSA-N 300.490 5.052 30 20 DKED CC(C)(C#N)CCCNC(C)(C)c1ccc(Cl)c(Cl)c1 472247294 PBWNMKKAHLFSOM-UHFFFAOYSA-N 313.272 5.148 30 20 DKED CC(C)(C#N)CCCSCc1cccc(Br)c1 486120589 GAKAEEZDYZCAGH-UHFFFAOYSA-N 312.276 5.012 30 20 DKED CC(C)(C#N)CCCN(Cc1ccc(F)cc1Cl)CC1CC1 511068143 YWQAXXBLFMFNTJ-UHFFFAOYSA-N 322.855 5.021 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)o1)C1CCC(C)CC1 610270979 MIKDPFOPNHQQLN-AEJJIKPWSA-N 322.452 5.117 30 20 DKED N#Cc1ccc(CN2CCC[C@@H]2c2cccc3ccccc23)cc1 60040210 CNFCHVCMEHLFFK-JOCHJYFZSA-N 312.416 5.049 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C(C)C 475557380 ANZFIPTVARVINU-SFHVURJKSA-N 314.473 5.191 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC[C@H](CC)CC1 476123661 WNNBNQQJRKJOCE-SAABIXHNSA-N 313.485 5.693 30 20 DKED CC(C)C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccs1 512668091 SQRGQFGDNLNIFR-DYVFJYSZSA-N 316.445 5.197 30 20 DKED CCCN(C(=O)CCCCCC#N)c1cccc2ccccc12 588901295 CWLBPDUAEZQZAF-UHFFFAOYSA-N 308.425 5.057 30 20 DKED CC[C@H](C#N)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 593509678 GEZFXCIFWKMRLI-LSDHHAIUSA-N 324.449 5.028 30 20 DKED CC(C)c1nc(CS[C@H](C)c2ccc(C#N)cc2)cs1 609825395 VDKSHKBESLYLTR-GFCCVEGCSA-N 302.468 5.133 30 20 DKED Cc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)s1 727974870 QTFJVIGKBHIDSU-CSKARUKUSA-N 311.431 5.076 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H]2CCCCC2(C)C)n1 752513571 VEKYWZSPFMIWNB-KBPBESRZSA-N 318.486 5.049 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(CCCC)cc1)c1ccncc1 766018062 FRDBZSGMHCWNQI-UWJYYQICSA-N 308.469 5.392 30 20 DKED CSc1ccc(C(=O)/C=C/c2ncc(C(C)(C)C)s2)cc1 790603922 PMINEXNTBIHGJH-MDZDMXLPSA-N 317.479 5.059 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C\c1csc(-c3cccs3)n1)C2 303299123 OCVQWVJCFPNEMM-LCYFTJDESA-N 323.442 5.002 30 20 DKED CCN(Cc1ccc(C(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 461393987 DFLYLDKBLHPMQO-CQSZACIVSA-N 314.379 5.079 30 20 DKED CC(C)CC[C@@H](NC(=O)CCCCC#N)c1ccc(Cl)cc1 593964052 DARJYVDWCMYJIV-QGZVFWFLSA-N 320.864 5.017 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1Cl 189909387 BGYGGDDCJNUVOM-UHFFFAOYSA-N 313.828 5.444 30 20 DKED C[C@@H](Nc1ccc(Cl)c(C(F)(F)F)c1)c1cccc(C#N)c1 315684148 SIJLMGLNCZZZKX-SNVBAGLBSA-N 324.733 5.404 30 20 DKED CC[C@H](N[C@H](c1ccc(F)c(C)c1)C1CC1)c1ccc(C#N)cc1 447583587 CACWCXIOGOZNNK-SFTDATJTSA-N 322.427 5.198 30 20 DKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)CC(C)(C)CCC#N 507668535 JBFBQCZRKDYJRW-GFCCVEGCSA-N 313.272 5.316 30 20 DKED C[C@H](NCCCC#N)c1ccc(-c2ccc(Cl)cc2F)s1 541738827 SNRYEBFXVTXASL-NSHDSACASA-N 322.836 5.162 30 20 DKED Cc1cc(C)c(C(=O)/C=C/c2nccc3ccccc23)cc1C 740764342 RSZZPJVXODZZGA-CMDGGOBGSA-N 301.389 5.056 30 20 DKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccccc1Cl 741840254 LUMYIAFALXQQLP-SREVYHEPSA-N 300.716 5.121 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1cccc2ccccc12 782301361 LKKIUDHKLHZTSC-ZHACJKMWSA-N 305.402 5.070 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1 195656650 BSKIUOBBVNVJIJ-AWEZNQCLSA-N 314.816 5.196 30 20 DKED CC(C)(C#N)CCCCSCCOc1ccccc1Cl 435880249 IFNTYOWPLHPGNM-UHFFFAOYSA-N 311.878 5.172 30 20 DKED CCSc1ccc([C@@H](C)NCCCCC(C)(C)C#N)cc1 444679796 CJADXRKMSLQRJP-OAHLLOKOSA-N 304.503 5.169 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1 538508364 JUWQEYZAEIPHGO-XIKOKIGWSA-N 316.807 5.153 30 20 DKED C[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1cccc(C#N)c1 539495698 DBZNRJYCTCNXJN-RYUDHWBXSA-N 319.235 5.277 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 744016056 IEKZTNZOLLLURF-ZIAGYGMSSA-N 314.454 5.079 30 20 DKED CC[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 37748391 TVMZCJCSQYNMRR-QGZVFWFLSA-N 319.235 5.106 30 20 DKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2ccccc2)n1 301947232 XZBGMXZJRFPUDP-NSHDSACASA-N 322.355 5.134 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc21 448027211 LWRDLQUOPOLRAP-IWMITWMQSA-N 304.437 5.093 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(-c2ccccc2)cc1C 519192825 SBCVIGUQHLCEOA-UHFFFAOYSA-N 308.425 5.092 30 20 DKED C=CCCCN(C)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 670055259 QTRXDSAYBXWCOR-UHFFFAOYSA-N 308.853 5.067 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1cccc(CC)c1 732624488 BDBGHIUJXSMLHM-UHFFFAOYSA-N 316.514 5.014 30 20 DKED CC[C@@H](C)C(C)=NNc1nc2cc(C(F)(F)F)ccc2s1 743445468 VYWCQOIWRUUXOG-MRVPVSSYSA-N 315.364 5.149 30 20 DKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 753389676 HCSJGESVHNJHSP-INIZCTEOSA-N 308.425 5.018 30 20 DKED CCCCCCCC[S@](=O)Cc1nc(C(C)(C)C)cs1 790138813 HROWXOWPTJAJNW-FQEVSTJZSA-N 315.548 5.050 30 20 DKED O=C(/C=C/c1ccnc2ccccc12)c1ccc2ccccc2c1 164511361 NNJSEFAIWNMCSV-VAWYXSNFSA-N 309.368 5.284 30 20 DKED CCC[C@H](NCCCCC(C)(C)C#N)c1ccc(F)cc1F 444677728 URTLGINZDMEOKR-KRWDZBQOSA-N 308.416 5.116 30 20 DKED CCc1cccc(CNc2ccccc2SC[C@H](C)C#N)c1 469126908 UKIALCOEWUVPIA-OAHLLOKOSA-N 310.466 5.113 30 20 DKED N#CCc1ccc(N[C@@H]2CCc3c(Cl)cc(Cl)cc32)cc1 507806503 FILPGKRWVPFLBE-QGZVFWFLSA-N 317.219 5.159 30 20 DKED CC(C)[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 565568335 BOBHVZBITFNWSL-UXHICEINSA-N 324.855 5.186 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](F)c1ccccc1 789719695 IEGGJFQRWOZQST-GOSISDBHSA-N 311.400 5.188 30 20 DKED Cc1ccccc1[C@@H](NCc1ccc(C#N)cc1Cl)C(C)C 439450400 KSOPDGWTOGYPCB-IBGZPJMESA-N 312.844 5.007 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@H]1c1cccc(Cl)c1 444600858 WUKJPZTVJCVRGI-KRWDZBQOSA-N 304.865 5.197 30 20 DKED Cc1ccccc1[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C(C)C 539608286 CFPFEWJDKBESPN-MGPUTAFESA-N 310.416 5.054 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550829094 AVJXVFRLACUPLI-GCJKJVERSA-N 320.480 5.896 30 20 DKED C[C@H](S[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C#N)cc1 609825624 IYCFESUOUKUAKI-QWHCGFSZSA-N 312.394 5.022 30 20 DKED C[C@H](Nc1ccc2nc(C3CC3)sc2c1)c1ccc(C#N)cc1 610341832 YYJYQEAORDDKGF-LBPRGKRZSA-N 319.433 5.218 30 20 DKED C#CCCCCCC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1 780676344 LWPIJNXUJFACBI-HXUWFJFHSA-N 311.469 5.057 30 20 DKED CC(CCCCC#N)=NNc1ccc(Cl)c(C(F)(F)F)c1 844606745 GYIAHPFIVPSKOA-UHFFFAOYSA-N 317.742 5.231 30 20 DKED CC(=NNc1cc(C)cc(C)c1)c1sc(C(C)(C)C)nc1C 915111972 RZCDQBGLPBGTIK-UHFFFAOYSA-N 315.486 5.202 30 20 DKED N#CCC[C@H](Nc1ccnc2ccc(Cl)cc12)c1ccccc1 301759692 AWSIPLVGYFFDED-KRWDZBQOSA-N 321.811 5.345 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2 427865330 NIQSNPDOJKUSPX-QKKBWIMNSA-N 322.427 5.159 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C)(C)CC1 475551969 VWXFUSPVCSSKPS-UHFFFAOYSA-N 314.473 5.192 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 519172721 MICQPWSBAISPDN-OAHLLOKOSA-N 320.502 5.316 30 20 DKED C=CCCC[C@@H](C)N[C@H](C)c1cccc(OCc2ccccn2)c1 539257194 QVZJPCYUSDJIRK-QZTJIDSGSA-N 324.468 5.056 30 20 DKED CCCC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC)cc1 539496770 UMYKQUDNLQZWRS-IERDGZPVSA-N 322.452 5.149 30 20 DKED N#Cc1c(Cl)cccc1SCc1cccc2cccnc12 542103240 HJKQUMBQSIZNGL-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 557273502 LLGGZMGNUFBHIT-VGSWGCGISA-N 318.464 5.261 30 20 DKED CC(C)[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 574611238 HGMWFEHPFHQUCA-UXHICEINSA-N 324.855 5.186 30 20 DKED Cc1ccc2c(c1)C/C(=C\c1cnc(-c3cccs3)s1)C2=O 751515398 YOPRYWWMYCIUPC-UKTHLTGXSA-N 323.442 5.002 30 20 DKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1nccc2ccccc12 792094490 DZGXQBKUSCFJRE-QGZVFWFLSA-N 308.425 5.018 30 20 DKED CCCC[C@@H](CC)CC(CC)=NNc1ccc(C(=O)O)c(F)c1 1776077196 YYTHFSQGPYIVLJ-CYBMUJFWSA-N 322.424 5.308 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CC(C)C 191440361 XLPMVRIDROGVJC-UHFFFAOYSA-N 302.462 5.048 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1 358344684 XDYFMXUIXNESCI-RBUKOAKNSA-N 312.844 5.426 30 20 DKED N#CC1(CCSCc2nc(C3CC3)cs2)CCCCC1 419458822 DMZAZWOYRSSLFK-UHFFFAOYSA-N 306.500 5.118 30 20 DKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccccc1)c1ccccc1 435107126 RYYULDSZSLQTSJ-YLJYHZDGSA-N 322.452 5.097 30 20 DKED C=C(C)COc1cc(CNc2ccc3ccoc3c2)ccc1OC 443009251 JVHRQDLARMPGBR-UHFFFAOYSA-N 323.392 5.008 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2c(C)cccc2CC)CCCC1(C)C 444819329 RXFWUSQXQNRDOA-KRWDZBQOSA-N 314.473 5.156 30 20 DKED Cc1ccccc1[C@H](C)Nc1ccccc1SC[C@H](C)C#N 479765904 KQESMCAJTDJCNL-ZBFHGGJFSA-N 310.466 5.420 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@@H](C)c1cccc(C#N)c1 600848803 JSRBITDQVKTVQV-INIZCTEOSA-N 324.493 5.681 30 20 DKED C[C@@H](CCC(C)(C)C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571916 XCHQMEFUHXXITE-STQMWFEESA-N 320.502 5.079 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 186452819 IHRPWESFPNWUJI-MEDUHNTESA-N 322.424 5.006 30 20 DKED N#Cc1cc(F)ccc1N[C@@H](c1ccccc1)c1ccc(F)cc1 325286154 VLRDBVKHLFZQHG-FQEVSTJZSA-N 320.342 5.038 30 20 DKED Cc1nc(C(C)(C)/N=C(/O)c2cc(C(C)C)oc2C)sc1C 330609255 NQGBAICIYUGLAK-UHFFFAOYSA-N 320.458 5.025 30 20 DKED C[C@H](NCC1CCC(C#N)CC1)c1cc2cc(Cl)ccc2o1 442867694 MAKDHUZAUCEJKU-HSBZDZAISA-N 316.832 5.067 30 20 DKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(C3CCC3)c2)cc1 462418036 GKEBMEQUSBDIRC-UHFFFAOYSA-N 318.420 5.008 30 20 DKED CCC(C)(C)CC(=O)Nc1sc(-c2ccccc2)cc1C#N 466992897 SLEIEUFWVYVSMT-UHFFFAOYSA-N 312.438 5.052 30 20 DKED CC[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)s1 618802368 JBHWOGTVGPIAGP-HUUCEWRRSA-N 316.857 5.001 30 20 DKED Cc1cc(C#N)ccc1CSC1=Nc2ccccc2CS1 776795357 OZDZKBGUJZSIDC-UHFFFAOYSA-N 310.447 5.034 30 20 DKED CCc1ccc([C@H](CC)N[C@@H](CCCC#N)c2ccccc2)cc1 340460950 YPBUBMBBUJDHML-VXKWHMMOSA-N 320.480 5.725 30 20 DKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc2ccccc12 439461357 ZZGHEKJOHSVTEY-CQSZACIVSA-N 320.823 5.216 30 20 DKED CC[C@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc(C#N)cc1 447531497 PTKQGFWOVSUZRY-SFTDATJTSA-N 304.437 5.140 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1ccccc1F)c1ccc(F)c(F)c1 480684640 ULTMXAJULPXDIR-KPZWWZAWSA-N 305.343 5.072 30 20 DKED CCCCCCCC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 732029522 KEBHKMOFELEPQV-INIZCTEOSA-N 307.865 5.016 30 20 DKED C[C@@H](C=NOc1ccccc1C(F)(F)F)c1ccc(F)cc1 756895098 HLMMRDFKZMVRGA-NSHDSACASA-N 311.278 5.013 30 20 DKED CSc1ccc(/C=C\C(=O)c2ccc(Cl)s2)s1 798232345 RTOKVTOBAGCLSH-RQOWECAXSA-N 300.857 5.081 30 20 DKED CC(=NNc1cc(C)ccc1C)c1sc(C(C)(C)C)nc1C 915111774 NTBGQPSRUAHVPV-UHFFFAOYSA-N 315.486 5.202 30 20 DKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1776697244 CHNUHOLBGCNXSZ-GMMCIKNFSA-N 322.404 5.103 30 20 DKED C[C@@H](Nc1cc(Cl)cc(Cl)c1)c1ccc(OCC#N)cc1 37199530 DRKVPKUWNMKHPL-LLVKDONJSA-N 321.207 5.069 30 20 DKED CCCCCCCC(=O)N1CC=C(c2c[nH]c3ccccc23)CC1 900675206 NBTDYBKPYZTKAT-UHFFFAOYSA-N 324.468 5.144 30 20 DKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)c(C)o1 1776784595 MYFSYAIQGHPZFI-UHFFFAOYSA-N 323.477 5.249 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)cc1 189898471 VUUNPJXIKXRYAD-UHFFFAOYSA-N 307.437 5.028 30 20 DKED CC(C)c1cnc(-c2ccc(NC3CCC(C)(C#N)CC3)cc2)o1 449056417 PIKQVGDDDPHFTG-UHFFFAOYSA-N 323.440 5.349 30 20 DKED CC(C)c1cnc(S[C@H](C)c2ccc(C#N)cc2)n1C(C)C 523497596 UJTNEUMOBWRAKU-CQSZACIVSA-N 313.470 5.312 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cc2ccccc2s1 525955993 LGKLNVCLRMOOII-OLZOCXBDSA-N 324.424 5.324 30 20 DKED C[C@H](Sc1cccc(Cl)c1C#N)c1ncc(C(C)(C)C)o1 537844540 LXBFKXSCENFECP-JTQLQIEISA-N 320.845 5.350 30 20 DKED CCC(C)(C)OCc1ccccc1NCC(C)(C)CCC#N 543617185 UJFHXXJEWPMQGV-UHFFFAOYSA-N 302.462 5.134 30 20 DKED C[C@@H](Nc1cc(Cl)c(Cl)cc1F)c1cccc(C#N)c1 600853917 JUOKLLWNHSBWPB-SECBINFHSA-N 309.171 5.177 30 20 DKED CC[C@H](N[C@@H](CC1CC1)c1ccccc1)c1ccc(C#N)cc1 618573940 QVBWBZAIHFBYCY-SFTDATJTSA-N 304.437 5.140 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 734079479 QJOFDEXUNVHVOA-AEFFLSMTSA-N 320.436 5.018 30 20 DKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1ccc2ccccc2c1 742429346 MNTFLYLSWOQLMM-SEYXRHQNSA-N 324.383 5.126 30 20 DKED CCSc1ccc(C(=O)/C=C/c2scnc2C2CC2)cc1 782347660 MGBWGNGWLLUZJB-MDZDMXLPSA-N 315.463 5.029 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@@H]1c1cccs1 885027273 YFMJEWRNPHFSCT-MRXNPFEDSA-N 307.503 5.552 30 20 DKED CCC[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 154329555 JGXXMIALUOWSSO-CABCVRRESA-N 318.486 5.092 30 20 DKED C[C@@H](N[C@H](C)c1cccc2ccccc12)c1cccc(C#N)c1 192943676 BXTLHJWEYUGYIJ-HZPDHXFCSA-N 300.405 5.123 30 20 DKED Cc1noc(C)c1C(C)(C)/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329298292 UFGPDPIOTQEYQB-ARFHVFGLSA-N 318.461 5.090 30 20 DKED N#CCCC[C@H](NCc1ccc(Cl)cc1F)c1ccccc1 353912710 FXYWIWQGWLQZDT-SFHVURJKSA-N 316.807 5.004 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(SC)cc1)c1ccc(C#N)cc1 467432714 MHWYJCHXFQJUDI-AUUYWEPGSA-N 310.466 5.082 30 20 DKED Cc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1C 516199291 XLYYEUSPRWJUDT-WIYYLYMNSA-N 306.453 5.389 30 20 DKED CCCc1cccc(CN[C@@H](CCCC#N)c2ccccc2)c1 552313208 UTJGHWSCSSYERK-NRFANRHFSA-N 306.453 5.164 30 20 DKED C/C(=C/C(C)(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 588501501 SNNDFRFZUMQELS-WUFNSSIPSA-N 316.470 5.012 30 20 DKED CCCCCCCCC(=O)N(C)[C@@H]1CCCc2nc(C)sc21 732036215 RVPZCRVYAKSEHA-MRXNPFEDSA-N 322.518 5.038 30 20 DKED CCCCCCCC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1 742964431 AKOXXHHGGRXUNK-RDJZCZTQSA-N 305.462 5.248 30 20 DKED CCCCCCC[C@@H](NCc1nnc(C)s1)c1ccccc1 780744109 KGCVZFXPFVPHST-QGZVFWFLSA-N 317.502 5.038 30 20 DKED CC(=NNc1ccc2ccccc2n1)c1oc2ccccc2c1C 916286707 PTYGNHUFDQNNGW-UHFFFAOYSA-N 315.376 5.126 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1F 90665878 JCJCEUFYBBAZJN-RTBURBONSA-N 314.379 5.051 30 20 DKED Cc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1C 195656642 VXTNAKRVXWMPDY-KRWDZBQOSA-N 308.425 5.159 30 20 DKED N#CCCC[C@H](NCc1cc(F)cc(Cl)c1)c1ccccc1 353911813 CWWXFDWRCTYBDQ-SFHVURJKSA-N 316.807 5.004 30 20 DKED CCSc1ccc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)cc1 520294069 QFHJZWFCDIWMST-XOBRGWDASA-N 322.477 5.008 30 20 DKED CSc1ccc(C)c(NCc2ccccc2C(C)(C)C#N)c1 539521168 QJWBUNJJWYYOMY-UHFFFAOYSA-N 310.466 5.130 30 20 DKED CCSc1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551556189 HQUFALVUJGAGEI-OAHLLOKOSA-N 322.477 5.010 30 20 DKED CCCCC[C@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)C(C)C 756300948 SWHNWEPZYJUSQR-GJZGRUSLSA-N 320.502 5.295 30 20 DKED CC1(C#N)CCC(N[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 414253501 ZIZXEQKKBNYMMA-WEOZKBJRSA-N 316.876 5.038 30 20 DKED C[C@@H](c1ccc(CNc2cccc(CC#N)c2)cc1)C(F)(F)F 453135449 AQSBRJVMJQBEAB-ZDUSSCGKSA-N 318.342 5.031 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC2CCC1CC2 506046173 RQJQSTZVELZVDY-RJYAGPCLSA-N 311.469 5.303 30 20 DKED Cc1ccccc1[C@@H](NCc1ccccc1C(C)(C)C#N)C(C)C 538160437 XRJDVQJVVRWLRP-NRFANRHFSA-N 320.480 5.283 30 20 DKED C[C@@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1cccc(C#N)c1 538407917 OWHIFMWRUNNUTR-FOIQADDNSA-N 304.437 5.022 30 20 DKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(CC#N)cc2)cc1 542260045 VJZTXXFISWHWEO-MRXNPFEDSA-N 324.493 5.104 30 20 DKED Cc1cc(-c2ccccc2)ccc1N[C@@H](C#N)Cc1ccccc1 603585145 ODMJRVRXWHBOCY-OAQYLSRUSA-N 312.416 5.209 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@H](C)c1ccc(C#N)cc1 609825103 GLFOIKUQALGZDP-CYBMUJFWSA-N 314.816 5.172 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2coc3ccccc23)s1 747705058 KAWKHHYTEGXEFM-CMDGGOBGSA-N 311.406 5.083 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2ccc(C(F)(F)F)s2)c1 761480259 QXCVXGKDNNYFSN-ZZXKWVIFSA-N 314.303 5.111 30 20 DKED C[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)C1CCCCC1 792102920 KAZTYQWVHOUZNI-BEFAXECRSA-N 320.436 5.018 30 20 DKED CCCCCCCC(=O)Nc1ccc2oc(C3CC3)nc2c1 914767896 NEHFASYZPZASKA-UHFFFAOYSA-N 300.402 5.004 30 20 DKED Cc1nc(-c2cccc(N[C@@H](C)c3cccc(C#N)c3)c2)oc1C 183014409 LABGBMLBZAXITP-AWEZNQCLSA-N 317.392 5.003 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCCc2cc(F)ccc21)c1ccccc1 340450325 XEHRPJUUCADNJX-NHCUHLMSSA-N 322.427 5.228 30 20 DKED N#C[C@H](Nc1ccccc1CCC(F)(F)F)C1CCCCC1 464789837 OZTICTJFJSOYGU-INIZCTEOSA-N 310.363 5.066 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccc(C)s1)c1ccc(F)c(F)c1 480672715 ZVQNVMPREKCPBX-PXAZEXFGSA-N 307.409 5.303 30 20 DKED C[C@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)c(F)c1 495413889 FTNMLVTXKYBAKR-YCRPNKLZSA-N 322.427 5.279 30 20 DKED C=CCCC(=O)N[C@H](c1ccccc1)c1cccc2ccccc12 517667797 GSWPHUOHNZPYOR-JOCHJYFZSA-N 315.416 5.012 30 20 DKED CC1(C)C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 520850942 MZILGMGQJGDVJK-LEWJYISDSA-N 318.464 5.434 30 20 DKED C[C@H](Sc1cccc(Cl)c1C#N)c1nc2ccccc2o1 543031571 IIZLJXDIRDJUSO-JTQLQIEISA-N 314.797 5.206 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cnc(C2CCC2)s1 760261532 DMJXWPAFWHVCBR-KTKRTIGZSA-N 322.433 5.096 30 20 DKED C=CC[C@H](N[C@H]1CCSc2cc(C)c(C)cc21)c1ccncc1 779023702 HTFMHFSFBSQCPS-OALUTQOASA-N 324.493 5.142 30 20 DKED CSc1ccc(/C=C\C(=O)c2cc3ccccc3o2)s1 798232657 ZEMXTZUWGMBLGB-VURMDHGXSA-N 300.404 5.112 30 20 DKED CCOc1cccc2cc([C@@H](C)Nc3cccc(F)c3C#N)oc12 61174347 LVUGCDLMMUJLET-GFCCVEGCSA-N 324.355 5.015 30 20 DKED C=CCC[C@@H](NCc1ccc2cc(OC)ccc2c1)c1ccco1 514086948 DQSWKPPYYIFOJO-HXUWFJFHSA-N 321.420 5.239 30 20 DKED C=CCCC[C@@H](C)Sc1nnc(-c2ccccc2Cl)o1 540371276 DUFURTCCFZTICH-LLVKDONJSA-N 308.834 5.227 30 20 DKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nc2ccccc2o1 540858842 PXKSXRHBECUCKH-JTQLQIEISA-N 314.797 5.206 30 20 DKED CC(C)(C#N)CCOc1cc(C(F)F)nc2ccc(Cl)cc12 596281576 NTFSGRJBHZNPBL-UHFFFAOYSA-N 324.758 5.144 30 20 DKED CCCCCC1=C(C)CCC1=NNc1ncnc2sccc12 725819368 RZQYHLKWKYYFHL-UHFFFAOYSA-N 314.458 5.150 30 20 DKED C#CCCCSCC(=O)Nc1c(C(C)C)cccc1C(C)C 766737822 NEWLGJDHVDIQMW-UHFFFAOYSA-N 317.498 5.019 30 20 DKED N#Cc1ccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cc1 818260145 ULHRTFWBJJEVRD-KPKJPENVSA-N 315.397 5.183 30 20 DKED Cc1ccc(-c2ccncc2)cc1N[C@@H](C)c1ccc(C#N)cc1 118443285 YYLKKEXMVBXAFY-INIZCTEOSA-N 313.404 5.102 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(OCC#N)cc1 192990045 JHCJTMOCMVXJHM-JXFKEZNVSA-N 322.452 5.027 30 20 DKED N#CCCn1cc(-c2csc(C3CCCC3)n2)c2ccccc21 340148924 PKKXSXSMPHXYLE-UHFFFAOYSA-N 321.449 5.336 30 20 DKED C=CCN(CC=C)C(=O)Nc1cccc(Cl)c1SC(C)C 438254304 GIAVMIYZHOMVOS-UHFFFAOYSA-N 324.877 5.046 30 20 DKED C[C@H](SCCC(C)(C)C#N)c1ccc(OC(F)(F)F)cc1 463250317 KOHNQPKOXORURX-NSHDSACASA-N 317.376 5.319 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1cccc(F)c1)c1ccc(F)c(F)c1 480662862 KOGMBZMZVZMONL-KZULUSFZSA-N 305.343 5.072 30 20 DKED N#C[C@@H](Cc1ccccc1)Sc1cc(Cl)ccc1Cl 603452835 NJKMKABGLINCAE-CYBMUJFWSA-N 308.233 5.220 30 20 DKED C#CCCCCC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 773398552 CTUZMVCABYLVBK-SFHVURJKSA-N 319.448 5.067 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1cccc(C)c1C 799900796 PRUMWCNDKHXIEB-UHFFFAOYSA-N 310.466 5.231 30 20 DKED Cc1ccc(-c2nc(/C=C3\C(=O)c4ccccc4[C@@H]3C)co2)cc1 809156895 OPUIOJLTZAUUDK-KVMVOAJRSA-N 315.372 5.033 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)CC2 427870577 VMMLVCBLWAGRPG-SPLOXXLWSA-N 322.427 5.159 30 20 DKED CC(C)c1nc2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2s1 439572314 PSDCBVOCVSHNMZ-ZDUSSCGKSA-N 321.449 5.464 30 20 DKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc2ccccc2c1 512632248 YFQITNTZCNYBPD-GJZGRUSLSA-N 318.395 5.262 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2)s1)c1cccc(C#N)c1 237577314 INVZSURUNDZGMI-HNNXBMFYSA-N 318.445 5.138 30 20 DKED Cc1ccc(C)c([C@@H](C)Nc2cccc(OCCCC#N)c2)c1 321552861 FFBLGUJXTSYGFG-QGZVFWFLSA-N 308.425 5.159 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1 413741571 DDUQUAQBMIAONT-UXHICEINSA-N 319.448 5.281 30 20 DKED C[C@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(C#N)cc1 463904486 HYRSLOPLSJCJKB-YWZLYKJASA-N 324.443 5.525 30 20 DKED Cc1csc(-c2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2)n1 539735122 PEMJTWKMZGBPBD-AWEZNQCLSA-N 319.433 5.163 30 20 DKED CC(C)[C@@H](NCCCC(C)(C)C#N)c1ccc(Cl)cc1F 542919829 UUAFVHRDPRJKRB-MRXNPFEDSA-N 310.844 5.096 30 20 DKED CCOc1c(Cl)cc(NCC(C)(C)CCC#N)cc1Cl 767190763 JNUYATROGVEXEI-UHFFFAOYSA-N 315.244 5.134 30 20 DKED COc1cc(C(=O)/C=C/c2cc(Cl)cs2)ccc1SC 782325801 CRWVXUQOIMMYCI-SNAWJCMRSA-N 324.854 5.028 30 20 DKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568294 POKYHSACZBSCML-ZDUSSCGKSA-N 320.502 5.223 30 20 DKED CCOc1cccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1 815635543 FDRVTAPPFBTLGU-DYESRHJHSA-N 322.452 5.171 30 20 DKED CCCCCCCC(=O)N(c1ccccc1)c1nc(C)cs1 104983518 GBXSGMMMVLONPU-UHFFFAOYSA-N 316.470 5.477 30 20 DKED CCSc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 179236001 JOIABDVERJPUJN-HUUCEWRRSA-N 310.466 5.082 30 20 DKED N#CCC[C@H](Nc1ncc(-c2ccccc2)s1)c1ccccc1 301781395 JPYGSTFKHXMSEB-KRWDZBQOSA-N 319.433 5.267 30 20 DKED CCC[C@H](Nc1cccc(OCCCC#N)c1)c1ccsc1 443081395 VMFBBLXMUPCLLN-SFHVURJKSA-N 314.454 5.384 30 20 DKED C=C(C)CCNC(=S)Nc1c(C(C)C)cccc1C(C)C 840792417 LLZKGMQIAQZFDV-UHFFFAOYSA-N 304.503 5.186 30 20 DKED CCCCCCCCCN(C)C(=O)c1cc2ccsc2[nH]1 918685506 DGMFVTVVJPFION-UHFFFAOYSA-N 306.475 5.052 30 20 DKED CC(C)CC[C@@H]1CCC(=NNc2ccc(Cl)c(C(=O)O)c2)C1 1776033751 BZEPXSCVYFTVNZ-GFCCVEGCSA-N 322.836 5.042 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)s1 512642387 PDNTYDMNFCNRFX-QMTHXVAHSA-N 322.836 5.214 30 20 DKED N#Cc1csc(CN[C@@H](CC2CCCC2)c2ccccc2)c1 533104828 OJKZFOIANKGPIS-IBGZPJMESA-N 310.466 5.031 30 20 DKED CC(C)C[C@@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588382400 ZNHPWAZOLJOSGY-QGZVFWFLSA-N 320.864 5.017 30 20 DKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccccc3)s2)cc1 734303500 RLRLSYDVGOJFSF-QXMHVHEDSA-N 305.402 5.015 30 20 DKED O=C(/C=C/c1cccc2cnccc12)c1ccc2ccccc2c1 782879256 DPRWBXAZWMQXDX-ZHACJKMWSA-N 309.368 5.284 30 20 DKED N#Cc1ccc(CNc2cccc(Oc3ccccc3)c2)s1 317443683 YHYKFNNJTHHMDS-UHFFFAOYSA-N 306.390 5.024 30 20 DKED Cc1cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)s1 340451871 PXAYDCSJTVNRHL-HNAYVOBHSA-N 312.482 5.451 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1 444682026 YEVJWKDNRXWJKM-ZDUSSCGKSA-N 312.379 5.076 30 20 DKED CCCC[C@@H](CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 463772500 ATEDEYBTGGIUBA-HUUCEWRRSA-N 318.486 5.236 30 20 DKED C[C@@H]1CCC[C@H](CCSCCCC2(C#N)CCOCC2)C1 508588658 NTXNEATVYPWIMX-IAGOWNOFSA-N 309.519 5.037 30 20 DKED N#CCCC[C@H](N[C@@H]1CCc2cc(Cl)ccc21)c1ccccc1 550829554 XWFGJQHMYPKRFO-VQTJNVASSA-N 324.855 5.352 30 20 DKED C=CCC[C@@H](NCc1ccc(SC)s1)c1ccccc1 554972257 HIRRVVQMRHMXIX-MRXNPFEDSA-N 303.496 5.267 30 20 DKED C[C@H](CCN[C@H](CCCC#N)c1ccccc1)c1ccccc1 574791041 HXRYSFKADPOHCT-WIYYLYMNSA-N 306.453 5.205 30 20 DKED C=CCCC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 588034371 AZJRZJFJCUDKRQ-UHFFFAOYSA-N 301.773 5.037 30 20 DKED Cc1ccccc1C(=O)/C=C\c1nc(-c2ccccc2)cs1 727976271 OQKIIRXRPDTBEK-QXMHVHEDSA-N 305.402 5.015 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1 732971727 ZPTPNHJJPIWXJH-SFHVURJKSA-N 323.427 5.379 30 20 DKED CC(=NNc1ccccc1Cl)c1ccc(-c2ccncc2)cc1 745193211 JKBTYPHQEPQCMH-UHFFFAOYSA-N 321.811 5.238 30 20 DKED O=C(/C=C\c1cncs1)c1ccc(SC2CCCC2)cc1 767720668 HWZFASAKBUFNHN-KTKRTIGZSA-N 315.463 5.074 30 20 DKED N#CC1(/C(O)=N/[C@@H]2CCC[C@H](c3ccccc3)C2)CCCCC1 330202918 ZYYNBOWNOPMSOD-ZWKOTPCHSA-N 310.441 5.143 30 20 DKED CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(C)(C#N)CC1 445415967 GIEJTTOYLFLTGL-OAHLLOKOSA-N 311.256 5.070 30 20 DKED CC1(C)CCC[C@@H](CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)C1 756518991 LNORBECQCDVTKN-RDJZCZTQSA-N 320.436 5.018 30 20 DKED C[C@H](SCc1cc(Cl)nc(Cl)c1)c1ccc(C#N)cc1 808359609 DOOZUUKOJSJAEI-JTQLQIEISA-N 323.248 5.254 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1csc2ccccc12 769798713 XOSNJYDOJOZVHL-CQSZACIVSA-N 300.471 5.272 30 20 DKED C=CC[C@H](N[C@@H]1C[C@H](C(C)C)c2ccccc21)c1ccncc1 774185419 BOQJGSIOXFLXCI-QHAWAJNXSA-N 306.453 5.173 30 20 DKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 776092260 ASGNSUZGKUSYER-UONOGXRCSA-N 306.475 5.049 30 20 DKED O=C(/C=C/c1ccc2ncccc2c1)c1cccc2ccccc12 916134828 IWBFONJDCTZGNR-ACCUITESSA-N 309.368 5.284 30 20 DKED CC(C)(C#N)CCCCSCc1csc(-c2ccoc2)n1 435884364 RFWKWNHJVMABGK-UHFFFAOYSA-N 320.483 5.356 30 20 DKED CN(CCCCC(C)(C)C#N)Cc1ccc(Cl)c(Cl)c1 444600944 XUCBQROLORCCPA-UHFFFAOYSA-N 313.272 5.145 30 20 DKED CC[C@H](N[C@@H](c1ccc(C)cc1)C1CC1)c1ccc(C#N)cc1 447547865 DUIJIQROAOQQJB-SFTDATJTSA-N 304.437 5.059 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cscc1C#N 459806724 CRZILVAJNDPXCV-UHFFFAOYSA-N 312.438 5.119 30 20 DKED N#Cc1c(F)cccc1CNc1cccc(-c2cccs2)c1 600849499 OEEOXDJHTBHNBC-UHFFFAOYSA-N 308.381 5.038 30 20 DKED CC[C@H](C)Sc1ccc(N[C@H](C#N)Cc2ccccc2)c(C)c1 604526572 OCLLPYUUJKGRPD-WMZOPIPTSA-N 324.493 5.432 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C/c1cnc(-c3cccs3)s1)C2 751513747 NOVOXXGRMDFKCR-UKTHLTGXSA-N 323.442 5.002 30 20 DKED CCCC(C)(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 426322178 HKBXELAYGZRPQH-CQSZACIVSA-N 318.486 5.236 30 20 DKED CC[C@H](C)[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462751736 BFGMYHONWHYJHS-LIRRHRJNSA-N 312.844 5.089 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccc2c(c1)CCC2 486051777 LSEPWSIKQSBWNL-OAHLLOKOSA-N 322.477 5.182 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1F 512630012 LENDNXRROQSOBD-QVKFZJNVSA-N 322.427 5.279 30 20 DKED C[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)c(F)c1 525955994 LGKLNVCLRMOOII-QWHCGFSZSA-N 324.424 5.324 30 20 DKED Cc1ccccc1[C@@H](N[C@@H](C)c1cccc(C#N)c1)C(C)(C)C 540592174 UEFZTYROKPPWQG-OXJNMPFZSA-N 306.453 5.305 30 20 DKED C[C@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)c1ccc(C#N)cc1 561454074 DOSRVHVRFZLMAN-YCRPNKLZSA-N 322.427 5.279 30 20 DKED Cc1ccccc1[C@@H](Sc1ccc(C#N)cn1)c1ccccc1 603504977 NUUBKRHMFRAPRG-FQEVSTJZSA-N 316.429 5.143 30 20 DKED C[C@H]1/C(=C/c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 809155868 HCMPDGJUHLHPLV-OUZNOSRWSA-N 323.442 5.255 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1coc2ccccc12 926478756 CNMRSWPHWBXWDD-JXFKEZNVSA-N 318.420 5.519 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CCC)C(C)C 476158857 ROQIQEVEFDNJAH-GOSISDBHSA-N 301.474 5.549 30 20 DKED C=CCCc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccco1 505051190 IVGJELQKKZOINC-OAHLLOKOSA-N 324.424 5.156 30 20 DKED C[C@H](N[C@H](c1cccc(F)c1)C1CCCC1)c1ccc(C#N)cc1 540593396 IAIXAZORSMNAMR-BTYIYWSLSA-N 322.427 5.279 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc21 555000739 WVDPFZGTIQDSSU-BAGYTPMASA-N 316.448 5.020 30 20 DKED CC(C)(C#N)CCCOc1c(Cl)cc(Cl)c2cccnc12 577427037 RWJFXYWYVJAHHO-UHFFFAOYSA-N 323.223 5.250 30 20 DKED Cc1cc(Cl)c2ccccc2c1NC(=O)CCCCCC#N 588961876 TVITUOFIRTYDDP-UHFFFAOYSA-N 314.816 5.214 30 20 DKED C[C@@H](CC#N)Sc1ccccc1N[C@H](C)c1ccccc1F 600847564 VFUSLIYDFNBCMD-UONOGXRCSA-N 314.429 5.393 30 20 DKED C[C@H](Nc1ccc(COC(C)(C)C)cc1)c1cccc(C#N)c1 611475534 PSYSXPFGOIKAGX-HNNXBMFYSA-N 308.425 5.046 30 20 DKED O=C(/C=C/c1ccc2cnccc2c1)c1cc2ccccc2s1 782350642 BZHDTLJVCLAPGC-SOFGYWHQSA-N 315.397 5.346 30 20 DKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1cncs1 799891668 AUSBSLCFFPQYIU-VEQVDCDKSA-N 323.339 5.004 30 20 DKED CCCCCCCCC(=O)Nc1cccc(-c2cnco2)c1 918651900 UJQXZEOMJVNUFE-UHFFFAOYSA-N 300.402 5.031 30 20 DKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 303752288 IGQDHMGJMDWUHD-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(O)c(CC)c1 487314919 XCYOPXDDOOIXCE-UHFFFAOYSA-N 323.436 5.059 30 20 DKED C=CCCC(=O)N[C@@H](C)c1ccccc1-c1ccc(Cl)cc1 523501323 UYDNPYUBRTXOGG-AWEZNQCLSA-N 313.828 5.150 30 20 DKED Cc1cccc(C)c1CNc1ccccc1SC[C@@H](C)C#N 610000167 HZTYOUUSBNNUMH-AWEZNQCLSA-N 310.466 5.167 30 20 DKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1ccc2ccccc2n1 744015245 KSICKBYUZGCBFX-DOTOQJQBSA-N 308.425 5.018 30 20 DKED CSc1ccc(C(=O)/C=C/c2cccnc2Cl)c(Cl)c1 765613840 NPWYQLMYMQRDBO-QPJJXVBHSA-N 324.232 5.006 30 20 DKED C=CCC(CC=C)c1nc(-c2c(Cl)cccc2Cl)no1 904310005 LNWIJUHEZRJRIA-UHFFFAOYSA-N 309.196 5.279 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1C(C)C 43230081 FBVLGGNRMQCKFC-UHFFFAOYSA-N 308.425 5.030 30 20 DKED C[C@@H](NC1CCC(C)(C#N)CC1)c1cccc(Cl)c1Cl 449156743 OSJRPEVFDFJGLX-OPGSHWCFSA-N 311.256 5.116 30 20 DKED C=C(C)[C@H](NCc1cc(C)sc1C)c1ccc(F)c(F)c1 479405098 CHFMCXBPYIYAGG-KRWDZBQOSA-N 307.409 5.050 30 20 DKED C=CCC[C@@H](NCc1cc2ccc(F)cc2[nH]1)c1ccccc1 486715425 WLNDEFGADBCNEX-LJQANCHMSA-N 308.400 5.104 30 20 DKED C[C@@H](CC#N)Sc1ccccc1N[C@@H](C)c1cccc(C#N)c1 600847428 SHSQCRHFZXDBDU-GJZGRUSLSA-N 321.449 5.126 30 20 DKED C#CC[C@H](N[C@@H](C)c1ccc(OC(C)(C)C)cc1)c1ccccc1 765802307 AIUKHDDVRJCKFT-UWJYYQICSA-N 321.464 5.279 30 20 DKED CSc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665228 FIARHEJDWPRALN-DNVCBOLYSA-N 310.466 5.104 30 20 DKED Cc1noc(C2CC2)c1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@H]21 329088967 IGSWNAYGCKNMOE-BPLDGKMQSA-N 302.418 5.055 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340429791 DTTGFIVHWRFMCK-RTWAWAEBSA-N 322.452 5.171 30 20 DKED CCC(C)(C)OCc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1C 447588656 VRVBEMUZCREMQC-AEFFLSMTSA-N 314.473 5.195 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCCCC[C@H]1/C=C/c1cccs1 466310505 YDXCVSGGMDSDBR-YOIRJEGESA-N 317.498 5.135 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1cccc(Cl)c1 487404728 YKFRVYLFDKSTBN-CYBMUJFWSA-N 316.857 5.204 30 20 DKED O=C(/C=C/C=C/c1ccccc1)c1ccc(-c2ccncc2)cc1 745990122 KUMDNWRRLSDPIN-KBXRYBNXSA-N 311.384 5.201 30 20 DKED CCCCCCC[C@@H](C)Nc1cccc(NC(=O)N(C)C)c1C 793247301 XGIMQMGGIPXYSZ-OAHLLOKOSA-N 319.493 5.249 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340430929 AIKZQFRWVDZYON-FGZHOGPDSA-N 318.464 5.397 30 20 DKED C=C(C)[C@H](NCc1cscc1Cl)c1ccc(F)c(F)c1 681375323 RLMIXJXUGQMAGO-HNNXBMFYSA-N 313.800 5.087 30 20 DKED C/C(C=NOc1ccccc1C(F)(F)F)=C/c1ccccc1 754710931 ZNNSSPWXEPTYJA-AJFIOWGASA-N 305.299 5.174 30 20 DKED C#CCCCCCC(=O)N1CCCCC[C@@H]1c1cccc(C)c1 779950950 PHJBICRDJFBQRK-HXUWFJFHSA-N 311.469 5.022 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1(F)CCCCC1 813221444 RWERPIJKJGDFQH-UHFFFAOYSA-N 303.421 5.149 30 20 DKED CCC[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 341752982 ZOGPTDQNHIIPBN-LEWJYISDSA-N 304.437 5.067 30 20 DKED N#CCCC[C@@H](N[C@H]1CCc2c(Cl)cccc21)c1ccccc1 556203086 ZXTNXIKXPFZMTI-UXHICEINSA-N 324.855 5.352 30 20 DKED CC(F)(F)c1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1 614794161 VZICVADOMJOHJD-UHFFFAOYSA-N 314.379 5.212 30 20 DKED Cc1ccc(C(=O)/C=C/c2cccc(-c3ccccn3)c2)s1 747695982 OHDBANGBTKWDHH-MDZDMXLPSA-N 305.402 5.015 30 20 DKED CC1(C)CCCC[C@H]1CC(=O)[C@H](C#N)c1ccc2ccccc2n1 752472905 CECGAODKISMNLE-DLBZAZTESA-N 320.436 5.018 30 20 DKED CC(C)(C#N)CCCCSc1nnc(-c2ccccc2)s1 767060904 BWDZQNWWVWWVAK-UHFFFAOYSA-N 317.483 5.017 30 20 DKED CC(C)c1nc2cc(N[C@H](C)c3ccc(C#N)c(F)c3)ccc2o1 776844566 NZCHWUYSQTWKPT-GFCCVEGCSA-N 323.371 5.135 30 20 DKED C[C@@H](CCC(C)(C)C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571915 XCHQMEFUHXXITE-QWHCGFSZSA-N 320.502 5.079 30 20 DKED CSc1ccccc1[C@H](C)N[C@H](CCC#N)c1ccccc1 194935203 QWOSDWIHLAGUCN-MAUKXSAKSA-N 310.466 5.104 30 20 DKED C=CC[C@H](CC)NC(=O)Nc1c(CCC)cccc1C(C)C 439383764 SBRDZLNEPINKAR-INIZCTEOSA-N 302.462 5.239 30 20 DKED CC[C@H](NCc1ccc(-c2ccccc2)o1)c1ccc(C#N)cc1 447563366 PPZJSPVNYFGIPZ-FQEVSTJZSA-N 316.404 5.059 30 20 DKED Cc1nc(S[C@@H](C)c2ccc(C#N)cc2)[nH]c1-c1ccccc1 488261120 FSXSDUYZFSEVNQ-AWEZNQCLSA-N 319.433 5.110 30 20 DKED C[C@@H](N[C@H](c1ccccc1F)C1CCCC1)c1cccc(C#N)c1 540591031 DDPWIPWTEIBDAZ-VFNWGFHPSA-N 322.427 5.279 30 20 DKED CC(C)Sc1ccc([C@H](C)NCc2ccc(CC#N)cc2)cc1 542260041 VJZTXXFISWHWEO-INIZCTEOSA-N 324.493 5.104 30 20 DKED CCC(=O)c1cc(Cl)ccc1OCCCCC(C)(C)C#N 566775641 CVGOZOQDNNIRNV-UHFFFAOYSA-N 307.821 5.032 30 20 DKED CCCCCCCC(=O)Nc1ccc(Oc2ccccn2)cc1 733767434 DDLOPLODLIUSNB-UHFFFAOYSA-N 312.413 5.173 30 20 DKED C=CCOCCCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 744349287 FAMDVIKTOIHZLF-UHFFFAOYSA-N 323.396 5.023 30 20 DKED CCCCCC1=C(C)CCC1=NNc1oc(C(C)C)nc1C#N 745625497 WXFBIWLDXPFFFF-UHFFFAOYSA-N 314.433 5.128 30 20 DKED CC(C)(C)c1cnc(/C=C\C(=O)c2cc3ccccc3o2)s1 790601178 KVGUCLYEHPARGQ-HJWRWDBZSA-N 311.406 5.083 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797566523 MIWLBQUZJCEUDM-ZIAGYGMSSA-N 320.502 5.223 30 20 DKED C=CCOc1ccc(CN[C@@H](C)c2ccc(C)cc2)cc1Cl 303236227 ZUNLIOQOARLTLF-HNNXBMFYSA-N 315.844 5.064 30 20 DKED Cc1ccccc1[C@@H](CC(F)(F)F)NC1CCC(C)(C#N)CC1 449290223 WQXYVXAZOJHUSN-ARWYELJZSA-N 324.390 5.051 30 20 DKED CSc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1Cl 540832959 MTHMORIJXORMMF-NSHDSACASA-N 302.830 5.107 30 20 DKED C[C@@H](SCc1csc(C(C)(C)C)n1)c1ccc(C#N)cc1 609825717 PKRZBEKZFXWZNX-GFCCVEGCSA-N 316.495 5.307 30 20 DKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cccc(F)c3)s2)cc1 734303572 VAOZOCZSBOUKHR-KTKRTIGZSA-N 323.392 5.154 30 20 DKED COCc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cc1 741840348 QJRFCHJLJUEUHE-RMKNXTFCSA-N 321.203 5.036 30 20 DKED Cc1ccsc1C(=O)/C=C\c1cccc(-c2cccnc2)c1 768490103 MQMMZZPJKUDBOX-FPLPWBNLSA-N 305.402 5.015 30 20 DKED C=CCC[C@@H](Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccco1 796961012 HMNAOESLPBDCPH-FFZOFVMBSA-N 322.452 5.388 30 20 DKED O=C(/C=C\c1sccc1Cl)c1c(F)cccc1Cl 809159532 RCTHCOPLHCQPPR-PLNGDYQASA-N 301.169 5.090 30 20 DKED CC1(C#N)CCC(Nc2ccc([C@H](F)C(F)(F)F)cc2)CC1 883363105 VXOVDWQCZPLBQK-SLTAFYQDSA-N 314.326 5.144 30 20 DKED Cc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3)c2)o1 139843998 YTVMNAXYNRXAQI-VAWYXSNFSA-N 318.372 5.063 30 20 DKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc12 464646806 ZJXHFIHIHUYBGT-UZLBHIALSA-N 307.437 5.106 30 20 DKED C=CCCC[C@@H](C)NC(=O)N(c1ccccc1)c1ccccc1 541123859 YDXQVQNJBWABNL-QGZVFWFLSA-N 308.425 5.279 30 20 DKED C=CCC[C@@H](Nc1cnn(CC(C)C)c1C(F)F)c1ccco1 574351181 GWJXOOYXYIHFHJ-CYBMUJFWSA-N 323.387 5.189 30 20 DKED CC(C)[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1 195656687 LVYJNOMCEUEWKM-HXUWFJFHSA-N 308.425 5.178 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340429790 DTTGFIVHWRFMCK-NHCUHLMSSA-N 322.452 5.171 30 20 DKED N#CCCC[C@@H](NCc1ccc(C(F)F)cc1)c1ccccc1 353913999 JTQJFPXPKQYZQG-GOSISDBHSA-N 314.379 5.149 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 428419484 FHELTKZBJKPHNL-GFCCVEGCSA-N 313.363 5.067 30 20 DKED Cc1ccc(-c2cccnc2)cc1N[C@H](C)c1cccc(C#N)c1 479823746 RIJSGTINCCCKRF-MRXNPFEDSA-N 313.404 5.102 30 20 DKED C=CC[C@H](N[C@H](CC)c1ccc(Cl)cc1)c1ccncc1 766022517 WOUHVEVLPQOKSB-MSOLQXFVSA-N 300.833 5.093 30 20 DKED C[C@@H]1/C(=C/c2csc(-c3cccs3)n2)C(=O)c2ccccc21 809158237 ZEELTWOAIKZFKW-GPILYODUSA-N 323.442 5.255 30 20 DKED N#CCCCOc1cccc(NCc2ccc3ccccc3c2)c1 237827130 UUEQJWBBECIBTH-UHFFFAOYSA-N 316.404 5.134 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(Cl)cn1)c1ccccc1 480214656 PFDWJJNMRQXUKH-RDTXWAMCSA-N 300.833 5.093 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1cnc2ccsc2c1)c1ccccc1 536831040 GGZJAAWWNDSJDG-MAUKXSAKSA-N 322.477 5.654 30 20 DKED CC(C)[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1Cl 539495255 JZMPIJZKTHSDQF-LIRRHRJNSA-N 312.844 5.260 30 20 DKED CCCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2o1 735205828 HGZXIGXIOWNKFI-CABCVRRESA-N 312.413 5.001 30 20 DKED C[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 37201468 ZFQURRSABAIHAK-VXGBXAGGSA-N 319.235 5.277 30 20 DKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(C)c1 323721800 KZYCVJVFGMJTBQ-FQEVSTJZSA-N 308.425 5.241 30 20 DKED C[C@@H]1CC[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2sccc21 453237034 KXQMGPYSEJFXCY-AYOQOUSVSA-N 324.493 5.711 30 20 DKED C[C@H](SCCC(C)(C)C#N)c1ccc(Cl)c(Cl)c1 463198206 LINUAYQWKMYCRD-JTQLQIEISA-N 302.270 5.727 30 20 DKED CCCC[C@@H](CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 463772501 ATEDEYBTGGIUBA-LSDHHAIUSA-N 318.486 5.236 30 20 DKED C[C@@H](NCCCC(C)(C)C#N)c1cc(F)c(Cl)cc1Cl 539241826 OIMCIFZNNHDYMG-SNVBAGLBSA-N 317.235 5.113 30 20 DKED Cc1cccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1C 559860429 ULQGMWMWYLLRMD-NQIIRXRSSA-N 306.453 5.389 30 20 DKED CN(C(=O)CCCCCC#N)c1ccc2c(c1)oc1ccccc12 590776786 GEASLBQIZGMCQJ-UHFFFAOYSA-N 320.392 5.023 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc2c(c1)oc1ccccc12 605918002 VIAFGIVSAFDUOK-UHFFFAOYSA-N 308.381 5.016 30 20 DKED C=CC[C@@H]1CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 626190585 NCIMUDIBBRRBRQ-MRXNPFEDSA-N 314.473 5.363 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@@]2(C)[C@@H](C1)C2(F)F 816786870 OXHFGNASNYHWQW-WBVHZDCISA-N 315.448 5.021 30 20 DKED O=C(/C=C/c1ccc2oncc2c1)c1cc(Cl)sc1Cl 821037422 BXSIYIKGGABCEY-HNQUOIGGSA-N 324.188 5.092 30 20 DKED CCCCCCCCCC=NNc1cccc(C(=O)O)c1C 1776087688 QRSDFOZWJYAJGU-UHFFFAOYSA-N 304.434 5.232 30 20 DKED C[C@H](Sc1ccccc1C#N)c1ncc(-c2ccccc2)o1 173707473 ROSNTOMGQHBMSX-ZDUSSCGKSA-N 306.390 5.067 30 20 DKED CCCCCCCCCN(C)Cc1cc2ccccc2nc1O 303496766 UFMHIEJXIGRERW-UHFFFAOYSA-N 314.473 5.123 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(C)(C)CC 429620006 GAKQRPPVJXDUJY-UHFFFAOYSA-N 302.462 5.096 30 20 DKED CC(C)(C#N)c1ccccc1CNc1cccc2ccsc12 443459566 GBPDKTORDKMRRH-UHFFFAOYSA-N 306.434 5.315 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)s1 531696073 HJPUMEUUGZNTRU-BXUZGUMPSA-N 304.846 5.075 30 20 DKED N#Cc1cnc(Oc2ccc3c(c2)[nH]c2ccccc23)c(Cl)c1 734141785 NGGTVBOXWLXFGJ-UHFFFAOYSA-N 319.751 5.033 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc2ccsc12 501255766 FGFWZQWSGNOZCZ-UHFFFAOYSA-N 322.433 5.121 30 20 DKED C[C@H](Oc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 507076618 YIYNEWUISMRMQY-LBPRGKRZSA-N 324.767 5.007 30 20 DKED Cc1ccccc1[C@H](NCc1ccccc1C(C)(C)C#N)C(C)C 538160438 XRJDVQJVVRWLRP-OAQYLSRUSA-N 320.480 5.283 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cccc(F)c1Cl 558261972 RUXSHWKPGSQQDO-UHFFFAOYSA-N 321.804 5.010 30 20 DKED CC[C@H](Cc1ccccc1)N[C@H](CCCC#N)c1ccccc1 574059312 LCPSEMDOGWJTAG-NHCUHLMSSA-N 306.453 5.032 30 20 DKED CC(C)[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1 611390407 XXCDBFRIERQTFF-SFTDATJTSA-N 322.427 5.062 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1C(C)(C)C 670057933 QNZRBDSBWMUXRA-CQSZACIVSA-N 320.864 5.210 30 20 DKED O=C(/C=C\c1nccc2ccccc12)c1cccc2ccccc12 740763739 HLLCKYSCCRDPML-SEYXRHQNSA-N 309.368 5.284 30 20 DKED CCCCCC[C@H](C)C(=O)Nc1ccccc1SCCC#N 741924593 GVBRGTNXZNPMOK-HNNXBMFYSA-N 318.486 5.237 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(Cl)c(F)c1 765613234 OLAOXVGFJMOJIE-ALCCZGGFSA-N 321.804 5.099 30 20 DKED CCCCCCCC[S@@](=O)Cc1cccc(C(F)F)c1 794895225 LJNABWKJIWNGKH-HXUWFJFHSA-N 302.430 5.233 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)CCC 475573242 LDSONFVPFAVPGH-INIZCTEOSA-N 302.462 5.239 30 20 DKED N#CCc1ccc(CSCc2cccc(C(F)F)c2)cc1 479586663 GWCVMLXQVHXMKT-UHFFFAOYSA-N 303.377 5.124 30 20 DKED COCC[C@@H](Sc1ccc(C#N)cc1Cl)c1ccccc1 499474105 KKYXEQZJBOFBIH-MRXNPFEDSA-N 317.841 5.082 30 20 DKED CCCc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 537951264 GXSNQNHASCLMFK-LAUBAEHRSA-N 306.453 5.335 30 20 DKED CC(C)[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 574611234 HGMWFEHPFHQUCA-PMACEKPBSA-N 324.855 5.186 30 20 DKED C[C@H](CC#N)Sc1ccccc1N[C@H](C)c1ccccc1F 600847565 VFUSLIYDFNBCMD-ZIAGYGMSSA-N 314.429 5.393 30 20 DKED C=C(Cl)CN(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1 741810593 LPENTYKYJOEUGG-OAHLLOKOSA-N 315.844 5.108 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2ncc(-c3ccccc3)s2)c1 770574378 LAROWUKTSTZUDP-MDZDMXLPSA-N 323.392 5.154 30 20 DKED C[C@@H](c1cccc(Cl)c1)[S@@](=O)CCCCC1(C#N)CCC1 899396399 DPCDHGKYKWINMN-QKKBWIMNSA-N 323.889 5.014 30 20 DKED CCCCCCCCCNC(=S)Nc1c(C)cccc1C 916007097 RQPSHFHGYUDTJW-UHFFFAOYSA-N 306.519 5.340 30 20 DKED C[C@@H](Nc1ccc(CC#N)cc1)c1ccc(Cl)cc1Cl 37071474 YHABTAIVRYTOPD-LLVKDONJSA-N 305.208 5.233 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90664543 UKQJGDUJGWILJC-JSGCOSHPSA-N 304.846 5.097 30 20 DKED CC[C@@H](CC#N)NC1CCC(c2cccc(C(F)(F)F)c2)CC1 432920039 WSDPITYBZARJLB-PWZRNIHTSA-N 324.390 5.013 30 20 DKED CC(C)(C#N)CCCCN1CCCC[C@@H]1c1ccc(F)cc1F 444668565 VDMQQFPZCWZKLB-GOSISDBHSA-N 320.427 5.212 30 20 DKED C=CCCc1ccccc1NC(=O)N1CCC[C@@]2(CC=CCC2)C1 505001013 NEZGETUYRYHZIX-NRFANRHFSA-N 324.468 5.159 30 20 DKED C[C@H](SCCCCC#N)c1ccc(OC(F)(F)F)cc1 531945475 GFOOPLVDOPKDBU-NSHDSACASA-N 303.349 5.073 30 20 DKED CCC(CC)[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccs1 561453978 AXCIWVBCIPTVEK-KUHUBIRLSA-N 312.482 5.448 30 20 DKED C[C@H](Nc1ccc(-c2ccco2)cc1F)c1cccc(C#N)c1 600848296 DFWZGKIXRRTMLA-ZDUSSCGKSA-N 306.340 5.130 30 20 DKED CCc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)s1 745990546 TVNRZGRRWPRTKU-MDZDMXLPSA-N 319.429 5.269 30 20 DKED CCCCCCCCC(=O)N1CCC(OC2CCCCC2)CC1 747668733 CQIGWIORKGSJLV-UHFFFAOYSA-N 323.521 5.077 30 20 DKED CC(C)=CCC/C(C)=C/C=NNc1ccc(C(F)(F)F)cn1 915917943 WDXLKVQUPMSHBB-NANQRBRQSA-N 311.351 5.191 30 20 DKED CC(C)c1ccc(NC(=O)c2cccc(CC#N)c2)c(C(C)C)c1 49700540 DFFFYTLNNRZVOU-UHFFFAOYSA-N 320.436 5.252 30 20 DKED C[C@H](CCCC(F)(F)F)N[C@H](CCCC#N)c1ccccc1 340445983 MLIVRNCPMRZAIS-GDBMZVCRSA-N 312.379 5.132 30 20 DKED CCCC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1 537293559 WXHKVZCGFAAPMN-KKSFZXQISA-N 322.452 5.149 30 20 DKED C[C@H](N[C@H](C#N)c1ccc(Cl)cc1)c1c(F)cccc1Cl 585719317 NULGHPLVZIZSDR-ZUZCIYMTSA-N 323.198 5.048 30 20 DKED N#Cc1ccc(CSCc2ccc(Cl)c3cccnc23)cc1 60514764 KRYZBTZFAHRJBI-UHFFFAOYSA-N 324.836 5.193 30 20 DKED CCC(CC)[C@H](NCc1ccc(C#N)cc1F)c1cccs1 533309787 PAAHDCNRNCVLQR-SFHVURJKSA-N 316.445 5.026 30 20 DKED Cc1cccc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1C 538526552 NEANSVDIXNLLEW-QGZVFWFLSA-N 308.425 5.159 30 20 DKED C=CCCOCCCCC(=O)Nc1ccccc1-c1ccccc1 539365030 VYDABRJGHDKOOH-UHFFFAOYSA-N 323.436 5.055 30 20 DKED C=C[C@@H](CC(=O)N(C1CC1)[C@H](C)c1ccccc1)c1ccccc1 559681233 LJEMHHGFMSQCRO-MSOLQXFVSA-N 319.448 5.099 30 20 DKED CC(C)(C#N)CCSCc1ccc(Cl)c2cccnc12 576141739 NHIWWZYEPWOOCB-UHFFFAOYSA-N 304.846 5.061 30 20 DKED CC[C@H](N[C@H](C)c1ccc(OC(C)C)cc1)c1ccc(C#N)cc1 584699844 MKUBFCBPGPNBHI-IERDGZPVSA-N 322.452 5.147 30 20 DKED N#CCCCCCC(=O)Nc1ccccc1SC1CCCC1 588868607 WLVFHALDPIDBJT-UHFFFAOYSA-N 316.470 5.134 30 20 DKED C=CCCc1ccccc1NC(=O)c1c[nH]c2cc(Cl)ccc12 669729018 ZJKQQUNKIVPUNP-UHFFFAOYSA-N 324.811 5.192 30 20 DKED Cc1ncccc1/C=C/C(=O)c1ccc(-c2cccs2)cc1 728785610 IFPVIQLZVUQRMX-ZHACJKMWSA-N 305.402 5.015 30 20 DKED O=C(/C=C\c1cccc(F)c1)c1cc(Cl)sc1Cl 744868952 LYZWJLHJYXCZBI-PLNGDYQASA-N 301.169 5.090 30 20 DKED CCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1nccc2ccccc12 792092060 OJWSIVHFQYSMGF-NQIIRXRSSA-N 322.452 5.408 30 20 DKED CC(C)[C@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 794525063 YSENMQWIOYGZOR-HNNXBMFYSA-N 321.342 5.510 30 20 DKED C[C@@H]1/C(=C\c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 809156336 LCPLSGZHVAODIW-ZRRZQRFHSA-N 323.442 5.255 30 20 DKED CC(C)(CCC#N)CNc1ccc(SC2CCCC2)cc1 157456845 DKXNQSVQGOAVJJ-UHFFFAOYSA-N 302.487 5.463 30 20 DKED N#CCCC[C@H](NCc1cccc(Cl)c1F)c1ccccc1 353916263 PPYBEGCDVPBYTH-KRWDZBQOSA-N 316.807 5.004 30 20 DKED C[C@@H]1CC[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 358350171 ZOUIISCCCSQVPI-TYCQWZJGSA-N 304.437 5.260 30 20 DKED CC(C)O[C@H](CSCCCCC(C)(C)C#N)c1ccccc1 427696449 QFPGEQAPTCQODR-GOSISDBHSA-N 319.514 5.606 30 20 DKED N#CCCCOc1cccc(CNc2csc3ccccc23)c1 486528833 AKQLBXFPLGKBIQ-UHFFFAOYSA-N 322.433 5.196 30 20 DKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1ccccc1)C1CCCC1)CC2 517228296 KBUQBDCNBOCCKZ-VXKWHMMOSA-N 316.448 5.067 30 20 DKED C/C(=C/C(C)(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 588501500 SNNDFRFZUMQELS-DINCDJDBSA-N 316.470 5.012 30 20 DKED CC(C)c1cnc(S[C@@H](C#N)C2CCCCC2)n1C(C)C 610034359 CNQCFVQIDJWKSA-INIZCTEOSA-N 305.491 5.152 30 20 DKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccsc1 727267450 UNLXQRLWUOZOJW-DUXPYHPUSA-N 316.731 5.316 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1 340446433 ONZZMKXUQMAILA-PMACEKPBSA-N 310.416 5.302 30 20 DKED C[C@@H](Sc1ccccc1C#N)c1ccc(OC(F)F)cc1 525758008 YFOJRNJPFQMUQL-LLVKDONJSA-N 305.349 5.013 30 20 DKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1coc2ccccc12 789141615 FXSWLDUYMHOQES-FPLPWBNLSA-N 321.357 5.045 30 20 DKED C=CCN(C(=O)Nc1ccc(C(C)C)cc1C(C)C)C(C)C 916708025 GMUAZBIBPDBHTA-UHFFFAOYSA-N 302.462 5.362 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(Cl)nc1)c1ccccc1 181508215 NJWJVGOARZAMSQ-RHSMWYFYSA-N 300.833 5.093 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H]1CCSc2ccccc21 410359152 KJZBLCFVLMNLKL-KRWDZBQOSA-N 323.461 5.023 30 20 DKED C=CC[C@H](C)NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 439982029 SKKNMDNJJAYISV-DLBZAZTESA-N 322.452 5.021 30 20 DKED CC[C@H](N[C@@H](C)c1cccc(OC(C)C)c1)c1ccc(C#N)cc1 447538014 AHYYJWZHQFADQS-KKSFZXQISA-N 322.452 5.147 30 20 DKED C[C@@H]1CC[C@H](N[C@H](CCCC#N)c2ccccc2)c2sccc21 453237035 KXQMGPYSEJFXCY-LZQZEXGQSA-N 324.493 5.711 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2cc3ccccc3o2)s1 736433369 SWBFEFCIYBBJER-HJWRWDBZSA-N 311.406 5.083 30 20 DKED Cc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(O)c1C 815635339 ATXJFENZLHLXPD-PXNSSMCTSA-N 322.452 5.095 30 20 DKED C=C(C)[C@@H]1CC=C(C)C(=NNc2ncc(Cl)cc2Cl)C1 7860042 QCAMUWGVVONTCE-LLVKDONJSA-N 310.228 5.089 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1cccs1)C1CC1 481911113 DCRIQPXPFYRVAG-ICSRJNTNSA-N 322.477 5.128 30 20 DKED N#Cc1c(F)cccc1SCc1csc(C2CCCC2)n1 590596264 XJRBFDROZJQDPA-UHFFFAOYSA-N 318.442 5.104 30 20 DKED CCCc1ccc(CN[C@@H](CCCC#N)c2ccccc2)s1 598644905 UPYOMBXEFLRIAW-IBGZPJMESA-N 312.482 5.225 30 20 DKED Cc1ccc(Sc2ccc(NC(=O)CCCC#N)cc2)cc1C 461797177 QHGUAOJCRVUAKJ-UHFFFAOYSA-N 324.449 5.087 30 20 DKED C=CCCc1ccccc1NC(=O)N1C[C@H](C)[C@H]1c1ccccc1 505028879 JPFRZXFJDYMHMQ-JXFKEZNVSA-N 320.436 5.030 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C(C)C)c1 514510054 ZVSAWBWGEUUNOQ-UHFFFAOYSA-N 314.454 5.092 30 20 DKED C[C@H](Sc1ccc(C#N)cc1F)c1ncc(-c2ccccc2)o1 525629940 TYKZZDOJYBKPAT-LBPRGKRZSA-N 324.380 5.206 30 20 DKED C=C[C@H](CC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 535406843 MQBQLCGHFYQWHF-QGZVFWFLSA-N 307.437 5.417 30 20 DKED CC[C@@H](CC#N)NCc1ccc(-c2cccc(Cl)c2Cl)o1 546581865 HGMYLILYJIQGAL-NSHDSACASA-N 323.223 5.035 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550827523 MLLRHSCYQAPXNZ-KXBFYZLASA-N 312.844 5.426 30 20 DKED C=C(C)CCS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 578734526 GAYQXVYHFSDYCI-HNNXBMFYSA-N 305.487 5.145 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@H](CC1CC1)c1ccccc1 611395366 HZFWRXQBTQDLQL-OAQYLSRUSA-N 318.464 5.119 30 20 DKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2ccccc2)cc1 618742046 PRLVBSBCEWUVAB-QHCPKHFHSA-N 324.427 5.002 30 20 DKED CCC[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc(C)cs1 733676535 ASRVIMLBKBLVPD-JKSUJKDBSA-N 318.486 5.015 30 20 DKED CC(=NNc1nc(-c2ccccc2)cs1)c1sccc1C 733745074 ZEBZAKGZJGITIW-UHFFFAOYSA-N 313.451 5.016 30 20 DKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1ccccc1 735317633 DTPFWANXOIMMJH-CYBMUJFWSA-N 317.841 5.237 30 20 DKED Cc1ccc2cc(C(=O)/C=C/c3nccc4ccccc34)oc2c1 754825121 NHEBSYBRVPXRLZ-CMDGGOBGSA-N 313.356 5.186 30 20 DKED Cc1cc(NC(=O)C2(C#N)CCCCC2)ccc1-c1ccccc1 762515044 YATJYZMRUHFSRW-UHFFFAOYSA-N 318.420 5.075 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(OCC(C)C)cc1)c1ccncc1 766018155 GETHOKUVJQRLBW-DYESRHJHSA-N 324.468 5.084 30 20 DKED CC(C)[C@H]1/C(=C/c2scnc2C2CC2)C(=O)c2ccccc21 782354391 LPQHGHZPDUJHTI-BAPRJRNISA-N 309.434 5.040 30 20 DKED C[C@H](S[C@H](C)c1ncc(C(C)(C)C)o1)c1cccc(C#N)c1 190904213 BGELTEITYOYQRE-QWHCGFSZSA-N 314.454 5.399 30 20 DKED N#CCC[C@H](NCc1cc(Cl)ccc1Cl)c1ccccc1 338220580 ZOXARDNUZBPEHW-KRWDZBQOSA-N 319.235 5.128 30 20 DKED C=C(C)[C@@H](NCc1cc2ccccc2o1)c1ccc(F)c(F)c1 479401089 DDIYAEQDFCAOKT-LJQANCHMSA-N 313.347 5.118 30 20 DKED CC(C)(C#N)CCCSc1nc2cc(F)cc(Cl)c2o1 479482561 JSCBCDYQWJXPLX-UHFFFAOYSA-N 312.797 5.042 30 20 DKED Cc1c(C(=O)/C=C/c2nccc3ccccc23)oc2ccccc12 740764840 HYRZJPPOSWXWLA-ZHACJKMWSA-N 313.356 5.186 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C(C)=C\c1ccco1 846994830 VYKQONOZVORCAU-SQFISAMPSA-N 309.409 5.174 30 20 DKED CCC(C)(C)OCc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1C 447588658 VRVBEMUZCREMQC-SJLPKXTDSA-N 314.473 5.195 30 20 DKED CC1(C#N)CCC(N[C@H](Cc2ccccc2)c2cccs2)CC1 449139559 LGZLNVPEOQJWDV-QPIRBTGLSA-N 324.493 5.094 30 20 DKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc2ccccc12 554996686 ARZUXIBVEWJBBS-IVZQSRNASA-N 312.416 5.050 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1F)c1ccc(OC(F)F)cc1 610165726 JBOADJUMBALFME-SNVBAGLBSA-N 323.339 5.152 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1C1CCCC1 649956438 SCACAJJVPBUJSC-RTBURBONSA-N 311.469 5.303 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1cccc(Cl)c1Cl 782325050 KOMYVGZFNQTFBV-VOTSOKGWSA-N 324.232 5.223 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 37220685 BDPYDSDDHHMMKF-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C=CCCC(=O)Nc1ccc(-c2nc3ccc(C)cc3s2)cc1 72080051 GIIHCGQKCMPTIG-UHFFFAOYSA-N 322.433 5.176 30 20 DKED C=CCC[C@@H](NC(=O)c1sccc1C1CC1)c1ccccc1 432991661 LDULRMUSCKMVRA-QGZVFWFLSA-N 311.450 5.063 30 20 DKED CC[C@@H](NCCCCC(C)(C)C#N)c1ccccc1OC(F)F 444678200 YJBITXCCPQAVHU-OAHLLOKOSA-N 324.415 5.049 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@@H]1CCC[C@H](C#N)C1 463299332 DUYSNCGMSGVOFN-DOTOQJQBSA-N 302.487 5.131 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1C[C@H](C)C[C@@H](C)C1 476170713 XOSKTEXQGYSPGW-HZPDHXFCSA-N 313.485 5.549 30 20 DKED CC(C)(C#N)CCCSc1ncc(C(F)(F)F)cc1Cl 476481066 KCORIPKRKJHZLK-UHFFFAOYSA-N 322.783 5.176 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 480676055 ASFVMZGJYMWSHL-BBATYDOGSA-N 323.333 5.211 30 20 DKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccc(C#N)c(F)c1 525955995 LGKLNVCLRMOOII-STQMWFEESA-N 324.424 5.324 30 20 DKED CC[C@@H](NCc1c(Cl)cccc1Cl)c1ccc(C#N)cc1 556063413 DGFMWYQXWXYBJI-QGZVFWFLSA-N 319.235 5.106 30 20 DKED CC(C)(C#N)CCCNc1cccc(Cl)c1SC(F)F 762800363 ZVYQLXHJBSMNMO-UHFFFAOYSA-N 318.820 5.397 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(CC)o1 189878926 ZNYJSXCSYSTCBQ-UHFFFAOYSA-N 311.425 5.255 30 20 DKED CC(C)C[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 192995083 PTULBWUGIFNNBK-DYESRHJHSA-N 322.452 5.027 30 20 DKED C[C@@H](CCc1ccsc1)N[C@H](CCCC#N)c1ccccc1 340446446 OUAUTXIUKZLXNO-QFBILLFUSA-N 312.482 5.094 30 20 DKED C[C@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)c(F)c1 495413719 FTNMLVTXKYBAKR-BTYIYWSLSA-N 322.427 5.279 30 20 DKED C=CCC[C@H](NCc1cc(C)nc2ccccc12)c1ccccc1 537154356 IIAVWPXBJHLMJX-NRFANRHFSA-N 316.448 5.340 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)cc1 540705560 TZPSNTLPFSBAKT-KPZWWZAWSA-N 316.807 5.153 30 20 DKED CC(C)(C#N)CCN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 545267920 KHPZCKYWULENQW-MRXNPFEDSA-N 324.390 5.172 30 20 DKED C=CCCC(=O)N[C@H](c1ccccc1)c1ccc2ccccc2c1 597607246 MBINNAKIRUEMFQ-JOCHJYFZSA-N 315.416 5.012 30 20 DKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 744016055 IEKZTNZOLLLURF-UONOGXRCSA-N 314.454 5.079 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C/c1coc(-c3ccccc3)n1)C2=O 766695356 KJKHHIPFRGRMFB-DZBQEORWSA-N 315.372 5.033 30 20 DKED Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H](CCC#N)c1ccccc1 90665681 WYYDKHJKBASRAL-UXPWSPDFSA-N 304.437 5.178 30 20 DKED C[C@@H](CCC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 441327911 ZIAHICIMERJOSV-INIZCTEOSA-N 320.436 5.010 30 20 DKED CC(C)C[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1 512625757 QHGOMBIYZHDBSD-MGPUTAFESA-N 310.416 5.135 30 20 DKED C#CC[C@@H](N[C@H]1C[C@H](C)Sc2sccc21)c1ccccc1 773113796 DUMKEDRWFLKBDW-XKQJLSEDSA-N 313.491 5.028 30 20 DKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1csc2ccccc12 804438053 LCDOWBSNTMIQCY-QMMMGPOBSA-N 319.842 5.056 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@H](C)/N=C\c1ccccc1O 920173632 CWMISWLLMPQWEV-RQZLXBNYSA-N 322.433 5.004 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C)=C(C)C1 281208771 ZOQWKOHPQSUSAG-UHFFFAOYSA-N 312.457 5.113 30 20 DKED C[C@H](CC#N)Sc1ccccc1N[C@H](C)c1cccc(C#N)c1 600847429 SHSQCRHFZXDBDU-HUUCEWRRSA-N 321.449 5.126 30 20 DKED CCCCCCCCC(=O)N(C)[C@@H](C)c1sc(CC)nc1C 741578960 QJAMEOSBPLKKOC-HNNXBMFYSA-N 324.534 5.284 30 20 DKED C=C(Cl)COc1ccc([C@@H](C)NCc2sccc2C)cc1 765335784 YVXQENIDOCXYNQ-CQSZACIVSA-N 321.873 5.039 30 20 DKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 784877377 AVACIAWSMNKEOH-UONOGXRCSA-N 306.475 5.049 30 20 DKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cncs2)c1 787172284 VGMKNPCNGXEGBX-KTKRTIGZSA-N 305.402 5.015 30 20 DKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCC(C)(C)C#N)C1 538487960 HCIJCINELOXKON-XJKSGUPXSA-N 324.390 5.028 30 20 DKED CCC(CC)[C@H](NCc1ccc(CC#N)cc1)c1ccccc1 544120904 UAWWHGPBOGTNLA-NRFANRHFSA-N 306.453 5.020 30 20 DKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccsc1 727780058 GFYNGJRQEFYZFN-BQYQJAHWSA-N 311.431 5.076 30 20 DKED O=C(/C=C/c1ccc(Cl)cc1)c1ccc(-c2ccncc2)cc1 745989903 GHBOSFVCHMVGTC-XCVCLJGOSA-N 319.791 5.298 30 20 DKED Clc1c(CON=Cc2cccs2)sc2ccccc12 763399398 BUTFDGGUNJCCLG-UHFFFAOYSA-N 307.827 5.167 30 20 DKED O=C(O)c1ccccc1NN=C1CCCCCCCCCCC1 1776029894 HLSTUELCTMCSSD-UHFFFAOYSA-N 316.445 5.457 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 186452802 IHRPWESFPNWUJI-BDJLRTHQSA-N 322.424 5.006 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 766018909 JQHFVCSFGAQQNM-SJCJKPOMSA-N 321.251 5.356 30 20 DKED C=CCCCCNC(=S)Nc1c(C(C)C)cccc1C(C)C 769761194 VDRSBJZVSJUEJM-UHFFFAOYSA-N 318.530 5.576 30 20 DKED CC(C)(C)c1cnc(/C=C/C(=O)c2c(F)cccc2Cl)s1 809159820 XIXLFJYDTNWSJZ-BQYQJAHWSA-N 323.820 5.129 30 20 DKED Fc1ccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)cc1 818203185 DKLWFXKQWIEBHI-UHFFFAOYSA-N 317.578 5.232 30 20 DKED CC[C@H](N[C@H](C)c1oc2ccccc2c1C)c1ccc(C#N)cc1 447545814 YFKBMPURNVYOGM-BEFAXECRSA-N 318.420 5.415 30 20 DKED N#CC[C@@H]1CC[C@H](N[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 453290633 KVGCYFHIFKLJCJ-YLVFBTJISA-N 323.267 5.116 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CCC1CC1 475567752 YDHJVLSWJZEUJH-HNNXBMFYSA-N 314.473 5.239 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(Cl)cn1)c1ccccc1 480214652 PFDWJJNMRQXUKH-KDOFPFPSSA-N 300.833 5.093 30 20 DKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(C)cc1)c1ccccc1 533888277 AEHWJMPYYWMMSK-NQIIRXRSSA-N 319.448 5.018 30 20 DKED C=CCN(C(=O)Nc1ccc(S[C@@H](C)CC)cc1C)C1CC1 539027257 BZJOGFRBKVNSOU-AWEZNQCLSA-N 318.486 5.068 30 20 DKED Cc1c([C@H](NCc2ccc(C#N)s2)C(C)C)oc2ccccc12 540598545 GUSDHOCARSCLJR-GOSISDBHSA-N 324.449 5.161 30 20 DKED CC(C)C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccccc1 619755361 FUHRZVUSNGIJKG-IBGZPJMESA-N 312.844 5.089 30 20 DKED CC(=NNc1ncccc1Cl)c1ccc(SC(C)C)cc1 728430080 YKXPPNVPIXFDJP-UHFFFAOYSA-N 319.861 5.072 30 20 DKED CCCCCCCCCC(=O)Nc1ccc(C)c(NC(C)=O)c1 915727445 SMGRHVQTLXUQEG-UHFFFAOYSA-N 318.461 5.033 30 20 DKED CC(C)Oc1cccc(/C=C\C(=O)c2cc3ccccc3o2)c1 921261220 BVYIKBQJFMEMNP-KHPPLWFESA-N 306.361 5.116 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1 97465035 JXMLBHCVAUMCQJ-CQSZACIVSA-N 314.816 5.196 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(F)c1F 340442009 DTRSYSARJZWBJY-KSSFIOAISA-N 314.379 5.051 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1ccccc1)C1CC1 481664651 HGMWYHNXXXSQNX-YADHBBJMSA-N 316.448 5.067 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1-c1c(F)cccc1F 494534799 VWMKWYVOIANVGU-ZDUSSCGKSA-N 315.363 5.173 30 20 DKED C[C@H](SCc1ccc2ncccc2c1)c1cccc(C#N)c1 527198014 SDVKZXNVRCQCQC-AWEZNQCLSA-N 304.418 5.101 30 20 DKED CC(C)(C#N)CCCSCc1coc(-c2ccccc2F)n1 600652020 MLXGUAHXNOLCQV-UHFFFAOYSA-N 318.417 5.044 30 20 DKED C#CC[C@H](N[C@H](C)c1ccccc1SCC)c1ccccc1 773103968 CVUWCGSBPCSLQY-APWZRJJASA-N 309.478 5.214 30 20 DKED CC[C@H](N[C@@H](CC)c1ccc(F)cc1F)c1ccc(C#N)cc1 447542407 OZXIYKCXSWHZML-OALUTQOASA-N 314.379 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H](C)C[C@@H](C)C1 476170720 XOSKTEXQGYSPGW-VQFNDLOPSA-N 313.485 5.549 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)c(F)c1 538508050 SYSHQARJLLKVLC-BTYIYWSLSA-N 322.427 5.279 30 20 DKED CCC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1F 540594499 KPVJKOLGGFINLI-DJJJIMSYSA-N 314.379 5.028 30 20 DKED CC(C)[C@H](NCCCC(C)(C)C#N)c1ccc(Cl)cc1F 542919828 UUAFVHRDPRJKRB-INIZCTEOSA-N 310.844 5.096 30 20 DKED CC[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(Cl)cc1 594914163 DSDUSQVWPHMNRP-IBGZPJMESA-N 324.855 5.136 30 20 DKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccsc3)s2)cc1 734304527 MUCHJSHNOKCETG-SREVYHEPSA-N 311.431 5.076 30 20 DKED Cc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)s1 734981717 SHVWTQXCYPGCTJ-CMDGGOBGSA-N 310.390 5.267 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(SCC)cc1)c1ccncc1 756925684 GRUBPZQWAGTHPK-BEFAXECRSA-N 312.482 5.162 30 20 DKED Cc1cc2ccccc2nc1NN=C1CCC[C@@H](C(F)(F)F)C1 783522742 ZTUALNBFVPGNSC-CYBMUJFWSA-N 321.346 5.064 30 20 DKED CCCCCCC(=O)Nc1sc(-c2ccccc2)cc1C#N 917716573 MQTIVGYWQQIDMD-UHFFFAOYSA-N 312.438 5.196 30 20 DKED C[C@H](S[C@@H](C)c1ncc(C(C)(C)C)o1)c1ccc(C#N)cc1 85228665 ARVLLHACOQACMB-STQMWFEESA-N 314.454 5.399 30 20 DKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1 192988749 GBDZXFBVRSYNMA-ORAYPTAESA-N 310.828 5.014 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1cc(Cl)ccc1Cl 444670994 CGLWIGKEJBXKEW-GFCCVEGCSA-N 313.272 5.364 30 20 DKED Cc1c(C(=O)/C=C\c2cc(F)c(F)c(F)c2)oc2ccccc12 727975519 ZTQNAEUEFCVJPE-SREVYHEPSA-N 316.278 5.055 30 20 DKED CCC[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccn1 729149296 IPIWMDSWEVPZDP-ANKPHQHTSA-N 323.223 5.054 30 20 DKED CCCCC[C@@H](C)CC(=O)Nc1ccccc1SCCC#N 742648817 CVYUAMUIMPMKOU-OAHLLOKOSA-N 318.486 5.237 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccncc1 815580046 AZLVXTRCESMQNL-YCRPNKLZSA-N 320.411 5.342 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(C)c1 189882805 DHHDQNCTGSYMNB-UHFFFAOYSA-N 307.437 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(C2CCC2)n1 194958649 UKAVZWACTCJXLO-UHFFFAOYSA-N 324.424 5.046 30 20 DKED C[C@H](CCc1ccsc1)N[C@@H](CCCC#N)c1ccccc1 340446444 OUAUTXIUKZLXNO-APWZRJJASA-N 312.482 5.094 30 20 DKED CC(C)Sc1ccc([C@@H](C)NCC2CCC(C#N)CC2)cc1 442848674 AVOXVTZXDZOJRF-KLAILNCOSA-N 316.514 5.168 30 20 DKED N#Cc1ccc(F)c(CSCc2cccc(C(F)F)c2)c1 479598718 CZXSSIYATJZGHJ-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@H](N[C@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1F 512632247 YFQITNTZCNYBPD-CABCVRRESA-N 318.395 5.262 30 20 DKED C[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 539705583 LHIYBRVKXXZZDO-CQSZACIVSA-N 323.889 5.235 30 20 DKED CC(C)c1cccc(CN[C@@H](CCCC#N)c2ccccc2)c1 595503074 PLJMNUDXSNIWKG-NRFANRHFSA-N 306.453 5.335 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC2(CC2)C1 613902273 YZABYOIVSUSXJW-QGZVFWFLSA-N 311.469 5.447 30 20 DKED Cc1ccsc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741471526 BCJXBPBBBKKTKG-AATRIKPKSA-N 305.402 5.015 30 20 DKED CC1(C#N)CCC(Nc2ccc(CCC(F)(F)F)cc2)CC1 449045808 ITDVDBZYUAWGIV-UHFFFAOYSA-N 310.363 5.066 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccccc1 502405177 LGHFHADYEOYIOP-LAUBAEHRSA-N 323.484 5.356 30 20 DKED CCSc1ccc([C@@H](C)N[C@H]2CCc3ccc(C#N)cc32)cc1 520294068 QFHJZWFCDIWMST-VLIAUNLRSA-N 322.477 5.008 30 20 DKED CCC(CC)[C@@H](NCc1ccc(C#N)cc1F)c1cccs1 533309785 PAAHDCNRNCVLQR-GOSISDBHSA-N 316.445 5.026 30 20 DKED C[C@@H](Sc1cccc(Cl)c1C#N)c1ncc(C(C)(C)C)o1 537844541 LXBFKXSCENFECP-SNVBAGLBSA-N 320.845 5.350 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 559859770 OHMVVBXKDGXXSH-DNVCBOLYSA-N 312.844 5.426 30 20 DKED N#CCCC[C@H](NC/C=C/c1ccc(Cl)cc1)c1ccccc1 590069149 CKLUNJUVPFNPBM-YJJPMGAVSA-N 324.855 5.378 30 20 DKED C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(CC#N)CC1 614963451 DYGRIPUBRZFUAG-KRWDZBQOSA-N 320.436 5.166 30 20 DKED Cc1cc(F)ccc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741472297 HCPGVKGDSTUEHH-VURMDHGXSA-N 317.363 5.092 30 20 DKED C#CC[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccccc1 773116173 QDRAYGBFHYTTQH-KDOFPFPSSA-N 317.354 5.121 30 20 DKED CC(C)n1nccc1/C=C/C(=O)c1ccc(-c2ccccc2)s1 794938125 KTHAFZSRWRDDAI-CMDGGOBGSA-N 322.433 5.089 30 20 DKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ccccc1C 916269285 DBGZCHXGYBBGNB-UHFFFAOYSA-N 309.800 5.033 30 20 DKED Cc1coc(-c2ccc(C)c(N[C@@H](C)c3ccc(C#N)cc3)c2)n1 160033453 OFXQMNCTKBDDGC-HNNXBMFYSA-N 317.392 5.003 30 20 DKED CC(C)(C)C[C@H](NCc1cc(C#N)cs1)c1ccc(F)cc1 236631297 UIUPJMBJFRSFBF-KRWDZBQOSA-N 316.445 5.026 30 20 DKED N#CCCCCSCc1ccc(Cl)cc1Br 480364430 MWPYRLGKUJWRSY-UHFFFAOYSA-N 318.667 5.030 30 20 DKED CC(/C=C/c1ccncc1C#N)=C\c1cccc(C(F)(F)F)c1 486144526 GDXOZTFSKMBLDR-BYWGDBCOSA-N 314.310 5.089 30 20 DKED C=C(C)[C@H](CC(=O)Nc1c(C(C)C)cccc1C(C)C)OCC 533676626 JGDPWTWLGWRKPA-SFHVURJKSA-N 317.473 5.243 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 560907968 DCKAVGMAQGIMPW-UGSOOPFHSA-N 316.807 5.175 30 20 DKED CC(C)(C#N)c1ccccc1CNc1cc(C(F)F)ccc1F 593179671 GYXZZFFLDRJVER-UHFFFAOYSA-N 318.342 5.177 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nccc2ccccc12 792106880 TXBFCVBUUUWMRO-QFBILLFUSA-N 320.436 5.018 30 20 DKED C[C@@H](Sc1cccc(Br)c1)c1ccc(C#N)cc1 303718791 RHEBPWXCCBDHHC-LLVKDONJSA-N 318.239 5.174 30 20 DKED C=CC[C@@H](C(=O)Nc1cccc(C(C)(F)F)c1)c1ccccc1 440646867 ZPZXJQKRAUNXFW-QGZVFWFLSA-N 315.363 5.097 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CCC 475552526 ZPYHFWSYCKYDGJ-HNNXBMFYSA-N 302.462 5.191 30 20 DKED CCC(CC)[C@H](NCc1ccc(C#N)c(F)c1)c1cccs1 484064938 KKCRMPVDCJNOSN-SFHVURJKSA-N 316.445 5.026 30 20 DKED CC[C@@H](C)[C@@H](NCc1cc(C#N)cs1)c1ccc(Cl)cc1 530879314 UXCVJHRJNDDUQQ-SJKOYZFVSA-N 318.873 5.150 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 557273501 LLGGZMGNUFBHIT-VGOFRKELSA-N 318.464 5.261 30 20 DKED COc1cc(/C=C\C(=O)c2csc(Cl)c2)ccc1SC 787185820 JBVPONXOPFGUIQ-HYXAFXHYSA-N 324.854 5.028 30 20 DKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1 79724174 GLRHAJSNXXIGCT-LJQANCHMSA-N 312.388 5.071 30 20 DKED N#CCCC[C@H](N[C@@H]1CCCc2sccc21)c1ccccc1 340444048 BUBYZPCKQZENBZ-ZWKOTPCHSA-N 310.466 5.150 30 20 DKED C=C[C@@H](CC(=O)Nc1cccc(SC)c1C)c1ccccc1 540443179 LXBOQDVUFVTMOA-HNNXBMFYSA-N 311.450 5.015 30 20 DKED C=CC[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccncc1 783243795 CAFGKMORMMDEOO-RHSMWYFYSA-N 308.450 5.264 30 20 DKED N#C[C@@H](SC1=Nc2ccccc2CS1)C1CCCCC1 115186502 IYGVLNAHYAPDSW-OAHLLOKOSA-N 302.468 5.127 30 20 DKED C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 535498842 XJYPMFZXVCSIMI-FQEVSTJZSA-N 311.469 5.242 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)c(F)c1 538508052 SYSHQARJLLKVLC-VFNWGFHPSA-N 322.427 5.279 30 20 DKED C[C@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)c(F)c1 538508455 MYSWSPVAQLPXRJ-IFXJQAMLSA-N 310.416 5.135 30 20 DKED CSc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 539923808 GOMHTPMEOSYVNG-UHFFFAOYSA-N 322.477 5.225 30 20 DKED CSc1ccc(C(=O)/C=C\c2ccc(Cl)nc2Cl)cc1 761479877 WYGZNIOOSNRWOZ-YWEYNIOJSA-N 324.232 5.006 30 20 DKED C[C@H](Nc1cccc(C2CCC2)c1)c1ccc(OCC#N)cc1 812739580 UQZNBXCCDLRJIX-HNNXBMFYSA-N 306.409 5.030 30 20 DKED Cc1ccc2c(c1)CC[C@H]2N[C@@H](CCCC#N)c1ccccc1 815635495 DNJIVJFGSXRCQQ-LEWJYISDSA-N 304.437 5.007 30 20 DKED CC(=NNc1cccc(F)c1)c1cc(Cl)sc1Cl 920384125 PECQHEQMEXHOCP-UHFFFAOYSA-N 303.189 5.030 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1coc2ccccc12 926478762 CNMRSWPHWBXWDD-UZLBHIALSA-N 318.420 5.519 30 20 DKED CC[C@H](C)c1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1 1776698209 IJIPXTNPQUKLHA-UNJUUPHPSA-N 322.404 5.103 30 20 DKED C=CCN(Cc1ccccc1)Cn1ccc(=S)c2ccccc21 109314657 PBSANNHKJDJSJH-UHFFFAOYSA-N 320.461 5.016 30 20 DKED CC(C)(C#N)CCCCSCc1nc(C(C)(C)C)cs1 435894706 XFOCEXAJMCYULD-UHFFFAOYSA-N 310.532 5.394 30 20 DKED Cc1cc(CN[C@H](C)c2ccc(SC(C)C)cc2)ccc1C#N 488152224 QDNOOEXMVZQPJB-MRXNPFEDSA-N 324.493 5.218 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)c(F)c1 538508456 MYSWSPVAQLPXRJ-KUHUBIRLSA-N 310.416 5.135 30 20 DKED N#Cc1cccc(NC(c2ccc(F)cc2)c2ccc(F)cc2)c1 603891751 VSISABJNFCFVKE-UHFFFAOYSA-N 320.342 5.038 30 20 DKED CCCCCCCCC(=O)Nc1c(C)noc1-c1ccccc1 770024123 AGPGOFXKMFSWNN-UHFFFAOYSA-N 314.429 5.339 30 20 DKED C#CC[C@@H](N[C@@H](C)c1ccc(SCC)cc1)c1ccccc1 773117262 VANFVVHKWUQMHU-OXJNMPFZSA-N 309.478 5.214 30 20 DKED C#CCCCCCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 839258033 OMROHJVIBDBGBM-UHFFFAOYSA-N 318.631 5.169 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC(C)C)C1CC1 191417206 PYOYXSYXORMADW-UHFFFAOYSA-N 314.473 5.191 30 20 DKED CC(C)[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 315134042 CHRKXMLOTVSWJK-LIRRHRJNSA-N 312.844 5.260 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C[C@H]1CCC[C@@H](C)C1 330173550 HMBCGUIUPDELAQ-HIFRSBDPSA-N 311.429 5.190 30 20 DKED CCCCc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1 390293203 IMZQJKLFPJUDCX-INIZCTEOSA-N 308.425 5.105 30 20 DKED C=CCC1(NC(=O)Nc2ccccc2C(F)F)CCCCC1 425699995 JKHBJYQUUZFFST-UHFFFAOYSA-N 308.372 5.025 30 20 DKED C=CCC[C@@H](NC(=O)c1ccc(C(F)F)cc1)c1ccccc1 435301089 ICHZBEWDXQEUKD-QGZVFWFLSA-N 315.363 5.062 30 20 DKED C=CCC[C@H](NC(=O)Nc1ccsc1Cl)c1ccccc1 446476366 IKWPNAXQEIAGLC-ZDUSSCGKSA-N 320.845 5.231 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(Cl)cn1)c1ccccc1 480214654 PFDWJJNMRQXUKH-KSSFIOAISA-N 300.833 5.093 30 20 DKED Cc1cc(CS[C@H](C)c2nc3ccccc3o2)ccc1C#N 485596960 YWACRDKEWJWOGS-CYBMUJFWSA-N 308.406 5.002 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2)s1 541744324 FDPUXQDBLIRWRY-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CCCC[C@H](CC)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 735397894 YTZIBGWRHDLSGV-DOTOQJQBSA-N 308.425 5.018 30 20 DKED COCc1cccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)c1 742429770 YZMOSGCTNYYXAT-YVMONPNESA-N 321.203 5.036 30 20 DKED O=C(/C=C/c1c(F)cccc1F)c1cc(Cl)sc1Cl 744866085 PBIZJKSPTZDIGY-SNAWJCMRSA-N 319.159 5.229 30 20 DKED CC(C)(C#N)CCCNc1ccc(OC2CCCCC2)cc1 762795246 GPKNTIPKTNCSRE-UHFFFAOYSA-N 300.446 5.140 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1C 189879213 NSCZNZBENGDCFU-UHFFFAOYSA-N 311.400 5.238 30 20 DKED Cc1ccc(C(C)(C)C)cc1[S@](=O)CCCCC(C)(C)C#N 435437829 MNWIMBGUJGDDNG-JOCHJYFZSA-N 319.514 5.120 30 20 DKED CC[C@@H](C#N)Sc1nc2c(Cl)c(Cl)cc(Cl)c2o1 440580572 BPMRVSHQISMNQV-YFKPBYRVSA-N 321.616 5.182 30 20 DKED CC(C)(CCC#N)CNCC1(c2cccc(Cl)c2)CCCC1 462365390 LDLVIVWCGOYLDT-UHFFFAOYSA-N 318.892 5.071 30 20 DKED CCC[C@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1C#N 499780169 JUVODAGDYLDHMU-ZDUSSCGKSA-N 312.438 5.052 30 20 DKED N#Cc1ccccc1SCc1ccccc1Oc1cccnc1 525083455 IAKKPOADYPDVOY-UHFFFAOYSA-N 318.401 5.038 30 20 DKED N#Cc1ccc(SCc2ccc(C(F)(F)F)cc2)c(F)c1 525114963 AWPNPBZQQMLIOO-UHFFFAOYSA-N 311.303 5.008 30 20 DKED C[C@@H](Nc1cccc(N2CCCCCC2)c1)c1cccc(C#N)c1 537532602 APZCKEIOFIJJKH-QGZVFWFLSA-N 319.452 5.112 30 20 DKED Cc1ccccc1C(NCCCC(C)(C)C#N)c1ccccc1C 546180034 DDLSLWRBMKOAAI-UHFFFAOYSA-N 320.480 5.312 30 20 DKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc2ccccc2c1 560269395 PKEAFERLCKJVJE-MRXNPFEDSA-N 312.416 5.051 30 20 DKED CC(C)CCOc1ccccc1N[C@H](C)c1cccc(C#N)c1 600852662 RTUPVRVSSDPKJP-MRXNPFEDSA-N 308.425 5.156 30 20 DKED Cc1cc2cc[nH]c2cc1N=C(O)c1coc(C2CCCCC2)n1 328743006 JUVOISBTGMUHET-UHFFFAOYSA-N 323.396 5.148 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1NCc1ccccc1C 468331392 UQASKDSQZFCTRL-QGZVFWFLSA-N 322.452 5.148 30 20 DKED CC(C)(C#N)c1ccccc1CNc1csc2ccccc12 486143438 GFXNDRWGNYEMDG-UHFFFAOYSA-N 306.434 5.315 30 20 DKED CC[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(Cl)s1 551555075 RKAPLASGPNUDAX-AWEZNQCLSA-N 316.857 5.003 30 20 DKED Cc1ccccc1-c1cccc(CNCC(C)(C)CCC#N)c1 588929572 SABAVDSORJLUJM-UHFFFAOYSA-N 306.453 5.082 30 20 DKED CC(C)n1cc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cn1 732713658 JUVBHMJMYMZMBE-MDWZMJQESA-N 316.404 5.027 30 20 DKED C=CC[C@@H](N[C@H](CC)c1cccc(Cl)c1)c1ccncc1 746048272 ZVZWYMVIAUZQQA-QZTJIDSGSA-N 300.833 5.093 30 20 DKED C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 37220690 BDPYDSDDHHMMKF-VXGBXAGGSA-N 319.235 5.277 30 20 DKED Cc1cc(F)ccc1C1CCN(CCCCC(C)(C)C#N)CC1 428734109 YIZCGJHWCMILSE-UHFFFAOYSA-N 316.464 5.034 30 20 DKED C=CCOc1cccc(CN[C@@H](CC)c2ccc(Cl)cc2)c1 642339635 WXZHOCCUMJQVNN-IBGZPJMESA-N 315.844 5.146 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cccs2)cc1 741468664 GSKIJJJWBUTHKN-SEYXRHQNSA-N 320.413 5.320 30 20 DKED C=CC[C@@H](N[C@H]1CCCc2ccc(C(C)C)cc21)c1ccncc1 761451894 PIHBDLAREIJXBV-YADHBBJMSA-N 320.480 5.489 30 20 DKED FC(F)c1ccc(C=NOc2ccccc2C(F)(F)F)cc1 794524244 QFTMPMOSGCRXCX-UHFFFAOYSA-N 315.241 5.056 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1O 815636138 PRVRQCGWXYIOCT-WOJBJXKFSA-N 322.452 5.177 30 20 DKED Cc1cc(Cl)cc(CN[C@@H](CCCC#N)c2ccccc2)c1 339407435 LOJRTWAOAXGRFR-IBGZPJMESA-N 312.844 5.173 30 20 DKED C=CCCc1ccccc1NC(=O)C[C@@H](C=C)c1ccccc1 410347793 DHSQPKWYJGTZFM-QGZVFWFLSA-N 305.421 5.104 30 20 DKED CCC(CC)CN(CCC#N)C(=O)Nc1cccc2ccccc12 426645782 IGESNLXOWQKTRL-UHFFFAOYSA-N 323.440 5.024 30 20 DKED C=C[C@@H](CC(=O)Nc1cc(C(C)C)c(O)cc1C)c1ccccc1 535442920 ZAXLORLYOLUHRY-INIZCTEOSA-N 323.436 5.122 30 20 DKED N#CC1(CC(=O)Nc2ccccc2-c2cccs2)CCCCC1 596707634 IHZQFYWQHBNLCX-UHFFFAOYSA-N 324.449 5.218 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cc2cc(C)c(C)cc2o1)c1ccncc1 766018465 HYPOPCZSEJIVOV-QFBILLFUSA-N 320.436 5.413 30 20 DKED COc1cc(C(=O)/C=C\c2cscc2Cl)ccc1SC 771860949 TYLXFXPPIMZXIX-HYXAFXHYSA-N 324.854 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(/C)c1ccco1 834314465 MUJMMEGDQBWHSH-SQFISAMPSA-N 309.409 5.174 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2o1 193905816 RZSRSXIGDJEWLB-OAHLLOKOSA-N 320.392 5.288 30 20 DKED N#CC1(/C(O)=N/[C@H]2C[C@H](c3ccc(Cl)cc3)C2)CCCCC1 330046637 HCNSGTTYOXJUKQ-KOMQPUFPSA-N 316.832 5.017 30 20 DKED C=CCC[C@@H](NC(=O)Nc1c(C)cccc1C)c1ccccc1 435650208 DQKBAGPXFWQFTO-GOSISDBHSA-N 308.425 5.132 30 20 DKED C=CCC1(C(=O)Nc2cccc(-c3ccccc3OC)c2)CCC1 480081410 KYDNKHLUDQTJNX-UHFFFAOYSA-N 321.420 5.047 30 20 DKED CCC/C(C)=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 920322881 BZABHIBBFLJUOE-HFQYIWAZSA-N 324.449 5.041 30 20 DKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(F)c1 170991715 WPGYPAYRDAUYPB-ZIAGYGMSSA-N 314.429 5.251 30 20 DKED C=CCC[C@H](NCc1coc(-c2cccs2)n1)c1ccccc1 178757780 SBVJQFYJVFYPLA-KRWDZBQOSA-N 324.449 5.200 30 20 DKED CCCCCCCCCCCC(=O)N1CCC(C)(C#N)CC1 388839029 DDGARCXVPSVOPK-UHFFFAOYSA-N 306.494 5.060 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1ccc(Cl)cc1Cl 782301122 JZFSHBFYRFOKLC-AATRIKPKSA-N 324.232 5.223 30 20 DKED N#C[C@@H](C(=O)CCCC1CCCCC1)c1nccc2ccccc12 792099760 JLSNSJIKVQZMDU-IBGZPJMESA-N 320.436 5.162 30 20 DKED C[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 37201465 ZFQURRSABAIHAK-RYUDHWBXSA-N 319.235 5.277 30 20 DKED CCSc1cccc(CN[C@H](CCCC#N)c2ccccc2)c1 353915276 MZSBDVLVTLXKQR-HXUWFJFHSA-N 324.493 5.323 30 20 DKED CC(C)(CCC#N)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 554072466 GMMKHNCEQWKRKQ-MRXNPFEDSA-N 324.390 5.076 30 20 DKED CC(C)Sc1c(Cl)cccc1NC(=O)CCCCCC#N 588755243 DYXOFOSFDKFFTB-UHFFFAOYSA-N 324.877 5.253 30 20 DKED N#CCc1ccc(NCc2ccc3oc4ccccc4c3c2)cc1 779809136 LRWMKSYZKHXOGZ-UHFFFAOYSA-N 312.372 5.264 30 20 DKED C=CCC(F)(F)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 815164349 WEKXOOXBOXMMGT-LBPRGKRZSA-N 313.413 5.036 30 20 DKED CC(C)(C)C[C@@H](NCc1ccc(CC#N)cc1)c1ccc(F)cc1 543185039 IBNSTUCBIHPMMY-HXUWFJFHSA-N 324.443 5.159 30 20 DKED CCSc1ccc(C(=O)/C=C\c2cccc3cnccc23)cc1 782890324 USHJZQAJBJGIKG-FLIBITNWSA-N 319.429 5.243 30 20 DKED CCCCCCCC(=O)N(Cc1ccco1)c1ccccc1C#N 914515611 XUOPXWFSUMLZDS-UHFFFAOYSA-N 324.424 5.045 30 20 DKED Cc1cccc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)c1 71813571 ZWYBOBRAPDHPFX-MDZDMXLPSA-N 323.392 5.154 30 20 DKED N#CCCCOc1cccc(N[C@@H]2CCSc3ccccc32)c1 193905864 LHJUVTSGYRGEDC-GOSISDBHSA-N 324.449 5.018 30 20 DKED C=C(C)CN(CC)C(=O)c1cc2sc3ccccc3c2s1 302895148 JDXOZQAOPYDAFL-UHFFFAOYSA-N 315.463 5.154 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303547762 LFLFTZRTZIWEAT-INIZCTEOSA-N 312.457 5.033 30 20 DKED CC[C@H]1CC[C@H](C(O)=Nc2c(-c3ccccc3)n[nH]c2C)CC1 330186784 SIOMGXQKTZDXPN-KOMQPUFPSA-N 311.429 5.190 30 20 DKED C[C@H](S[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(C#N)c1 443159504 AUIWOPDHKKVXFE-QWHCGFSZSA-N 312.394 5.022 30 20 DKED C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 464516196 CCPPJRVNMYJVHP-NWDGAFQWSA-N 314.256 5.115 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](C)CC 475550560 ONWVCQZFXNPYDJ-HUUCEWRRSA-N 302.462 5.095 30 20 DKED Cc1cc2cc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc2cc1C 532206439 RKADQQSCPCXWDB-HOTGVXAUSA-N 318.420 5.333 30 20 DKED CCC(CC)N(C(=O)CCCCCC#N)c1ccc(C)c(C)c1 808312949 JMODQNARNTYSFN-UHFFFAOYSA-N 314.473 5.299 30 20 DKED CCCCCC1=CCCC1=NNc1ccc(C(F)(F)F)cn1 916592213 BFYFOVRYIOWLEM-UHFFFAOYSA-N 311.351 5.169 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cc(C#N)cs1 84058051 IELNSWUUTWKBQI-UHFFFAOYSA-N 312.438 5.119 30 20 DKED CC[C@@H](N[C@H](C)c1cc2cccc(F)c2o1)c1ccc(C#N)cc1 447596096 PNMQBKOPFOGSKK-FZKQIMNGSA-N 322.383 5.245 30 20 DKED Cc1c(CSC(C)C)cccc1NCc1ccccc1C#N 462175024 JAXMRXCQDURFMZ-UHFFFAOYSA-N 310.466 5.120 30 20 DKED C=CCC(CC=C)C(=O)N1CCC[C@H]1c1cccc2ccccc12 467813930 PPKBLVROAHXZCF-NRFANRHFSA-N 319.448 5.272 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC(C)C 475572012 IFQZTQBTYRPPLB-OAHLLOKOSA-N 302.462 5.095 30 20 DKED C[C@@H](Nc1cccc(OC2CCCC2)c1)c1cccc(C#N)c1 537537621 XNDFMXPDWDTOKA-OAHLLOKOSA-N 306.409 5.053 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1 538508362 JUWQEYZAEIPHGO-KZULUSFZSA-N 316.807 5.153 30 20 DKED CSc1ccc(C)c(NCc2ccc(C(C)(C)C#N)cc2)c1 614057750 BGDPSTDNMRQMLJ-UHFFFAOYSA-N 310.466 5.130 30 20 DKED CCC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccccc1 614179125 DIULMNUCFAAOMB-FQEVSTJZSA-N 306.453 5.119 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1C(C)(C)C 670057930 QNZRBDSBWMUXRA-AWEZNQCLSA-N 320.864 5.210 30 20 DKED CC(C)c1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)[nH]2)cc1 742432195 WFRLZBKWOZMOGN-OUKQBFOZSA-N 316.404 5.096 30 20 DKED O=C(/C=C/c1nc(Cl)cs1)c1cc(Cl)sc1Cl 759076848 SWWALJRDLPERGW-OWOJBTEDSA-N 324.641 5.061 30 20 DKED CC(C)(C#N)CCCNc1ccccc1SCc1ccccc1 762784776 YVJZYBPGKRGHIJ-UHFFFAOYSA-N 324.493 5.721 30 20 DKED CC(C)(C#N)c1ccccc1CNc1ccc2ccccc2c1 767800842 DMZFAAHHQLDSQH-UHFFFAOYSA-N 300.405 5.253 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1O 815636136 PRVRQCGWXYIOCT-UXHICEINSA-N 322.452 5.177 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C#N)c1 903000653 LXJUOBHZHODRCO-RTWAWAEBSA-N 317.436 5.034 30 20 DKED Cc1cc2c(cc1C)[C@H](N[C@H](C)c1ccc(C#N)cc1)CCS2 427589574 RSBMZJVLZOPDHE-DNVCBOLYSA-N 322.477 5.063 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(Cl)c1F 461089970 RYIZLNIWXIVLOW-PXAZEXFGSA-N 316.807 5.153 30 20 DKED CCN(Cc1cccc(C(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 470718091 OIFWNRZVPBAADA-AWEZNQCLSA-N 314.379 5.079 30 20 DKED Cc1c([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)oc2ccccc12 477865806 XGTQGANEPXBGPX-KGLIPLIRSA-N 322.383 5.164 30 20 DKED N#Cc1ccccc1-c1ccc(CSCc2cccnc2)cc1 579876479 DXIRSVVFOCECEQ-UHFFFAOYSA-N 316.429 5.054 30 20 DKED CSc1ccc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1 736433181 MYHXEDRXAAXAGR-KTKRTIGZSA-N 317.479 5.059 30 20 DKED O=C(/C=C\c1ccc(Cl)cc1)c1ccc(-c2ccncc2)cc1 745989902 GHBOSFVCHMVGTC-KMKOMSMNSA-N 319.791 5.298 30 20 DKED CC(C)Oc1ccccc1/C=C\C(=O)c1cc2ccccc2o1 916138527 UZWPQMDQMFPMAJ-QXMHVHEDSA-N 306.361 5.116 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccs1 189878263 VMMHGDVCFBFIRE-CQSZACIVSA-N 313.466 5.342 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc(CC)cc1C 189890164 COGIXSFBLXRGJJ-UHFFFAOYSA-N 311.425 5.255 30 20 DKED C[C@@H](Sc1ncc(Cl)cc1Cl)c1ccc(C#N)cc1 609825857 XRWTYOMMKLMOEB-SECBINFHSA-N 309.221 5.113 30 20 DKED Cc1nc2ccc(NCc3ccc(C(C)(C)C#N)cc3)cc2s1 614056316 CFDMIWSGCGLECC-UHFFFAOYSA-N 321.449 5.018 30 20 DKED CC(C)(C#N)CCSCc1csc(-c2cccs2)n1 616295276 NPTGXSGERFRYJN-UHFFFAOYSA-N 308.497 5.045 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 734079482 QJOFDEXUNVHVOA-SJLPKXTDSA-N 320.436 5.018 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)o1)[C@@H]1CCC[C@H](C)C1 742370820 OZPONGAMMRFTGR-LUQKVYGDSA-N 322.452 5.117 30 20 DKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1cccc2ccccc12 779713412 SQQRCZIYMFXUFB-HOTGVXAUSA-N 316.404 5.304 30 20 DKED CCCC(=NNc1ccc(Cl)c(C(=O)O)c1)C1CCCCC1 1776033515 SZENLIVNOJHRMJ-UHFFFAOYSA-N 322.836 5.187 30 20 DKED C[C@@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccc(C#N)cc1 156835430 LQZQEPLBHOZCJY-HZPDHXFCSA-N 322.452 5.147 30 20 DKED N#Cc1ccc(N[C@H](c2ccccc2)c2ccc(F)cc2)c(F)c1 303189205 YWSHRTGKDMWFPM-HXUWFJFHSA-N 320.342 5.038 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@@H](CC)CC[C@H]1C 475565854 QRMVDILOYODRQO-WBVHZDCISA-N 314.473 5.333 30 20 DKED Cc1cc(C)c([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1C 540151858 BJGWRPMIILPTAS-RXVVDRJESA-N 306.453 5.308 30 20 DKED CC(C)(C#N)CCCCNC1(c2ccc(Cl)cc2)CCC1 566964765 OAXSAZXRGPMIHH-UHFFFAOYSA-N 304.865 5.029 30 20 DKED C[C@H](Sc1cccc(F)c1C#N)c1ncc(-c2ccccc2)o1 580812174 LCUADNWHEDJFOR-LBPRGKRZSA-N 324.380 5.206 30 20 DKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1 610830408 QSQCFSLSTRJAMU-RYUDHWBXSA-N 319.235 5.277 30 20 DKED C[C@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1cccc(C#N)c1 610830512 YDTFRVXEGIFVME-JKSUJKDBSA-N 316.404 5.230 30 20 DKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC(C)(C)C)cc1 613242444 DOBZGGCPVDCSFR-HZPDHXFCSA-N 322.452 5.147 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccccc1F 789720305 WDRWKJKPWIRQDT-BUHFOSPRSA-N 323.411 5.330 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nccc2ccccc12 792104123 WUZFYNDFOBCTGL-QAPCUYQASA-N 308.425 5.018 30 20 DKED Cc1ccc(-c2ccncc2)cc1N[C@H](C)c1ccc(C#N)cc1 118443288 YYLKKEXMVBXAFY-MRXNPFEDSA-N 313.404 5.102 30 20 DKED N=C(O)[C@@H]1CCC[C@H](/C(O)=N/C2CCC3(CCCCC3)CC2)C1 329940596 GHDROZQVMGSGGI-CABCVRRESA-N 320.477 5.178 30 20 DKED C[C@H](SCc1ccccc1C(C)(C)C#N)c1cccc(C#N)c1 443141754 MRXDCNVOIRVGDR-HNNXBMFYSA-N 320.461 5.354 30 20 DKED N#Cc1ccc(CSCc2ccc(C(F)F)cc2)c(F)c1 460758447 MISZUJGXVNTZCI-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1Cl 573858322 FTFZFPQPRCTOEM-DNVCBOLYSA-N 312.844 5.426 30 20 DKED CC(C)n1cc(C(=O)/C=C\c2ccccc2-c2ccccc2)cn1 746686851 NPPZGLKLVDQDCV-SEYXRHQNSA-N 316.404 5.027 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(CC(C)C)cc1)c1ccncc1 766021624 QRYHQDDXZCNACI-UTKZUKDTSA-N 308.469 5.248 30 20 DKED C[C@@H](Nc1ccccc1Cc1ccccc1)c1cccc(C#N)c1 324186327 IVTVJKSCGLTWLY-QGZVFWFLSA-N 312.416 5.322 30 20 DKED N#C[C@H]1CC[C@@H](Nc2cccc(CSCc3ccccc3)c2)C1 442852761 IHEYTWKPMIHZQK-FXAWDEMLSA-N 322.477 5.224 30 20 DKED CC(C)COc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 610829781 KTFLLMBBRNKARX-DLBZAZTESA-N 322.452 5.005 30 20 DKED CC(=NNc1ccc(Cl)nc1)c1ccc(SC(C)C)cc1 743449627 ANZIJRAOLSYCHJ-UHFFFAOYSA-N 319.861 5.072 30 20 DKED C[C@H](SCCC(Cl)(Cl)Cl)c1ccc(C#N)cc1 767869151 YATFKXQBNFIVAP-VIFPVBQESA-N 308.661 5.113 30 20 DKED C#CC[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccccc1 783258404 HVZFNDMSIAGLQU-QAPCUYQASA-N 305.446 5.317 30 20 DKED CSCc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 922145118 MCJSHDSZYDEROX-FQEVSTJZSA-N 324.493 5.074 30 20 DKED O=C1/C(=C/C=C/c2ccco2)CCC/C1=C\C=C\c1ccco1 17169590 SHPLADCLSRWYLI-ZOFYMTOZSA-N 306.361 5.205 30 20 DKED Cc1cc(N[C@H](CCC#N)c2ccccc2)c2cccc(F)c2n1 301788620 MVJIZSLXLWBNRN-GOSISDBHSA-N 319.383 5.139 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(F)c1 340445490 DURTTYOKKKKNHK-VQTJNVASSA-N 310.416 5.302 30 20 DKED C=CCCc1ccccc1NC(=O)c1c(C)oc2ccccc12 410345198 OCDROJFPRGRXGI-UHFFFAOYSA-N 305.377 5.112 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2ccccc2C(F)F)CCCC1(C)C 425702635 MYZYDGNYRAUZHF-HNNXBMFYSA-N 322.399 5.223 30 20 DKED CC[C@H](Nc1ccc(COC(C)C)cc1)c1ccc(C#N)cc1 447578429 FMEWHTJAILVYKK-FQEVSTJZSA-N 308.425 5.046 30 20 DKED CC[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1ccc(C#N)cc1 517278343 KYBMWQDXSOIGFN-SJCJKPOMSA-N 316.807 5.153 30 20 DKED Cc1cc(SC(C)(C)C)ccc1N[C@H](C#N)Cc1ccccc1 725843521 UQOHWDMTQZTIIO-KRWDZBQOSA-N 324.493 5.432 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3ccsc3)n1)C2 730948983 NOCSTZHQZSJDIS-RIYZIHGNSA-N 323.442 5.002 30 20 DKED CC(/C=C\C(=O)c1cscn1)=C/c1ccccc1C(F)(F)F 799891907 JGOGHCGLUCRWFN-NJMVCRMVSA-N 323.339 5.004 30 20 DKED CC(C)(C)C[C@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1 236631382 BURQFQCNXAXCRB-KRWDZBQOSA-N 316.832 5.072 30 20 DKED CC[C@@H](C)Oc1cccc(N[C@@H](C)c2ccc(C#N)c(F)c2)c1 559876890 IVHJJWMGPVFWJZ-KGLIPLIRSA-N 312.388 5.048 30 20 DKED N#Cc1c(F)cccc1CNc1cccc(Oc2ccccc2)c1 600849277 MARPYQMULAGHOH-UHFFFAOYSA-N 318.351 5.102 30 20 DKED C=CCC[C@H](NCc1ccoc1)c1ccc(C(F)(F)F)cc1 749834615 FBUODUYCXBGPOM-INIZCTEOSA-N 309.331 5.096 30 20 DKED C[C@@H](C#N)Oc1ccccc1N[C@@H](C)c1ccc2ccccc2c1 182260480 WCPAKKPIBRAXSP-HOTGVXAUSA-N 316.404 5.304 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)ccc1C 189882926 KMIWJPYJAOPCGR-UHFFFAOYSA-N 321.464 5.337 30 20 DKED C[C@@H](Nc1ccc(Oc2ccccc2)cc1)c1cccc(C#N)c1 324371824 KYYOILLJTWBCJN-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C=C[C@@](C)(CC)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 442963761 GZVATHTVXJKPMJ-KKSFZXQISA-N 322.452 5.401 30 20 DKED C=C(C)[C@H](N[C@H]1CCCc2sccc21)c1ccc(F)c(F)c1 480683861 SDWCUDWFSZIYPC-WMZOPIPTSA-N 319.420 5.311 30 20 DKED C/C=C\c1ccc(NCc2cccc(OCCCC#N)c2)cc1 517776743 OFSDVWDOSVLNBG-KXFIGUGUSA-N 306.409 5.014 30 20 DKED C[C@@H]1CCC[C@@H](C(=O)Nc2sc(-c3ccccc3)cc2C#N)C1 525559417 PMOVGJWBAFDSLV-UKRRQHHQSA-N 324.449 5.052 30 20 DKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(C)cc1)c1ccccc1 533888279 AEHWJMPYYWMMSK-RXVVDRJESA-N 319.448 5.018 30 20 DKED CC(C)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 538393605 BNFHARBHEGXQGP-IFXJQAMLSA-N 312.844 5.260 30 20 DKED CC[C@@H](C)Oc1cccc(N[C@H](C)c2ccc(C#N)c(F)c2)c1 559876893 IVHJJWMGPVFWJZ-ZIAGYGMSSA-N 312.388 5.048 30 20 DKED CC(C)(C#N)CCSCc1cc(-c2ccc(Cl)cc2)no1 565270559 ZVZJGILWBIKUAD-UHFFFAOYSA-N 320.845 5.168 30 20 DKED Cc1ccc(F)c(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741473271 PHXWWDYERORUDF-SOFGYWHQSA-N 317.363 5.092 30 20 DKED C=CCN(C(=O)Nc1c(C(C)C)cccc1C(C)C)C(C)C 916706336 WYSMLEQIJILLFM-UHFFFAOYSA-N 302.462 5.362 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC[C@H](F)C1 424784580 ABQSWJJUFAFQLZ-HOTGVXAUSA-N 303.421 5.005 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1C 475546727 FKIQEBMMLJYAIU-INIZCTEOSA-N 314.473 5.335 30 20 DKED C[C@@H](Sc1nc2ccc(Cl)cc2o1)c1ccc(C#N)cc1 522823293 YEHBTQRTXOMMSZ-SNVBAGLBSA-N 314.797 5.206 30 20 DKED CCCc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 537951266 GXSNQNHASCLMFK-UWJYYQICSA-N 306.453 5.335 30 20 DKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2ccccc2s1 618807435 UNRPHNHFENMLRN-SCLBCKFNSA-N 318.445 5.111 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1ccc2ccccc2n1 744015246 KSICKBYUZGCBFX-NVXWUHKLSA-N 308.425 5.018 30 20 DKED Cc1cc(F)ccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 815635890 LOAVIZUHXKFEIV-OXQOHEQNSA-N 310.416 5.220 30 20 DKED COc1ccc(/C=C\C(=O)c2ccc(F)cc2F)c2ccccc12 915984082 HLGGAOFPNZFTMJ-POHAHGRESA-N 324.326 5.023 30 20 DKED Cc1ccsc1/C=C\C(=O)c1c[nH]c2cc(Cl)ccc12 920068885 SQHBEEKYGKDVHE-PLNGDYQASA-N 301.798 5.087 30 20 DKED Cc1csc(-c2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2)n1 183013748 IAQWNFLUCFBPOJ-CQSZACIVSA-N 319.433 5.163 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OC)c1 340458047 XNZLTLHXGLDMFV-LEWJYISDSA-N 322.452 5.171 30 20 DKED Cc1cc(Cl)ccc1CN[C@@H](CCCC#N)c1ccccc1 353916337 QAWIZRNSQGGMMM-IBGZPJMESA-N 312.844 5.173 30 20 DKED C=CCCc1ccccc1NC(=O)Nc1cc(C)c(O)c(C)c1C 505017275 TVBJUTWHLOETSO-UHFFFAOYSA-N 324.424 5.080 30 20 DKED CC(C)(C#N)CCCNc1ccccc1COc1ccccc1 532413944 XNYHJDWIYKTUOP-UHFFFAOYSA-N 308.425 5.007 30 20 DKED CC[C@H](Cc1cccs1)N[C@H](CCCC#N)c1ccccc1 590257331 LDRIZCQYRVVCDF-IEBWSBKVSA-N 312.482 5.094 30 20 DKED CC(F)(F)c1ccccc1NCc1ccc(C(C)(C)C#N)cc1 590778093 PHIYBVRSAAMMKA-UHFFFAOYSA-N 314.379 5.212 30 20 DKED CC[C@@H](C)Sc1ccc(N[C@H](C#N)Cc2ccccc2)c(C)c1 604526569 OCLLPYUUJKGRPD-AEFFLSMTSA-N 324.493 5.432 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccccc1 657929483 HXCTUKVLJPGWBJ-RHSMWYFYSA-N 316.395 5.377 30 20 DKED CCCCCCCC(=O)Nc1cc(-c2nc(C)co2)ccc1C 760026153 PAAFHJWLQFCDTK-UHFFFAOYSA-N 314.429 5.257 30 20 DKED Fc1cccc(Cl)c1NN=Cc1cscc1C(F)(F)F 811647559 QYUINIXCGXIWJB-UHFFFAOYSA-N 322.714 5.005 30 20 DKED C=CCCC[C@@H](NCc1ccc(C(F)F)nc1)c1ccccc1 883325194 RPFQKBYKVPYNAG-QGZVFWFLSA-N 316.395 5.206 30 20 DKED CC[C@@H](CC(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 410443458 LFMBNJVGVUYNKT-CABCVRRESA-N 318.486 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](C)CC 475550558 ONWVCQZFXNPYDJ-CABCVRRESA-N 302.462 5.095 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cccc(F)c1F)c1ccc(F)c(F)c1 480680807 LOXVXOJBFRKJFL-BBATYDOGSA-N 323.333 5.211 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C)c1ccc(C#N)cc1 540525314 SWGGRRHXRADVFD-RYMBOPBQSA-N 324.855 5.260 30 20 DKED C[C@H](N[C@@H](C#N)c1ccc(Cl)cc1)c1cc2ccccc2o1 585719288 MCODBDUCIFBYGX-LRDDRELGSA-N 310.784 5.002 30 20 DKED C=CC[C@@H](C)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 735065547 FBXQQVKIEWTXHV-LLVKDONJSA-N 321.873 5.373 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1cc(C)ccc1F 743572994 PHVFRONYPCGWGA-UHFFFAOYSA-N 324.509 5.513 30 20 DKED CC[C@@H](C)Oc1ccc(N[C@@H](C)c2ccc(C#N)cc2F)cc1 781423895 ZITHGZKRIZJQQT-KGLIPLIRSA-N 312.388 5.048 30 20 DKED C=CCC[C@@H](NCc1cc(C2CC2)no1)c1cccc(Cl)c1 903220182 LMTBCROOQBCABS-QGZVFWFLSA-N 316.832 5.003 30 20 DKED CCSc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 174055558 KWDZEALXTOCBKP-CABCVRRESA-N 310.466 5.082 30 20 DKED CSc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(C#N)cc1)CCC2 519829958 VRPUIJZJWWUNGL-VBKZILBWSA-N 322.477 5.008 30 20 DKED C=CCC[C@H](NCc1cc(Cl)nc(Cl)c1)c1ccccc1 775462656 BSYTWYMDJYVFSS-HNNXBMFYSA-N 321.251 5.186 30 20 DKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccccc1OC(F)F 794930995 IICXABLKPAOXNQ-YFHOEESVSA-N 324.273 5.122 30 20 DKED CCCCCCCCCC(=O)CCc1ccc(O)c(OC)c1 3610022 TYQRTQZWHUXDLG-UHFFFAOYSA-N 306.446 5.043 30 20 DKED endogenous,in-man C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H]1CC 191518649 WXFZYOCFXNSWCQ-CRAIPNDOSA-N 314.473 5.191 30 20 DKED Cc1ccc([C@@H](NCC2CCC(C#N)CC2)c2ccccc2)cc1 442879979 XQNKCSCUMCGYIL-AJTFCVKESA-N 318.464 5.004 30 20 DKED CC(C)(C#N)CCCN1CCC[C@@H]1c1cccc2ccccc12 472444288 QECCNDNQTBPISH-HXUWFJFHSA-N 306.453 5.307 30 20 DKED C[C@@H](SCCCCC#N)c1ccc(OC(F)(F)F)cc1 531945474 GFOOPLVDOPKDBU-LLVKDONJSA-N 303.349 5.073 30 20 DKED CC[C@@H](NCC(C)(C)CCC#N)c1ccc(Cl)c(Cl)c1 554367015 QNYPMUSFESVJFR-OAHLLOKOSA-N 313.272 5.364 30 20 DKED C=CCC[C@H](Nc1ccc(C)c(-c2ncco2)c1)c1ccco1 565136979 IXVXEWAWTDZRPB-KRWDZBQOSA-N 308.381 5.362 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 746047347 MGOXUVUKOJKITO-GUYCJALGSA-N 320.358 5.068 30 20 DKED C[C@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)c(F)c1 777673173 HBIUJIRLGBWNGL-JTQLQIEISA-N 322.355 5.185 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C)c1C 189874539 HHENGJOYSKNFHZ-UHFFFAOYSA-N 307.437 5.408 30 20 DKED Cc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1Cl 353915283 NCYFSYOPIKOOPY-IBGZPJMESA-N 312.844 5.173 30 20 DKED N#CCCCCS[C@H](c1ccccc1)c1ccc(F)c(F)c1 480387042 JNENMNWKEFBSNG-GOSISDBHSA-N 317.404 5.481 30 20 DKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1cccc2ccccc12 742429272 JVLNTZXKZUVLDI-BUHFOSPRSA-N 324.383 5.126 30 20 DKED O=C(/C=C\c1cccc2cnccc12)c1ccc2ccccc2c1 782879235 DPRWBXAZWMQXDX-KHPPLWFESA-N 309.368 5.284 30 20 DKED Cc1ncccc1/C=C\C(=O)c1ccc(SC2CCCC2)cc1 728786214 VHWNOJYVLWKWOY-RAXLEYEMSA-N 323.461 5.321 30 20 DKED Cc1cccc2c1C/C(=C/c1csc(-c3cccs3)n1)C2=O 729150498 KRRPDLYXARBRGZ-WQLSENKSSA-N 323.442 5.002 30 20 DKED CCCCCCCC[S@](=O)Cc1csc(C(C)(C)C)n1 790139735 MMMVZYZZIJMENO-FQEVSTJZSA-N 315.548 5.050 30 20 DKED CC(C)CC[C@H]1CCCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776033547 YAIINZXZMGOWDB-GFCCVEGCSA-N 322.836 5.042 30 20 DKED CCSc1ccccc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1 154328039 JUIRLYRXBXWLQD-CABCVRRESA-N 310.466 5.082 30 20 DKED C[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1cccc(C#N)c1 539495700 DBZNRJYCTCNXJN-VXGBXAGGSA-N 319.235 5.277 30 20 DKED Cc1ccc2cc(CN[C@H](CCCC#N)c3ccccc3)[nH]c2c1 594944343 NYONDXNRUVYSPE-HXUWFJFHSA-N 317.436 5.001 30 20 DKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 744016894 VNKJBLJTUKYUQN-DOTOQJQBSA-N 308.425 5.018 30 20 DKED C=CC[C@@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccncc1 779406369 WKVMBHLMUSGCOQ-LEWJYISDSA-N 322.427 5.064 30 20 DKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1nccc2ccccc12 805929357 BFJNZRKHIQUCHS-KRWDZBQOSA-N 308.425 5.018 30 20 DKED CC(C)(CCC#N)CNc1ccc([C@H](F)C(F)(F)F)cc1 883369414 QGPHQSYJSYXZAO-ZDUSSCGKSA-N 302.315 5.001 30 20 DKED CCCCCCCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 916848313 AEFMZIRFWRDTME-GOSISDBHSA-N 322.452 5.552 30 20 DKED N#CCCCOc1cccc(N[C@H](c2ccc(F)cc2)C2CC2)c1 324388760 PIZTWQSSBPOKBN-FQEVSTJZSA-N 324.399 5.071 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CCC[C@H]2CCCC[C@H]21 329114739 SLOMMACHMOJXAG-QGPMSJSTSA-N 323.440 5.271 30 20 DKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1 409708872 BRSBOJKKMSQHLL-UHFFFAOYSA-N 318.420 5.008 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(C#N)cc1)CC2 427870206 ZBLFFRLSIGNGSO-YCRPNKLZSA-N 304.437 5.020 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)CC1(C)C 475553339 UMTJEBQINOCWBR-HNNXBMFYSA-N 314.473 5.191 30 20 DKED C=CCC[C@H](N[C@@H](C)c1sc(CC)nc1C)c1ccccc1 540150310 IBVDHOVEJWHYSI-YOEHRIQHSA-N 314.498 5.372 30 20 DKED C[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1 551007071 CRPVYCZTKWRYNZ-LSDHHAIUSA-N 318.395 5.262 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC[C@H]1CCCCC1(F)F 594704307 ADVBMCYUWAOXJV-UONOGXRCSA-N 324.440 5.318 30 20 DKED N#Cc1cnc(Oc2ccc3oc4ccccc4c3c2)c(Cl)c1 609630739 CYGOMGWYXZMWDK-UHFFFAOYSA-N 320.735 5.298 30 20 DKED C[C@@H](SCc1nc(Cl)ccc1Cl)c1ccc(C#N)cc1 764940754 OLWJXXNJBLBELG-SNVBAGLBSA-N 323.248 5.254 30 20 DKED C=CCC[C@@H](NCc1coc(-c2cccs2)n1)c1ccccc1 178757790 SBVJQFYJVFYPLA-QGZVFWFLSA-N 324.449 5.200 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)[C@H]1C 191504835 LZNWYAGSGDMSRN-HZPDHXFCSA-N 314.473 5.191 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(OCC#N)cc1 192990084 JHCJTMOCMVXJHM-OXQOHEQNSA-N 322.452 5.027 30 20 DKED C[C@@H](SCc1ccccc1OC(F)F)c1ccc(C#N)cc1 522840031 YFLDLVMLOIHCGE-GFCCVEGCSA-N 319.376 5.154 30 20 DKED CC(C)(CCC#N)CN[C@H](c1cccc(C(F)(F)F)c1)C1CC1 554072460 GMMKHNCEQWKRKQ-INIZCTEOSA-N 324.390 5.076 30 20 DKED C[C@H](SCc1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 584137992 OEVUWSCZYHXIID-AWEZNQCLSA-N 320.417 5.208 30 20 DKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1cccc2ccccc12 742429273 JVLNTZXKZUVLDI-YPKPFQOOSA-N 324.383 5.126 30 20 DKED Cc1ccc2c(c1)C/C(=C\c1csc(-c3ccsc3)n1)C2=O 921270410 UZYDGDCTHWECBM-RIYZIHGNSA-N 323.442 5.002 30 20 DKED O=C(/C=C/c1cccc(O)c1)c1cc2c(ccc3ccccc32)o1 7716425 IPXDHDJMPQCTNO-CSKARUKUSA-N 314.340 5.188 30 20 DKED C[C@H](Nc1cccc(CCC(F)(F)F)c1)c1cccc(C#N)c1 182571958 GOODCZYZDLVXAN-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED CC(C)(C)c1cnc(C/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)o1 328792727 RNSMIMGSHWSPNV-SOUVJXGZSA-N 318.461 5.035 30 20 DKED C[C@H]1C[C@@H]1c1ccc(CN(CCCCC(C)(C)C#N)C2CC2)o1 444597693 ODCLDEIVJNATQC-YJBOKZPZSA-N 314.473 5.087 30 20 DKED CCOc1ccc(CN(CCCCC(C)(C)C#N)C(C)C)cc1 444610554 PRJCEXUTBJYPFD-UHFFFAOYSA-N 316.489 5.016 30 20 DKED Cc1cc(CN[C@@H](C)c2ccc(Cl)cc2Cl)ccc1C#N 488189512 ZSZWLNRFDBQFRJ-LBPRGKRZSA-N 319.235 5.024 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1 512659675 JECHBTBVCMLGMV-MGPUTAFESA-N 308.400 5.055 30 20 DKED C=CCC[C@@H](NCc1nc2ccccc2s1)c1ccccc1 538195147 OWEBJEKMIQOIDP-MRXNPFEDSA-N 308.450 5.093 30 20 DKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747198191 UKPFVNYMBQOOLI-UONOGXRCSA-N 306.475 5.049 30 20 DKED Cc1nc2cc(NCc3ccc(C(C)(C)C#N)cc3)ccc2s1 774298781 SGANEJLSUWTHRN-UHFFFAOYSA-N 321.449 5.018 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@]2(C)[C@H](C1)C2(F)F 816786867 OXHFGNASNYHWQW-DOTOQJQBSA-N 315.448 5.021 30 20 DKED CC(C)=CCC[C@@H](C)CC(=O)[C@H](C#N)c1nccc2ccccc12 842775387 MWBUGLRGGDSTEH-APWZRJJASA-N 320.436 5.184 30 20 DKED N#Cc1ccc(CNc2ccccc2SC2CCCC2)s1 157533540 IMHJEHJZZUPJDO-UHFFFAOYSA-N 314.479 5.267 30 20 DKED C[C@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1 192988871 JDSSBYJPMNHCMI-ZDUSSCGKSA-N 324.474 5.121 30 20 DKED CC(C)[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315860951 MKJRHCKLCGTDHY-LIRRHRJNSA-N 312.844 5.260 30 20 DKED C=CCC[C@@H](NCc1ccc(-c2ccncc2)cc1)c1ccco1 552058369 DVQIHXBTXQQTLQ-HXUWFJFHSA-N 318.420 5.139 30 20 DKED C[C@H](SCc1nc2ccccc2s1)c1ccc(C#N)cc1 609825106 GQBJVLMPSGJBHX-LBPRGKRZSA-N 310.447 5.162 30 20 DKED C[C@H](NCc1cc(-c2ccccc2)cs1)c1cccc(C#N)c1 610345030 QJFUKTWMCTZURU-HNNXBMFYSA-N 318.445 5.138 30 20 DKED N#Cc1ccccc1CNc1ccccc1Sc1ccccc1 610664026 USNZEXNGWCEYBM-UHFFFAOYSA-N 316.429 5.322 30 20 DKED Cc1ccc(C(=O)/C=C/c2ncc(-c3ccccc3)s2)s1 770570633 IDZHDBCAHXTZGJ-CSKARUKUSA-N 311.431 5.076 30 20 DKED CCCCCC[C@H]1CCCC1=NNc1ccc(C(=O)O)c(F)c1 1776074376 WUTOODZWKAXQSJ-ZDUSSCGKSA-N 320.408 5.062 30 20 DKED Cc1cc([C@H](C)Nc2cccc(OCCCC#N)c2)c(C)s1 193907647 FXFVEUHEIWXUOU-AWEZNQCLSA-N 314.454 5.221 30 20 DKED CCSc1cccc(CN[C@@H](CCCC#N)c2ccccc2)c1 353915275 MZSBDVLVTLXKQR-FQEVSTJZSA-N 324.493 5.323 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cccc(C(F)F)c1 486240396 BGHHJYZBDKTNAD-UHFFFAOYSA-N 319.376 5.155 30 20 DKED CC(C)(C)c1cnc(SCc2ccccc2C(C)(C)C#N)o1 489646482 IOQKRKAQUDQYGC-UHFFFAOYSA-N 314.454 5.066 30 20 DKED C[C@@H](Oc1ccccc1NCCCC(C)(C)C#N)c1ccccc1 531648180 OKWHHCCCPYRHEQ-QGZVFWFLSA-N 322.452 5.568 30 20 DKED N#CCCCCN[C@H](c1ccccc1)[C@@H]1CCCc2ccccc21 539331364 JDHSCSYRKMWTCP-FGZHOGPDSA-N 318.464 5.131 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 539610761 IITVQAVILIKLBH-MGPUTAFESA-N 308.400 5.055 30 20 DKED C=CCC(C)(C)c1noc(/C=C(/c2ccccc2)C(F)(F)F)n1 551472111 NKKZJROWGDDBFQ-QBFSEMIESA-N 322.330 5.026 30 20 DKED C=CCC[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccco1 560552794 GEJHJRTZVGGCQQ-HNNXBMFYSA-N 308.381 5.418 30 20 DKED CSCCc1ccccc1NCc1ccc(C(C)(C)C#N)cc1 600858648 SBKXNNMRGSBNJA-UHFFFAOYSA-N 324.493 5.005 30 20 DKED CC(=NNc1c(C)cc(C)cc1C)c1cnc2ccsc2c1 743445040 ATVGPGCGJQTNCE-UHFFFAOYSA-N 309.438 5.058 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C/c2cc(C#N)cs2)cc1 748440931 SYPRWVYLQFDRCQ-BQYQJAHWSA-N 313.447 5.016 30 20 DKED Cc1ccc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 799294098 RQQBRTVDAJRZCY-UHFFFAOYSA-N 320.436 5.366 30 20 DKED CCCCCCCSc1nnc(COc2ccc(C)cc2)o1 915794936 AIKRZTQLYWWESG-UHFFFAOYSA-N 320.458 5.020 30 20 DKED Cc1noc(C)c1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 916131927 NQZFQXCIENNIBK-CMDGGOBGSA-N 317.344 5.087 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 37777480 OQYDCLAHMIAENQ-LBPRGKRZSA-N 320.845 5.257 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccccc1 191386095 KGPJINPKRWEOMW-OXJNMPFZSA-N 311.473 5.131 30 20 DKED CC(C)c1ccoc1/C(O)=N/[C@@H](C)c1nc(C(C)(C)C)cs1 330476105 GYRQLFXFKZIGOL-NSHDSACASA-N 320.458 5.223 30 20 DKED CC[C@@H](C)[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462759495 CRJGTIFLWLEIRJ-KUHUBIRLSA-N 312.844 5.089 30 20 DKED C=CCC[C@H](NCc1nc2ccccc2s1)c1ccccc1 538195144 OWEBJEKMIQOIDP-INIZCTEOSA-N 308.450 5.093 30 20 DKED Cc1nc(-c2ccc(N[C@@H](C)c3ccc(C#N)cc3)cc2)oc1C 611482510 TZTDLURSJDGARU-AWEZNQCLSA-N 317.392 5.003 30 20 DKED CC(C)(C#N)c1ccc(CN[C@@H](CC2CC2)c2ccccc2)cc1 614178823 FQDKGERVUPQWSW-NRFANRHFSA-N 318.464 5.119 30 20 DKED CC(C)(C#N)CCCNc1ccc(C(C)(C)C(F)(F)F)cc1 617764563 BRDDCYFTQKUBNU-UHFFFAOYSA-N 312.379 5.268 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1nc(C)sc1C)c1ccc(F)c(F)c1 681401415 RURMOIWJIXQQQD-QFYYESIMSA-N 322.424 5.006 30 20 DKED CCCCCCCC(=O)Nc1scnc1-c1ccccc1 727993683 UGNPLCSSXPKZCJ-UHFFFAOYSA-N 302.443 5.109 30 20 DKED C=CC[C@@H](N[C@H](CCC)c1ccc(Cl)cc1)c1ccncc1 766021875 VFXPTDFHQOZHLT-RTBURBONSA-N 314.860 5.483 30 20 DKED CC[C@H](C)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 795206040 VLPQEDCEQDKYSN-JXFKEZNVSA-N 320.436 5.107 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc2ccccc2s1 181724824 YGJHBQBTJIODSE-KGLIPLIRSA-N 306.434 5.185 30 20 DKED N#Cc1cccc(SCc2c(Cl)ccc3cccnc23)c1 435030090 YMXZMNAZFTXEQK-UHFFFAOYSA-N 310.809 5.052 30 20 DKED CC(C)(C#N)CCCCSC[C@@H]1CCC2(CCCCC2)O1 435881448 AWFHCPVIRMFAKN-INIZCTEOSA-N 309.519 5.322 30 20 DKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2cccc3ccccc23)CC1 464656763 ZRBSLPRVYFFMIP-QGZVFWFLSA-N 321.464 5.148 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512625788 QMDQPIWONFCKGW-HUUCEWRRSA-N 310.416 5.233 30 20 DKED C[C@H](Sc1cc(C#N)ccn1)c1ccc(Cl)c(Cl)c1 515850279 LXFKTDNERMIVGX-VIFPVBQESA-N 309.221 5.113 30 20 DKED CC1(C)CCC(CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)CC1 752473401 HARRNSHNBYDQIQ-KRWDZBQOSA-N 320.436 5.018 30 20 DKED C[C@]1(C=NOc2ccccc2C(F)(F)F)C[C@@H]1c1ccccc1 841633183 NMWHYRJHKOQHDP-NVXWUHKLSA-N 319.326 5.264 30 20 DKED C[C@@H]1CC[C@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 358350162 ZOUIISCCCSQVPI-HBGVWJBISA-N 304.437 5.260 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H](C)c1cc2ccccc2o1 410370292 SDDGLCLHUZMLKP-HNNXBMFYSA-N 319.404 5.294 30 20 DKED CC[C@@H](C)[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462759490 CRJGTIFLWLEIRJ-AUUYWEPGSA-N 312.844 5.089 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc2c(c1)COC2)c1ccccc1 539046385 DUHZYCUGEFSYKT-KKSFZXQISA-N 307.437 5.075 30 20 DKED CCC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1F 540594486 KPVJKOLGGFINLI-BFUOFWGJSA-N 314.379 5.028 30 20 DKED C=CCC[C@@H](NCc1cc(F)c(Cl)cc1F)c1ccco1 560536263 NLRCHIORWQMPNQ-OAHLLOKOSA-N 311.759 5.008 30 20 DKED Cc1cc(S[C@@H](C)c2ccc(C#N)cc2)c2ccccc2n1 609825893 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CCCCCCCC(=O)Nc1cccc(C2SCCS2)c1 825540345 RKXWOXAUJAPJOJ-UHFFFAOYSA-N 323.527 5.464 30 20 DKED CCCCCC(CCCCC)=NNc1cccc(C(=O)O)c1 1776036927 WBWVFWLHPKNIEU-UHFFFAOYSA-N 304.434 5.313 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1 189909014 ZEFPLRWRGXZGFU-UHFFFAOYSA-N 313.828 5.444 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C3CCC3)cc2)n1 192242121 OUVMHQMMUWBESN-INIZCTEOSA-N 324.449 5.024 30 20 DKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3ccccc3)cc2)cn1 214916743 IVHXIEJZPWDMHO-RAXLEYEMSA-N 316.404 5.027 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)CCC 485693286 ITOGMFIGKHVWAK-UHFFFAOYSA-N 301.474 5.693 30 20 DKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1ccc(C#N)cc1 531951503 OHGFTKGNKNOZEJ-HOTGVXAUSA-N 316.404 5.230 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@H](C)c1cccc(C#N)c1 610830043 ZBLADQATMRSWBE-HUUCEWRRSA-N 310.466 5.082 30 20 DKED CC(C)C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccccc1 619755362 FUHRZVUSNGIJKG-LJQANCHMSA-N 312.844 5.089 30 20 DKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)CCc2ccccc21 727263911 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20 DKED O=C(/C=C/c1ccc(F)cc1)c1cc(Cl)sc1Cl 744868704 IPROTUQVANNUCT-ZZXKWVIFSA-N 301.169 5.090 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1cccc(F)c1 789718410 GXZWHKNBVRXZFN-SEYXRHQNSA-N 323.411 5.330 30 20 DKED C[C@H](c1cccc(Cl)c1)[S@@](=O)CCC1(C#N)CCCCC1 417181634 RTHDAOCYTUBWOV-SZNDQCEHSA-N 323.889 5.014 30 20 DKED CC[C@@H](Nc1ccc(COC(C)C)cc1)c1ccc(C#N)cc1 447578430 FMEWHTJAILVYKK-HXUWFJFHSA-N 308.425 5.046 30 20 DKED C=C(C)[C@@H](NCc1cccc(C(F)F)c1)c1ccc(F)c(F)c1 470762596 VTTMCBGAFLYMII-QGZVFWFLSA-N 323.333 5.309 30 20 DKED CC1(C)Cc2occc2[C@H](Nc2cccc(OCCCC#N)c2)C1 498755461 YQAIBPPPLCKWLH-GOSISDBHSA-N 324.424 5.088 30 20 DKED C=CCC[C@H](NCc1ccc(C(C)C)nc1C)c1ccccc1 559147604 AMWQVVUFFAPCHE-NRFANRHFSA-N 308.469 5.311 30 20 DKED C[C@H](S[C@@H](C#N)Cc1ccccc1)c1ccc(Cl)cc1 604485850 VXMITCZOSUXRLY-SUMWQHHRSA-N 301.842 5.269 30 20 DKED O=C(/C=C/c1cccc(F)c1)c1ccc(SC(F)F)cc1 734981826 USZTUIZIBGRNPW-RUDMXATFSA-N 308.324 5.037 30 20 DKED CC(C)c1ccccc1CNc1ccccc1SC[C@@H](C)C#N 864006687 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C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1cccs1 189874835 QQEDVWOVTALOOR-VAWYXSNFSA-N 311.450 5.252 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H](C)C1 191464878 DRACEWMBUGYDGS-CVEARBPZSA-N 314.473 5.048 30 20 DKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1cccc2ccccc12 464646805 ZJXHFIHIHUYBGT-OXQOHEQNSA-N 307.437 5.106 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CCC1CC1 475576891 BCJSNGZTWKTNGJ-UHFFFAOYSA-N 314.473 5.192 30 20 DKED CSc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1Cl 540832955 MTHMORIJXORMMF-LLVKDONJSA-N 302.830 5.107 30 20 DKED C=CCC[C@H](NCc1ccc(C(C)(F)F)cc1)c1ccco1 559875988 CZMVZKUUVJVSDG-INIZCTEOSA-N 305.368 5.188 30 20 DKED Cc1c(C(=O)/C=C/c2cnc(C(C)C)s2)oc2ccccc12 758431214 VZFDRDSAMGOBDK-CMDGGOBGSA-N 311.406 5.217 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1nccc2ccccc12 792106609 SFSZRJQOTUMJML-CRAIPNDOSA-N 308.425 5.018 30 20 DKED CCCCCC(C)=NNc1nc(C(F)(F)F)nc2ccccc12 818266514 YOVXHHOSOOWZSL-UHFFFAOYSA-N 324.350 5.017 30 20 DKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCC(C)(C)C#N 287691676 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Cc1cc(F)ccc1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741472294 HCPGVKGDSTUEHH-SOFGYWHQSA-N 317.363 5.092 30 20 DKED C=CC[C@@H](N[C@H](C)c1cc2ccc(C)cc2o1)c1ccncc1 756036075 NZWZZVLJKDYEJB-CRAIPNDOSA-N 306.409 5.104 30 20 DKED C#CC[C@@H](N[C@@H](C)c1cc2ccc(C)cc2o1)c1ccccc1 756040276 JBMFMBKRJVLDJX-QFBILLFUSA-N 303.405 5.156 30 20 DKED O=C(/C=C/c1ccc(SC(F)F)cc1)c1ccccc1F 781543946 SEYQIQSEQWDUKT-JXMROGBWSA-N 308.324 5.037 30 20 DKED CCCCCCCCC(=O)N1CCCCC[C@@H]1c1cccn1C 912999585 UMEDQIZSXFOVOZ-LJQANCHMSA-N 318.505 5.219 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(C)c1 476118023 LBRVRWZMGWPDGH-QGZVFWFLSA-N 321.464 5.589 30 20 DKED CC(C)(C)c1ccc(CN[C@H](CCC#N)c2ccccc2)s1 533497635 MIBOVLSYEKPONS-QGZVFWFLSA-N 312.482 5.180 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1cccc(Cl)c1Cl 782325049 KOMYVGZFNQTFBV-SREVYHEPSA-N 324.232 5.223 30 20 DKED O=C(/C=C\c1cccs1)c1ccc(N2CCCCCC2)cc1 916132373 AONWQPTZRIJMEN-QXMHVHEDSA-N 311.450 5.025 30 20 DKED N#CCC[C@H](Nc1cc2ccccc2c(Cl)n1)c1ccccc1 301785702 LRERFGRLRLFOGP-KRWDZBQOSA-N 321.811 5.345 30 20 DKED Cc1ccc(CNc2ccccc2SC[C@H](C)C#N)cc1C 432330201 YNUAHFYTGZNOMC-CQSZACIVSA-N 310.466 5.167 30 20 DKED CC[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 447525570 ARAIATSKDGGPDP-KDOFPFPSSA-N 320.461 5.575 30 20 DKED N#CCC[C@H](C#N)COc1ccc(Cl)cc1C1CCCCC1 550177363 VMOITLYGDANMAR-CQSZACIVSA-N 316.832 5.210 30 20 DKED C=CCC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccco1 563555964 SAVNMXXDEDOQRS-GOSISDBHSA-N 310.397 5.082 30 20 DKED Cc1cc(C)c2c(c1)CC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 594505959 GJUODJOQGPUPEX-SFTDATJTSA-N 318.464 5.316 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747194168 VQZAUNNWWZKZSP-ZIAGYGMSSA-N 306.475 5.049 30 20 DKED C=CC[C@H](N[C@@H](C)c1cc2cc(C)c(C)cc2o1)c1ccncc1 766018461 HYPOPCZSEJIVOV-LPHOPBHVSA-N 320.436 5.413 30 20 DKED C=CCC[C@@H](NC(=S)Nc1c(C)cccc1C)c1ccccc1 771848536 AZRSEVRQLZMDCK-GOSISDBHSA-N 324.493 5.297 30 20 DKED CSc1ccc(NN=CC2CCC(C(F)(F)F)CC2)cc1 834998270 DYTHWBZAHAUJIP-UHFFFAOYSA-N 316.392 5.175 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1cc(C)no1 917172807 BXGPIZOTKJNHTD-KRWDZBQOSA-N 320.477 5.177 30 20 DKED CC(C)(C#N)CCCN1CCCC[C@H]1c1cc2ccccc2[nH]1 174853320 GIBCIYSACXVJJZ-IBGZPJMESA-N 309.457 5.025 30 20 DKED C=CCC[C@H](NCc1ncc(-c2ccccc2)o1)c1ccccc1 180045490 DHPGUNDGZBCDKJ-IBGZPJMESA-N 318.420 5.139 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC)c1 340458050 XNZLTLHXGLDMFV-SFTDATJTSA-N 322.452 5.171 30 20 DKED Cc1c(COC(C)(C)C)cccc1NC1CCC(C)(C#N)CC1 449041862 OUWAGCJWFWVTHD-UHFFFAOYSA-N 314.473 5.195 30 20 DKED N#CCCC[C@H](NCC/C=C/c1ccccc1)c1ccccc1 451067469 XCASCRCYLHICPQ-LNYGYFNRSA-N 304.437 5.115 30 20 DKED C[C@H](CCCC(F)(F)F)N[C@H]1CCCCc2cc(C#N)ccc21 481995079 ZYUILXXWLCRILG-DYVFJYSZSA-N 324.390 5.036 30 20 DKED CC(C)C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1 512625756 QHGOMBIYZHDBSD-FOIQADDNSA-N 310.416 5.135 30 20 DKED N#Cc1ccc2c(c1)[C@H](N[C@H](CC1CCC1)c1ccccc1)CC2 564433755 VYGYIXOAIDJVMT-FGZHOGPDSA-N 316.448 5.067 30 20 DKED N#CCCC[C@H](NCc1cccc(C2CC2)c1)c1ccccc1 421380053 JDOMHUGPXIRYJE-NRFANRHFSA-N 304.437 5.089 30 20 DKED N#CCCCCSCc1cc(Br)ccc1Cl 480361378 JAEVXEUXRIKWPK-UHFFFAOYSA-N 318.667 5.030 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccsc2)cc1 741468596 FUADHIBARDEWDM-WDZFZDKYSA-N 320.413 5.320 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)CC2CCC(C)(C)CC2)n1 752511509 CWGBJUDUEKAMPR-CQSZACIVSA-N 318.486 5.049 30 20 DKED CC(C)(C#N)CCCSCc1ccccc1C(F)(F)F 507131284 GNFYCOZUZCDQNJ-UHFFFAOYSA-N 301.377 5.269 30 20 DKED CCOc1ccccc1[C@H](CC(C)C)NCCCC(C)(C)C#N 540426543 GMRGNCZXIAJNEJ-SFHVURJKSA-N 316.489 5.092 30 20 DKED C=CCC[C@H](NCc1ccccc1COC(C)C)c1ccco1 556865454 RUNCHOFVLURQSV-IBGZPJMESA-N 313.441 5.002 30 20 DKED CC[C@H](Nc1ccc2cnn(C(C)C)c2c1)c1ccc(C#N)cc1 575867722 UCMCBIFETOMDNU-IBGZPJMESA-N 318.424 5.052 30 20 DKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccc(Cl)s1 741840054 DFBZOEVVOHTXFZ-NSCUHMNNSA-N 306.745 5.183 30 20 DKED Cc1nc(-c2ccc([C@@H](C)/N=C/c3ccccc3O)cc2)cs1 783254888 OFVDWVZEOIZCKT-AYPRBGQRSA-N 322.433 5.004 30 20 DKED C=CC[C@H](N[C@@H](CC)c1sccc1Cl)c1ccncc1 883190254 YOHYFMZZONDGCD-GJZGRUSLSA-N 306.862 5.155 30 20 DKED C[C@@H](Nc1ccccc1CCC(F)(F)F)c1ccc(C#N)cc1 89099324 RTCYDSFOVBQSQW-CYBMUJFWSA-N 318.342 5.226 30 20 DKED N#CCCC[C@H](N[C@@H]1CCCc2ccc(F)cc21)c1ccccc1 340445554 FIAQUKZPQAPTLP-LEWJYISDSA-N 322.427 5.228 30 20 DKED C[C@@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1 495402824 SKICEOHCXUGRGZ-IIBYNOLFSA-N 304.437 5.140 30 20 DKED CCC(CC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 511573677 IHZOYCNHHWUKQG-UHFFFAOYSA-N 322.408 5.034 30 20 DKED CCN(Cc1cc(C#N)ccc1F)[C@@H](C)c1cc2ccccc2o1 513411956 RQQMHNZQRIQIOD-AWEZNQCLSA-N 322.383 5.027 30 20 DKED Cc1cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc(C)c1F 572189482 UMMXCZHHOGRDAD-YLJYHZDGSA-N 324.443 5.528 30 20 DKED Cc1ncsc1/C=C/C(=O)c1ccc(Oc2ccccc2)cc1 742429461 RBJKISNGLWBWLK-VAWYXSNFSA-N 321.401 5.140 30 20 DKED O=C(/C=C\c1csc2ccccc12)c1ccc(F)c(F)c1 810228476 VPVZJMMGBMKESL-VURMDHGXSA-N 300.329 5.076 30 20 DKED CCCCCCCCC(=O)[C@@H](C#N)c1nc2ccccc2s1 916846349 QLSZPLCAUIAZDG-CQSZACIVSA-N 314.454 5.223 30 20 DKED CCCCCCCCC(=O)Nc1ccc(-c2cnco2)cc1 918629929 XZVSWENHYFOBRJ-UHFFFAOYSA-N 300.402 5.031 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1C 935593798 ZZUFLJNJDNQQCL-UHFFFAOYSA-N 320.436 5.195 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 91412142 AEQDBCCBRNNODM-HNNXBMFYSA-N 318.445 5.138 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@H](CCC#N)c1ccccc1)CCC2 358336080 CAQQMRDIIKFMGB-RTWAWAEBSA-N 304.437 5.007 30 20 DKED CC[C@H](CC(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 410443464 LFMBNJVGVUYNKT-LSDHHAIUSA-N 318.486 5.092 30 20 DKED CC(C)C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccs1 539608470 MRPBJDJDILUNOJ-CXAGYDPISA-N 316.445 5.197 30 20 DKED CC[C@H](C)Sc1ccc(NC(=O)CCCCCC#N)c(C)c1 588154982 UQZBJQNFWHQDOC-HNNXBMFYSA-N 318.486 5.298 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3C)o2)o1 734306461 OVOSOKMRZJWMEF-CLFYSBASSA-N 310.324 5.192 30 20 DKED C=CCn1c(C)cc(C(=O)CS[C@@H](C)c2cccs2)c1C 737402963 ROYAJFKHKJDCTQ-AWEZNQCLSA-N 319.495 5.030 30 20 DKED CCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1nccc2ccccc12 792092062 OJWSIVHFQYSMGF-WIYYLYMNSA-N 322.452 5.408 30 20 DKED C=CCCC(=O)Nc1cc(Cl)ccc1Oc1ccccc1 60364713 QLTUXAMCZCKOPV-UHFFFAOYSA-N 301.773 5.037 30 20 DKED N#CCCCCSCc1nc(-c2ccccc2Cl)cs1 184904188 AKTVQPIEWMBLDP-UHFFFAOYSA-N 322.886 5.391 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccccc1C(F)(F)F 410356532 WMRTUMJALLUPJD-UHFFFAOYSA-N 319.326 5.076 30 20 DKED C=CCC(CC=C)C(=O)N1CCCCC[C@@H]1c1ccc(CC)o1 467535753 BFTOMCDRZGJUBH-GOSISDBHSA-N 315.457 5.054 30 20 DKED CC1(C)CC[C@@H]2C[C@@H](NCc3cc(C#N)cs3)c3cccc1c32 538487689 TUJVNQAQSDPLAL-RDTXWAMCSA-N 322.477 5.009 30 20 DKED CCCCCCCC[C@@H](C)CC(=O)N(C)c1c(C)noc1C 775179467 BHTBLJIILBWHSO-CQSZACIVSA-N 308.466 5.031 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1c(F)cccc1Cl 809159522 QYRSESBVWZCDIK-RMKNXTFCSA-N 310.702 5.313 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1ccccn1 919828277 YOVKGAWVJSAKAR-LJQANCHMSA-N 316.489 5.276 30 20 DKED CCC(CC)(NCc1ccc(C#N)s1)c1ccc(Cl)cc1 236916797 NWRQQQUFKSOVBI-UHFFFAOYSA-N 318.873 5.078 30 20 DKED C=C[C@](C)(CC)C(=O)N1CC=C(c2cccc3ccccc23)CC1 442952735 TZSZHLLCAYNJRS-JOCHJYFZSA-N 319.448 5.058 30 20 DKED C[C@H](S[C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C#N)c1 443162712 SWLPEMAVCUHMMW-QWHCGFSZSA-N 312.394 5.022 30 20 DKED CC(C)(C#N)CCCN[C@@H](CCc1ccccc1)c1ccccc1 539276824 OARRJAYYGDVAAJ-NRFANRHFSA-N 320.480 5.280 30 20 DKED C[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1 551007069 CRPVYCZTKWRYNZ-GJZGRUSLSA-N 318.395 5.262 30 20 DKED CC(C)C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccs1 619755877 XDMKFONYAUVVJJ-INIZCTEOSA-N 318.873 5.150 30 20 DKED Cc1ccc2cc(C(=O)/C=C\c3cncc4ccccc34)oc2c1 754827817 BETGBWVGDOAAMT-HJWRWDBZSA-N 313.356 5.186 30 20 DKED C#CCCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 766917949 IUPAOWKGFUPQRT-SFHVURJKSA-N 322.452 5.015 30 20 DKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1nccc2ccccc12 792104120 WUZFYNDFOBCTGL-MAUKXSAKSA-N 308.425 5.018 30 20 DKED COc1cccc2cc(C(=O)/C=C\c3ccc(SC)cc3)oc12 916130566 WZRKHLODMPBWTI-FLIBITNWSA-N 324.401 5.059 30 20 DKED Cc1cccc2c1[C@@H](C)C[C@@H]2N[C@@H](CCC#N)c1ccccc1 90665682 WYYDKHJKBASRAL-VDGAXYAQSA-N 304.437 5.178 30 20 DKED Cc1nc(-c2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 192948269 QZVRSKSDAPOBKX-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED O=CCCCCCCCCCCCCCCCCCC(=O)O 224789510 JLQXUMTUWRGNMR-UHFFFAOYSA-N 312.494 5.902 30 20 DKED CC(C)(CCC#N)CN[C@H]1CCCSc2ccc(Cl)cc21 348220763 VNYPTPROLOJNQB-HNNXBMFYSA-N 322.905 5.187 30 20 DKED CCOc1ccccc1[C@H](CC)N[C@@H](CC)c1ccc(C#N)cc1 447546765 YQYABJQJDYXAIH-PMACEKPBSA-N 322.452 5.149 30 20 DKED C[C@H](S[C@@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1 522962110 XAICEMQQMAMIJA-RYUDHWBXSA-N 303.377 5.392 30 20 DKED C[C@@H](NCc1ccc(CC#N)cc1)c1cc2cc(Cl)ccc2o1 558409128 OTTAADPVCBNCJT-CYBMUJFWSA-N 324.811 5.003 30 20 DKED C[C@H](NCC(C)(C)CCC#N)C(c1ccccc1)c1ccccc1 578803602 IGVHAYJFGTYBAM-SFHVURJKSA-N 320.480 5.127 30 20 DKED Cc1ccc([C@@H](NCc2ccc(C#N)c(Cl)c2)C2CCC2)cc1 619755066 RZTYIHYWKKDVOC-FQEVSTJZSA-N 324.855 5.151 30 20 DKED O=C(/C=C\c1ccc(-c2c(F)cccc2F)o1)c1cccs1 734366504 UTAHACZGRLIGEI-VURMDHGXSA-N 316.328 5.182 30 20 DKED CCCCCCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1 742964432 AKOXXHHGGRXUNK-WBVHZDCISA-N 305.462 5.248 30 20 DKED O=C(/C=C\c1cncc2ccccc12)c1ccc2ccccc2c1 772800735 AUFNSCFPWDYSBI-QXMHVHEDSA-N 309.368 5.284 30 20 DKED Cc1cc2cc(C(=O)/C=C/c3scnc3C3CC3)oc2cc1C 782341958 MWGHTMXBVPNSHC-AATRIKPKSA-N 323.417 5.280 30 20 DKED O=C(/C=C\c1ccc2oncc2c1)c1ccc(Cl)c(Cl)c1 821027304 FZKRVINRFSSCTQ-KTAJNNJTSA-N 318.159 5.031 30 20 DKED N#CCCC[C@@H](NCc1cccc(C2CC2)c1)c1ccccc1 421380055 JDOMHUGPXIRYJE-OAQYLSRUSA-N 304.437 5.089 30 20 DKED C=C[C@@H](CC(=O)Nc1cccc(C(C)(F)F)c1)c1ccccc1 440645490 JDORREMXNSTWLZ-AWEZNQCLSA-N 315.363 5.097 30 20 DKED C[C@@H](SCc1ncc(Cl)cc1Cl)c1cccc(C#N)c1 443156700 STPKXZMARKVCGY-SNVBAGLBSA-N 323.248 5.254 30 20 DKED CC(C)Sc1c(Cl)cccc1NCc1ccc(C#N)cc1 462246299 QISIMCGQDVWFIL-UHFFFAOYSA-N 316.857 5.324 30 20 DKED C=CCC[C@H](NCc1cnc2ccccc2c1)c1ccccc1 499609984 JAGQAVAZUUGZCF-FQEVSTJZSA-N 302.421 5.032 30 20 DKED CCOc1cccc2cc([C@H](C)Nc3cccc(F)c3C#N)oc12 501955915 LVUGCDLMMUJLET-LBPRGKRZSA-N 324.355 5.015 30 20 DKED C[C@@H](CCc1ccccc1)Nc1ccccc1SC[C@H](C)C#N 520835878 YJQJBEZXFXGAOT-SJORKVTESA-N 324.493 5.372 30 20 DKED CC(C)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 609378778 QXIZJYLQOSAFOE-UHFFFAOYSA-N 324.449 5.068 30 20 DKED Cc1cc(SC(C)(C)C)ccc1NCc1ccc(C#N)cc1 725794486 GUZBIIPXMCBSMR-UHFFFAOYSA-N 310.466 5.369 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@H](c2ccco2)C1 732129734 DHBVBVRWCCIPEL-KRWDZBQOSA-N 305.462 5.126 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccc(Cl)s2)s1 736433170 MOVXPRGXNJXNLV-PLNGDYQASA-N 311.859 5.052 30 20 DKED Fc1cccc(Cl)c1NN=CC1CCC(C(F)(F)F)CC1 769827156 PPVYVSXMRLFNJG-UHFFFAOYSA-N 322.733 5.246 30 20 DKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 776092258 ASGNSUZGKUSYER-KBPBESRZSA-N 306.475 5.049 30 20 DKED C=C(C)CSCC(=O)Nc1c(C(C)C)cccc1C(C)C 177872735 ROCYWPSAHSHKKX-UHFFFAOYSA-N 305.487 5.181 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@H]1CCCCC1(C)C 330126917 CHARWKZXPDLXGO-OAHLLOKOSA-N 311.429 5.190 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 444670933 HCELHBMKZOOHOW-CYBMUJFWSA-N 312.379 5.076 30 20 DKED C[C@H](C#N)CSc1ccccc1N[C@H](C)CCc1ccccc1 520835876 YJQJBEZXFXGAOT-IAGOWNOFSA-N 324.493 5.372 30 20 DKED C[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1ccc(C#N)cc1 610340820 HFVUNZWFOMQUNB-ZDUSSCGKSA-N 319.408 5.170 30 20 DKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2ccccc2)cc1 618742038 PRLVBSBCEWUVAB-HSZRJFAPSA-N 324.427 5.002 30 20 DKED CCCCCCCC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F 742780170 DOQRXZVKOUTHSI-MAUKXSAKSA-N 305.437 5.096 30 20 DKED O=C(/C=C/c1cnc(C2CCC2)s1)c1csc(Cl)c1 787185668 IJHZMODFBSSRNO-SNAWJCMRSA-N 309.843 5.022 30 20 DKED CCC[C@H](C)CCCC(C)=NNc1cccc(C(=O)O)c1C 1776088690 CHSKYVJWIMWEFI-ZDUSSCGKSA-N 304.434 5.088 30 20 DKED CC(C)[C@@H](NCC1CCC(C#N)CC1)c1cc2ccccc2o1 442871294 FIAHRZHTTLXXGZ-ALLBUHFWSA-N 310.441 5.049 30 20 DKED CC[C@H](N[C@@H](CC)c1cc(F)ccc1F)c1ccc(C#N)cc1 447588543 URPWUNGCFZYAGD-OALUTQOASA-N 314.379 5.028 30 20 DKED Cc1nc(SCCCC(C)(C)C#N)c2c(C)c(C)sc2n1 475941863 VNSAFSISPYJWNU-UHFFFAOYSA-N 319.499 5.039 30 20 DKED CC(C)C[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccs1 512668093 SQRGQFGDNLNIFR-SUMWQHHRSA-N 316.445 5.197 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(F)c(OC)c1)c1ccccc1 536833603 PYOGDANMIQZJEW-BEFAXECRSA-N 313.416 5.192 30 20 DKED C=CCC[C@H](N[C@H](C)c1cc2ccccc2[nH]1)c1ccccc1 775632326 YISOIGPGHGQUFJ-APWZRJJASA-N 304.437 5.526 30 20 DKED Cc1ccc(-c2nc(/C=C3/C(=O)c4ccccc4[C@@H]3C)co2)cc1 809156896 OPUIOJLTZAUUDK-YRIIZNAFSA-N 315.372 5.033 30 20 DKED CC[C@H](C)c1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1 1776698206 IJIPXTNPQUKLHA-BCNIOPEESA-N 322.404 5.103 30 20 DKED C=C[C@@H](CC(=O)N1CCCCC[C@@H]1c1ccco1)c1ccccc1 135275334 ZZFMWEOUHJACJH-PKOBYXMFSA-N 323.436 5.083 30 20 DKED Cc1cccc2c1CC[C@H]2N[C@@H](CCCC#N)c1ccccc1 340453966 SMVILZRNSQZBDD-LEWJYISDSA-N 304.437 5.007 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 358345849 PKXOJMJPJQWHCT-UZLBHIALSA-N 324.493 5.494 30 20 DKED O=C(/C=C\c1nccs1)c1ccc(SC2CCCC2)cc1 735229287 XWPMLZNDVKIQCX-KTKRTIGZSA-N 315.463 5.074 30 20 DKED C#CC[C@H](N[C@H](C)c1cc2ccc(C)cc2o1)c1ccccc1 756040274 JBMFMBKRJVLDJX-APWZRJJASA-N 303.405 5.156 30 20 DKED CC1(C)CCC(CC(=O)[C@H](C#N)c2nccc3ccccc23)CC1 792105465 MIZSCPOLZZWBHP-SFHVURJKSA-N 320.436 5.018 30 20 DKED C[C@@H](Sc1nc(Cl)c(C#N)s1)c1ccc(Cl)cc1 804389150 NGJZPLKMIPYEER-SSDOTTSWSA-N 315.250 5.175 30 20 DKED N#Cc1ccc(CN[C@@H]2CCc3ccc(-c4ccccc4)cc32)cc1 495195474 VMNGUTQMKWNMNU-HSZRJFAPSA-N 324.427 5.002 30 20 DKED CC[C@@H](NCc1ccc2sccc2c1)c1ccc(C#N)cc1 580249295 BJNXEGDAXKBPTD-GOSISDBHSA-N 306.434 5.014 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3C)o2)o1 734306462 OVOSOKMRZJWMEF-VQHVLOKHSA-N 310.324 5.192 30 20 DKED C#CCCCCCC(=O)Nc1cccc(CSC(C)C)c1C 779920464 JPIQYVNXOYSBEO-UHFFFAOYSA-N 317.498 5.159 30 20 DKED COc1cccc2cc(/C=C/C(=O)c3ccc(SC)cc3)oc12 72067732 KQRPCBLWXPIHFX-DHZHZOJOSA-N 324.401 5.059 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCC1CCC(F)(F)CC1 417036168 SQOKEDNCQNZZQE-CYBMUJFWSA-N 324.440 5.318 30 20 DKED Cc1ccc(F)c(CNc2ccccc2S[C@H](C)CC#N)c1 453076902 AHPAMYFKYQUWGT-CQSZACIVSA-N 314.429 5.141 30 20 DKED CC(C)(C#N)CCCSCc1ccc(Br)cc1 476522787 RWOBGALGTAROIV-UHFFFAOYSA-N 312.276 5.012 30 20 DKED Cc1cc(CNCC(C)(C)CCC#N)ccc1-c1ccccc1 494256375 ISILZJMBFRKCRT-UHFFFAOYSA-N 306.453 5.082 30 20 DKED CC(C)(C)C[C@@H](NCCCC(C)(C)C#N)c1ccc(F)cc1 540366809 XRBFGYQVIRHQNE-QGZVFWFLSA-N 304.453 5.223 30 20 DKED CC(C)(c1ccc(NCc2ccc(C#N)cc2)cc1)C(F)(F)F 428536198 RHWXQSGPHKPZBA-UHFFFAOYSA-N 318.342 5.010 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2c(C)cccc2Cl)CCCC1(C)C 445164230 KBUGNVCWEOVZRS-HNNXBMFYSA-N 320.864 5.247 30 20 DKED N#CCC[C@@H](/N=C/c1c(O)ccc2ccccc12)c1ccccc1 747690594 OSKKVCSBTLOIEM-KMUCBOENSA-N 314.388 5.009 30 20 DKED C[C@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)c(F)c1 776739078 LPVMAZKGIQKCOH-QWHCGFSZSA-N 324.424 5.324 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccc(F)cc1 918723741 WFBKCTPXXWUQGO-UHFFFAOYSA-N 310.482 5.205 30 20 DKED C[C@@H](NN=Cc1sc2ccccc2c1Cl)c1ccccc1 920383649 XZMZAGCLCJXAIV-GFCCVEGCSA-N 314.841 5.239 30 20 DKED N#CCC[C@@H](NCc1cc2ccccc2s1)c1ccccc1 130558289 HWZNGDHTQJFMHB-GOSISDBHSA-N 306.434 5.036 30 20 DKED CC(C)(C#N)CCCN(Cc1ccc2ccccc2c1)C1CC1 472447892 FTSQUIRUCHOALW-UHFFFAOYSA-N 306.453 5.134 30 20 DKED Cc1ccc(-c2nc(CSCCCC(C)(C)C#N)co2)cc1 480366859 VEOZHMBWURFERZ-UHFFFAOYSA-N 314.454 5.213 30 20 DKED CSc1cccc(NCc2ccccc2C(C)(C)C#N)c1C 540341090 XSIOMMORIWYHMO-UHFFFAOYSA-N 310.466 5.130 30 20 DKED C=CCCCN(C)C(=O)Nc1ccccc1Oc1ccc(C)cc1 580677747 ZGSLHEJTHSOZMO-UHFFFAOYSA-N 324.424 5.217 30 20 DKED CCCCCCCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 743804349 XOFMFLLERRSLLV-SJORKVTESA-N 305.462 5.330 30 20 DKED C=CCCCCC[C@H](C)N[C@@H]1CCO[C@@H](c2ccccc2)C1 793550173 DHOOIXXOTJZALJ-DFQSSKMNSA-N 301.474 5.021 30 20 DKED CCCCCCCC[S@](=O)Cc1cccc(C(F)F)c1 794895221 LJNABWKJIWNGKH-FQEVSTJZSA-N 302.430 5.233 30 20 DKED C=CCCCCC[C@@H](C)N[C@@H]1CCO[C@@H](c2cccs2)C1 834909751 PWQPAMOAINHWIX-BRWVUGGUSA-N 307.503 5.083 30 20 DKED N#Cc1csc(CNc2ccccc2SC2CCCC2)c1 93686854 IYGDNMOSKHNIFC-UHFFFAOYSA-N 314.479 5.267 30 20 DKED Cc1coc2ccc(N=C(O)C[C@@H]3CCO[C@H](C(C)C)C3)cc12 330043177 FBAVBQOBGMQWIL-KDOFPFPSSA-N 315.413 5.171 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc2cc(C)ccc2o1 410347885 RJJQRVFPGKZQPE-UHFFFAOYSA-N 305.377 5.112 30 20 DKED Cc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 521280923 HDSWHWTYOACEMF-NQIIRXRSSA-N 306.453 5.389 30 20 DKED C=CCCC(=O)Nc1ccccc1Oc1ccccc1Cl 523952702 NQFWMZRTQQGBCF-UHFFFAOYSA-N 301.773 5.037 30 20 DKED C=CCCC[C@H](C)Sc1nnc(-c2c[nH]c3ccccc23)o1 537072036 PQMRMVIKSQZLOD-LBPRGKRZSA-N 313.426 5.055 30 20 DKED CC(C)(C)CCCCC(=O)Nc1ccccc1SCCC#N 561126525 BQFJUPSVFPIMGV-UHFFFAOYSA-N 318.486 5.237 30 20 DKED CCSc1ccc([C@H](C)N[C@@H](CC)c2ccc(C#N)cc2)cc1 569432999 ZLIYYZKYDKRNCR-YWZLYKJASA-N 324.493 5.472 30 20 DKED CC(C)(C)Nc1ccccc1NCc1ccccc1C(C)(C)C#N 766131963 IUIWDJAAOKFUDG-UHFFFAOYSA-N 321.468 5.310 30 20 DKED CCCCCCCCC(=O)Nc1ncc(Cl)cc1Cl 888984860 BDGNUVSWJMKUQE-UHFFFAOYSA-N 303.233 5.078 30 20 DKED N#CCCC[C@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 353917240 UKYPBWOQKKOSDL-IBGZPJMESA-N 322.383 5.097 30 20 DKED C[C@@H](SCc1cccc(C#N)c1)c1ccc(OC(F)F)cc1 524065219 LOWQEETWQTVJMJ-GFCCVEGCSA-N 319.376 5.154 30 20 DKED CCCCCCCCCC(=O)N1CC[C@H]1c1cccc(F)c1 742866889 BEDRRKAOHMRRAB-SFHVURJKSA-N 305.437 5.240 30 20 DKED CCCCCCC[C@H](NCc1nccs1)c1ccccc1 765240802 BMCKMTDOTXMTFA-KRWDZBQOSA-N 302.487 5.335 30 20 DKED C=C(C)CN(C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 778242168 BEJKRTHFJFFSNH-UHFFFAOYSA-N 308.385 5.142 30 20 DKED CC(C)c1ccc([C@@H](C)Nc2ccccc2O[C@H](C)C#N)cc1 780743966 CCVVHWLIHXUZTN-HZPDHXFCSA-N 308.425 5.274 30 20 DKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567522 JOWHJRRYRQPXIA-UONOGXRCSA-N 320.502 5.223 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2[nH]1 926481591 UUQRBMFIKVNZHD-VQIMIIECSA-N 317.436 5.254 30 20 DKED C[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 21799130 RPUJFOAUDJVGNT-RYUDHWBXSA-N 319.235 5.277 30 20 DKED Cc1cc(C)cc([C@H](C)Nc2cccc(OCCCC#N)c2)c1 321918367 ANEDEEQDQDRCPO-KRWDZBQOSA-N 308.425 5.159 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(SC)cc1)c1ccc(C#N)cc1 467417925 MHWYJCHXFQJUDI-LIRRHRJNSA-N 310.466 5.082 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 480669940 OINUTAAVWDMJJG-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED CC1(C)CC[C@H]2C[C@@H](NCc3cc(C#N)cs3)c3cccc1c32 538487686 TUJVNQAQSDPLAL-KBXCAEBGSA-N 322.477 5.009 30 20 DKED CC[C@H](C)Oc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1 559878801 SUCWXNKDRLIOTC-UONOGXRCSA-N 312.388 5.048 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1ccc2ncccc2c1 742437578 VMVCONHKBJGYAT-SAIXKJTDSA-N 323.442 5.057 30 20 DKED CCCCCCC[C@@H](NCc1ccc(C#N)cn1)c1ccccc1 783293727 JRJJIRZBJRTIBH-OAQYLSRUSA-N 321.468 5.145 30 20 DKED CC(=NNc1cccc(Cl)c1C)c1nc2ccccc2s1 915050933 GWWKEMWCZUVVAJ-UHFFFAOYSA-N 315.829 5.094 30 20 DKED C[C@@H]1C[C@@H](C(O)=Nc2ccc3c(c2)oc2ccccc23)CCC1=O 328909471 DRYSPIYRRJMNGP-OLZOCXBDSA-N 321.376 5.179 30 20 DKED C[C@H](NCc1ccc(-c2ccsc2)cc1)c1ccc(C#N)cc1 549166682 SZWFLFYYLROKNK-HNNXBMFYSA-N 318.445 5.138 30 20 DKED O=C(/C=C/c1cccnc1Cl)c1ccc(-c2ccccc2)cc1 726363290 OZBFPFSXZAMODI-OUKQBFOZSA-N 319.791 5.298 30 20 DKED CO[C@H](C)c1cccc(N=Cc2c(O)ccc3ccccc23)c1 726890398 KUQFZXBTSPBZMK-CQSZACIVSA-N 305.377 5.003 30 20 DKED C=CCCCN(C)Cc1cc2ccc(SC)cc2nc1Cl 736623466 KUKIBGCGXUUNIW-UHFFFAOYSA-N 320.889 5.008 30 20 DKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1cc2ccccc2o1 741840490 WUEQNLWTSJXXKX-SREVYHEPSA-N 306.292 5.214 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccccc3F)cs2)cc1 757476167 WJDMNVRKBAIGRM-KHPPLWFESA-N 323.392 5.154 30 20 DKED C=CC[C@H](N[C@H](C)c1cc(Cl)cc(Cl)c1)c1ccncc1 766019499 MCSWWLULRXTUDI-PXAZEXFGSA-N 321.251 5.356 30 20 DKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@@H]1c1cc(C)on1 820893026 FAYFOVDJLBKYTF-MAUKXSAKSA-N 320.477 5.033 30 20 DKED Fc1cccc(Cl)c1C=NNc1ccc(Cl)c(Cl)c1 916249845 OCUNJJVKIPGQKZ-UHFFFAOYSA-N 317.578 5.232 30 20 DKED C[C@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 36919538 JJFJGYIMURIUAF-NSHDSACASA-N 304.365 5.046 30 20 DKED C=CCC[C@H](Nc1cccc(-c2nccs2)c1)c1ccco1 428439171 LOMDTKSQTYVPQS-INIZCTEOSA-N 310.422 5.523 30 20 DKED C[C@@H](SCc1cc(F)cc2cccnc12)c1cccc(C#N)c1 443156883 WXUANENHGLLHQL-CYBMUJFWSA-N 322.408 5.240 30 20 DKED CC1(C#N)CCC(NC2(c3ccc(Cl)c(Cl)c3)CC2)CC1 453166799 WNHIUGIZBXWOOM-UHFFFAOYSA-N 323.267 5.045 30 20 DKED C[C@H](SCc1ccccc1C(C)(C)C#N)c1ccc(C#N)cc1 486739104 SERUDBILMSJWHR-HNNXBMFYSA-N 320.461 5.354 30 20 DKED COc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1cccc(C#N)c1 539494941 WZQMEEGHCPPGOI-JXFKEZNVSA-N 322.452 5.005 30 20 DKED N#CCCC[C@@H](NC/C=C/c1ccc(Cl)cc1)c1ccccc1 590069147 CKLUNJUVPFNPBM-ROUKRRSUSA-N 324.855 5.378 30 20 DKED C=C(C)CN(CC)C(=O)c1cc(-c2ccccc2)ccc1Cl 599487435 KOCFUPPXNPEVHV-UHFFFAOYSA-N 313.828 5.045 30 20 DKED C=CCCCN1CCC(c2nc3cc(Cl)ccc3s2)CC1 605149747 JFWUHXYHIBJFNI-UHFFFAOYSA-N 320.889 5.095 30 20 DKED CCCCCCCCC(=O)Nc1ccccc1CC(F)(F)F 741989703 USDCVLKCULAVGA-UHFFFAOYSA-N 315.379 5.481 30 20 DKED C=CCC[C@@H](Nc1ccc(OC(F)F)c(F)c1)c1ccco1 796870760 QPAZILPYCNRNEE-CYBMUJFWSA-N 311.303 5.140 30 20 DKED CC(C)Oc1cccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)c1 303472013 NHAXDCJYDWAIEZ-CYBMUJFWSA-N 314.816 5.172 30 20 DKED CC1(C)CCC(C/C(O)=N/[C@@H]2CCC(O)=N[C@H]2C(C)(C)C)CC1 329217880 QZJQKZFKKGNSLN-RHSMWYFYSA-N 322.493 5.083 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(C#N)cc1F)CC2 427865332 NIQSNPDOJKUSPX-SZNDQCEHSA-N 322.427 5.159 30 20 DKED CO[C@H](C)c1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1 482003371 UAPUUZUYXLNASP-VFNWGFHPSA-N 320.436 5.145 30 20 DKED Cc1c([C@H](C)Nc2c(F)cc(C#N)cc2F)oc2ccccc12 500490222 LFWDDIVQZLYDKZ-NSHDSACASA-N 312.319 5.064 30 20 DKED C=CCCc1ccccc1NC(=O)N1CCCC12CCCCC2 505000684 IMHFOFGBXWZBTP-UHFFFAOYSA-N 312.457 5.136 30 20 DKED C[C@H](SCc1coc(-c2ccccc2)n1)c1ccc(C#N)cc1 609825470 ZISHZLUQGLPXAM-AWEZNQCLSA-N 320.417 5.208 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1cc(Cl)ccc1Cl 782303413 YGECGXGHCLXXRY-AATRIKPKSA-N 324.232 5.223 30 20 DKED CC1(C)CCC[C@@H](CC(=O)[C@H](C#N)c2nccc3ccccc23)C1 792103667 LOCSFPCPUZLFQJ-YJBOKZPZSA-N 320.436 5.018 30 20 DKED N#CCCC[C@H](NCc1cc(Cl)ccc1F)c1ccccc1 353915913 OMYLKWNCTMAJEI-SFHVURJKSA-N 316.807 5.004 30 20 DKED CCOc1cccc2cc([C@@H](C)Nc3ccc(F)cc3C#N)oc12 462928769 KMLNZSFTGPGFBZ-GFCCVEGCSA-N 324.355 5.015 30 20 DKED CC(C)(C#N)CCCSCc1c(Cl)ccc2cccnc12 480419357 JFKIMMOWYFROCA-UHFFFAOYSA-N 318.873 5.451 30 20 DKED N#CCCCCN[C@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 531960762 JFVGBEBZUXAKDD-SJORKVTESA-N 324.390 5.015 30 20 DKED CC(C)CC1(C(=O)[C@H](C#N)c2ccc3ccccc3n2)CCCC1 756228714 SNSSFMAVSJLJTF-QGZVFWFLSA-N 320.436 5.018 30 20 DKED Cc1ccc(C[C@H](C#N)Sc2cccc(C(F)(F)F)c2)cc1 912694488 VKGLTWPXANEFCT-MRXNPFEDSA-N 321.367 5.241 30 20 DKED CSc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665227 FIARHEJDWPRALN-HNAYVOBHSA-N 310.466 5.104 30 20 DKED C[C@H](N[C@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 174358495 UNSBDNIFOHUVFT-JKSUJKDBSA-N 300.405 5.123 30 20 DKED CC(C)COc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 325107322 AXCXPRUHPUORAZ-DLBZAZTESA-N 322.452 5.005 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC1=CCCC1 475565273 DCGUXYGHFLPCPS-UHFFFAOYSA-N 312.457 5.160 30 20 DKED CC[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1ccc(C#N)cc1 517278344 KYBMWQDXSOIGFN-SJKOYZFVSA-N 316.807 5.153 30 20 DKED O=C1/C(=C/c2ncc(-c3ccccc3)s2)CCc2sccc21 770572045 BMIMKVNQOUCANT-JLHYYAGUSA-N 323.442 5.084 30 20 DKED CCCCCCCCC(=O)Nc1ccc(N2CCCC2)cc1C 916826345 KWCSGLRYMIXNBY-UHFFFAOYSA-N 316.489 5.284 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CC)s1 189909841 UFGVUJKQPQONHJ-UHFFFAOYSA-N 313.466 5.415 30 20 DKED CC(C)(C#N)CCCN(Cc1c(F)cccc1F)C1CCCC1 472238023 FKOAPMOSRIDBRE-UHFFFAOYSA-N 320.427 5.039 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 480676054 ASFVMZGJYMWSHL-ADLMAVQZSA-N 323.333 5.211 30 20 DKED CCC(CC)[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 534169821 WFWBCFXVNFXXOU-ZIAGYGMSSA-N 318.486 5.092 30 20 DKED C=CC[C@@H](N[C@@H](C)c1c(C)oc2ccccc12)c1ccncc1 925074516 ICTOQFCPZSKCHD-KBXCAEBGSA-N 306.409 5.104 30 20 DKED C[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 21799137 RPUJFOAUDJVGNT-NWDGAFQWSA-N 319.235 5.277 30 20 DKED CC[C@H](C#N)Sc1nc(-c2ccccc2)c(-c2ccccc2)o1 199427298 BGVHLKYULRLDCB-MRXNPFEDSA-N 320.417 5.403 30 20 DKED CC(C)(C)[C@H](N[C@@H]1CC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1 442852375 XWYPAPNDVHLQMC-DAXOMENPSA-N 324.390 5.074 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc21 448027210 LWRDLQUOPOLRAP-IPHXSNPTSA-N 304.437 5.093 30 20 DKED CC1(C)CCC(CSCCCC2(C#N)CCOCC2)CC1 512318077 JWAAXHUUDIGOMJ-UHFFFAOYSA-N 309.519 5.037 30 20 DKED CCSc1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551556188 HQUFALVUJGAGEI-HNNXBMFYSA-N 322.477 5.010 30 20 DKED C[C@@H](Nc1ccc(OC2CCCC2)c(F)c1)c1ccc(C#N)cc1 743484295 MSKHHBLWSQFMJW-CQSZACIVSA-N 324.399 5.192 30 20 DKED CCc1c(C(=O)/C=C/c2nc(Cl)cs2)oc2ccccc12 759075623 MAQADLHXQMVRJU-BQYQJAHWSA-N 317.797 5.001 30 20 DKED CSc1ccc(C(=O)/C=C\c2ccc(Cl)nc2)c(Cl)c1 765613524 NBOGCEOHXVYVMM-KXFIGUGUSA-N 324.232 5.006 30 20 DKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)C1CCCCC1 797157986 LGCGRIXZJGMGPM-KHPPLWFESA-N 315.413 5.112 30 20 DKED O=C(/C=C\c1cscc1Cl)c1c(F)cccc1Cl 809159015 GIFBEMXQSBNMIZ-PLNGDYQASA-N 301.169 5.090 30 20 DKED CCCCCCCC(=O)O[C@@H](c1ccccc1)c1ccncc1 920771090 KXFYVWNETMZDQX-FQEVSTJZSA-N 311.425 5.075 30 20 DKED C=CCOc1ccc(CN[C@@H](C)c2cccc3ccccc23)cc1 391732543 DYUJTODEJCISNU-KRWDZBQOSA-N 317.432 5.255 30 20 DKED N#CCCCS[C@H](c1ccccc1)c1ccc(F)c(F)c1 479505929 SXZVAIAKRZGTEW-QGZVFWFLSA-N 303.377 5.091 30 20 DKED C=C(C)[C@H](NCc1ccccc1SC)c1ccc(F)c(F)c1 481591960 BQISKSGYXKTGNE-SFHVURJKSA-N 319.420 5.094 30 20 DKED C=CCN(C(=O)Nc1ccc(S[C@H](C)CC)cc1C)C1CC1 539027258 BZJOGFRBKVNSOU-CQSZACIVSA-N 318.486 5.068 30 20 DKED CC(C)[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 574611240 HGMWFEHPFHQUCA-VQTJNVASSA-N 324.855 5.186 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@@H](c2ccco2)C1 732129735 DHBVBVRWCCIPEL-QGZVFWFLSA-N 305.462 5.126 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1ccc(Cl)cc1Cl 782301123 JZFSHBFYRFOKLC-WAYWQWQTSA-N 324.232 5.223 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 91412147 AEQDBCCBRNNODM-OAHLLOKOSA-N 318.445 5.138 30 20 DKED CCCCCCCCCC(=O)Nc1cccc(NC(C)=O)c1C 128176233 VVFPIDZGYRTYLJ-UHFFFAOYSA-N 318.461 5.033 30 20 DKED Cc1nc(-c2cccc(N[C@@H](C)c3cccc(C#N)c3)c2)cs1 192995660 DAJSPKOQSNYOIE-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 303775058 NNFAACHCFTZYBD-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C[C@H](SCc1coc(-c2ccccc2)n1)c1cccc(C#N)c1 443146325 LBACTQJGUSWJMA-AWEZNQCLSA-N 320.417 5.208 30 20 DKED C=C[C@@H](CC(=O)Nc1cc(SC)ccc1C)c1ccccc1 539445954 GEIKJOQYYTWLJY-HNNXBMFYSA-N 311.450 5.015 30 20 DKED Cc1ccc([C@H](Nc2cccc(OCCCC#N)c2)C2CCC2)o1 541778272 RYCFAVOENBKFEX-HXUWFJFHSA-N 324.424 5.224 30 20 DKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2o1 584486580 KXNZGIRZTKVOMQ-IFXJQAMLSA-N 316.404 5.033 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccccc1SCC)c1ccncc1 766022990 YVEDNZQOMBYQIA-YJBOKZPZSA-N 312.482 5.162 30 20 DKED C=CC[C@H](N[C@@H](C)c1cccc(CC(C)C)c1)c1ccncc1 796772260 PQSMCOTVDDIMLC-UWJYYQICSA-N 308.469 5.248 30 20 DKED Cc1ccc(C[C@@H](C#N)Sc2cccc(C(F)(F)F)c2)cc1 912694487 VKGLTWPXANEFCT-INIZCTEOSA-N 321.367 5.241 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1csc(Cl)c1 191425072 PJGWKYHSUKJEKB-GFCCVEGCSA-N 320.845 5.257 30 20 DKED CC(C)(C#N)CCCCSCc1coc(-c2ccccc2)n1 435885147 GCWPRWUUXRCRRX-UHFFFAOYSA-N 314.454 5.295 30 20 DKED C=CCC[C@@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccccc1 447589611 YOCMKPLJPRKMAC-NHCUHLMSSA-N 304.437 5.306 30 20 DKED N#Cc1ccc(CSCc2ccc(C(F)F)cc2)cc1F 479522753 BPKJLYVMXMHRFB-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@H](N[C@H](CC1CCC1)c1ccccc1)c1cccc(C#N)c1 495401142 JMJMVDHELXVDOZ-HRAATJIYSA-N 304.437 5.140 30 20 DKED CSc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 516987450 RRJGVQFIPFBNSC-VBKZILBWSA-N 322.477 5.008 30 20 DKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(C#N)cc1 539496819 MESCNTHNZCZESR-VLIAUNLRSA-N 324.855 5.404 30 20 DKED CC[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)s1 572208513 PGPPNCASHPQEKG-HUUCEWRRSA-N 316.857 5.001 30 20 DKED CC(C)(C)[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1 589340630 NHWLVSNKKLLTKL-PMACEKPBSA-N 322.427 5.062 30 20 DKED C[C@H](Nc1ccccc1N1CCCCCC1)c1cccc(C#N)c1 611475861 WCQWELJLYNDPLK-KRWDZBQOSA-N 319.452 5.112 30 20 DKED COc1cccc(O)c1C=Nc1ccc(SC(C)(C)C)cc1 726739504 AOJWYKYEGDBDLQ-UHFFFAOYSA-N 315.438 5.042 30 20 DKED CCC[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc(C)cs1 733676534 ASRVIMLBKBLVPD-HZPDHXFCSA-N 318.486 5.015 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1ccncc1 746048117 WBCBNZPANKAGPT-OXQOHEQNSA-N 308.469 5.347 30 20 DKED Cc1ccc(C(=O)/C=C\c2cccc(-c3cccnc3)c2)s1 768492408 GNBRZYJXLJVSQI-HJWRWDBZSA-N 305.402 5.015 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1csc(Cl)c1 787185666 IJHZMODFBSSRNO-PLNGDYQASA-N 309.843 5.022 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C#N)c1 799374181 XWOGCLQABWPPRU-UHFFFAOYSA-N 320.436 5.195 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2ccccc2s1 188258752 FLEYJYQVBIGNFF-CRAIPNDOSA-N 320.461 5.597 30 20 DKED C=CCC[C@H](NCc1cccc(SCC)c1)c1ccco1 426348747 BXGSNICFLKRDLT-KRWDZBQOSA-N 301.455 5.189 30 20 DKED N#Cc1ccc(CSCc2cccc(C(F)F)c2)c(F)c1 479618251 QXHCHGGCKATPDT-UHFFFAOYSA-N 307.340 5.068 30 20 DKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4)cc3)CC2)c1 551581671 PYIFDCVBESGTBE-UHFFFAOYSA-N 324.427 5.004 30 20 DKED CC(C)(C#N)c1ccc(CN[C@H](CC2CC2)c2ccccc2)cc1 614178824 FQDKGERVUPQWSW-OAQYLSRUSA-N 318.464 5.119 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 735397896 YTZIBGWRHDLSGV-NVXWUHKLSA-N 308.425 5.018 30 20 DKED CCC(=CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)CC 759538893 NBMPZMQRGULYBQ-MRXNPFEDSA-N 324.449 5.041 30 20 DKED C[C@H](Nc1ccc(N2CCCCCC2)cc1)c1cccc(C#N)c1 785529704 JDFXZQKKFGXGGI-KRWDZBQOSA-N 319.452 5.112 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1ccccc1SC(C)(C)C 788520458 RHGSCGMGFGGVTK-HNNXBMFYSA-N 324.493 5.300 30 20 DKED C[C@H](c1cccc(Cl)c1)[S@](=O)CCCCC1(C#N)CCC1 899396401 DPCDHGKYKWINMN-SPLOXXLWSA-N 323.889 5.014 30 20 DKED Cc1ccc([C@H](NCC2CCC(C#N)CC2)c2ccccc2)cc1 442879980 XQNKCSCUMCGYIL-OBFZPWGMSA-N 318.464 5.004 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1cccc(COc2ccccc2)c1C 466425934 NUGXLMIHUWMELN-INIZCTEOSA-N 323.436 5.115 30 20 DKED CCCCC[C@H](CC)C(=O)[C@H](C#N)c1ccc2ccccc2n1 776073913 DQDADYBEXJTMKL-DOTOQJQBSA-N 308.425 5.018 30 20 DKED O=C(/C=C/c1ccsc1Cl)c1c(F)cccc1Cl 809159703 VCCSMSNILIIQPU-SNAWJCMRSA-N 301.169 5.090 30 20 DKED C=CCC[C@@H](NCc1ccnc(Cl)c1Cl)c1ccccc1 811484994 RWUNDEHMOBPCTF-OAHLLOKOSA-N 321.251 5.186 30 20 DKED C[C@@H](S[C@H](C)c1ncc(C(C)(C)C)o1)c1cccc(C#N)c1 190904228 BGELTEITYOYQRE-CHWSQXEVSA-N 314.454 5.399 30 20 DKED N#Cc1cccc(SCc2cc(Cl)cc3cccnc23)c1 468634519 FNTCDSBPBLVGAM-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H](c1ccccc1Cl)N(CCCC(C)(C)C#N)C1CC1 472444943 UEJVJDCUFZOVQY-AWEZNQCLSA-N 304.865 5.195 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1ccncc1 682803662 KJTNANUKCSBXIO-MRXNPFEDSA-N 322.452 5.066 30 20 DKED Fc1ccccc1NN=Cc1c(Cl)ccc(Cl)c1Cl 818274955 LXXVKJDYRCKFNT-UHFFFAOYSA-N 317.578 5.232 30 20 DKED CC(C)c1ccc([C@H](C)NN=Cc2c(F)cccc2Cl)cc1 917553174 XTDHOZIEPIWDJQ-ZDUSSCGKSA-N 318.823 5.287 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)C1CCC(F)(F)CC1 340453075 RKGRIPSJVXHHOA-MAUKXSAKSA-N 320.427 5.225 30 20 DKED C=CCC[C@H](C(=O)Nc1cccc([C@@H](C)OC)c1)c1ccccc1 488339199 MVGCIQRKHZXFGG-UZLBHIALSA-N 323.436 5.083 30 20 DKED C[C@@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1 495402823 SKICEOHCXUGRGZ-IERDGZPVSA-N 304.437 5.140 30 20 DKED N#CCCCCN(Cc1ccccc1C(F)(F)F)C1CCCC1 524667188 VONRGOBIKZWOMM-UHFFFAOYSA-N 324.390 5.144 30 20 DKED O=C(/C=C\c1cccc(Cl)c1)c1cccc(-c2ccncc2)c1 741474303 XBUCECJIQCURLH-FPLPWBNLSA-N 319.791 5.298 30 20 DKED Fc1cc(NN=CC2CCC(C(F)(F)F)CC2)ccc1Cl 767384632 HAGFNOPZXCSRCS-UHFFFAOYSA-N 322.733 5.246 30 20 DKED CCCCCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917045815 AIUFKNZAZPIUFL-GFCCVEGCSA-N 320.845 5.096 30 20 DKED CCCCCCCCC(=O)N[C@@H](c1ccccc1)c1cccnc1 728492699 VGQQRSAWOWLHNX-NRFANRHFSA-N 324.468 5.038 30 20 DKED C[C@@H](C=NOc1ccccc1C(F)(F)F)CCc1ccccc1 754712267 IWGJLTBKQQTCTE-CQSZACIVSA-N 321.342 5.339 30 20 DKED Cc1ccc([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)s1 795785864 DQZUJVWOMMEVBJ-KDOFPFPSSA-N 310.466 5.047 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1cccs1 417348788 JORKPFPOBJHUHR-LULLPPNCSA-N 324.493 5.265 30 20 DKED CCCc1ccc([C@H](N[C@@H]2CC[C@@H](C#N)C2)c2cccs2)cc1 442640020 ZIZARMWGGFGMQN-POAQFYNOSA-N 324.493 5.072 30 20 DKED Cc1ccc(CN[C@H](CCCC#N)c2ccccc2)c(Cl)c1 578874643 CVEISFBQAZBQCK-LJQANCHMSA-N 312.844 5.173 30 20 DKED Cc1cccc2[nH]c(CN[C@@H](CCCC#N)c3ccccc3)cc12 594943082 GWRWREHMLLWDOU-FQEVSTJZSA-N 317.436 5.001 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccccc2)cc1 741471325 ZBNPYZCOCYYDAW-LFIBNONCSA-N 314.384 5.258 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)o1)[C@@H]1CCC[C@@H](C)C1 742370821 OZPONGAMMRFTGR-QLVMHMETSA-N 322.452 5.117 30 20 DKED C[C@@H]1C/C(=C\c2coc(-c3ccccc3)n2)C(=O)c2ccccc21 751535892 NDICUWVFSVHTFX-RGHBXIHOSA-N 315.372 5.115 30 20 DKED CC(C)(C#N)CCCSCc1csc(-c2cccs2)n1 161179992 YJHKOLUUVJVBJA-UHFFFAOYSA-N 322.524 5.435 30 20 DKED C[C@H](S[C@@H](C)c1nc2ccccc2o1)c1ccc(C#N)cc1 183272413 WNCDDSTZILPRSH-STQMWFEESA-N 308.406 5.255 30 20 DKED C=CCC[C@@H](NCc1cc(F)cc2cccnc12)c1ccccc1 341937698 BWLOZLFFKXWWKQ-HXUWFJFHSA-N 320.411 5.171 30 20 DKED CC(C)(C#N)CCCN(Cc1cc(F)ccc1F)C1CCCC1 434903796 BZGRCTUGLYACAT-UHFFFAOYSA-N 320.427 5.039 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 537950265 OUMHMEOVEAKKAJ-VGOFRKELSA-N 314.432 5.535 30 20 DKED C[C@H](Nc1ccc(OC(C)(C)C)c(C#N)c1)c1ccccc1F 864017832 BJVABPRTPANZQY-ZDUSSCGKSA-N 312.388 5.048 30 20 DKED CCCc1ccc(-c2ccc(-c3ccc(C#N)cc3)c(F)c2)cc1 144767054 CCRAFIJEOWNROF-UHFFFAOYSA-N 315.391 5.984 30 20 DKED N#CCCCSC(c1ccc(F)cc1)c1ccc(F)cc1 216251802 PMPAWPNSGFKIHR-UHFFFAOYSA-N 303.377 5.091 30 20 DKED COc1ccc2[nH]cc(C(=O)/C=C/C(C)=C/c3ccccc3)c2c1 303637051 PZOJJQSGLCWRKG-XVNCSPBISA-N 317.388 5.019 30 20 DKED C[C@@H]1CC[C@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 358350154 ZOUIISCCCSQVPI-CZAAIQMYSA-N 304.437 5.260 30 20 DKED CC[C@H](N[C@H](c1ccc(OC)cc1)C(C)C)c1ccc(C#N)cc1 447513666 YAGRNTFQFIWCSQ-SFTDATJTSA-N 322.452 5.005 30 20 DKED C=CCC(CC=C)C(=O)N(CC)[C@H](C)c1cc2ccccc2o1 467822407 AVXQSCVKKLEEJY-OAHLLOKOSA-N 311.425 5.111 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)CCC 475573243 LDSONFVPFAVPGH-MRXNPFEDSA-N 302.462 5.239 30 20 DKED CSc1ccccc1[C@@H](C)NCc1ccccc1C(C)(C)C#N 501561510 NMDNCKZGJPNYTB-OAHLLOKOSA-N 324.493 5.060 30 20 DKED C[C@@H]1CC[C@@H](NCc2ccc(C#N)c(Cl)c2)c2sccc21 590778609 FGTQVFHQXPVNJM-BDJLRTHQSA-N 316.857 5.001 30 20 DKED CC1(C)CCC[C@H](CC(=O)[C@H](C#N)c2ccc3ccccc3n2)C1 756518990 LNORBECQCDVTKN-NVXWUHKLSA-N 320.436 5.018 30 20 DKED CC[C@@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 774170502 FIZGQUIIMVRDOL-AUUYWEPGSA-N 320.461 5.575 30 20 DKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(Cl)s1 788098934 PBWWJEMXFKUQAA-ARJAWSKDSA-N 321.810 5.014 30 20 DKED CCCCCCC[C@H](C)Nc1cccc(NC(=O)N(C)C)c1C 793247300 XGIMQMGGIPXYSZ-HNNXBMFYSA-N 319.493 5.249 30 20 DKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1cc2ccccc2s1 804441338 KCTVBSNRCDCCEA-MRVPVSSYSA-N 319.842 5.056 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90664545 UKQJGDUJGWILJC-OCCSQVGLSA-N 304.846 5.097 30 20 DKED CC(C)(C#N)c1ccccc1CNc1ccccc1C(F)F 424561368 BKEQAXFOWSGYIM-UHFFFAOYSA-N 300.352 5.037 30 20 DKED N#CCCCOc1cccc(N[C@@H](CC2CC2)c2ccccc2)c1 539627956 RJMHGXAMIVPUCY-NRFANRHFSA-N 320.436 5.322 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2)cc1 563741401 WVSCNLANWXYFIJ-KRWDZBQOSA-N 306.453 5.334 30 20 DKED C[C@@H](CCc1cccc(F)c1)N[C@H](CCCC#N)c1ccccc1 568656715 LJZOMLGKWFVVBX-LAUBAEHRSA-N 324.443 5.172 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccsc1Cl 594705949 QSMQYSQWZNKAMZ-NSHDSACASA-N 322.886 5.408 30 20 DKED N#Cc1cnc(SCc2cccc3ccccc23)c(Cl)c1 609630911 MRVLFPXGUDCYTP-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1ccc(C#N)cc1 610340819 HFVUNZWFOMQUNB-CYBMUJFWSA-N 319.408 5.170 30 20 DKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1ccc(C)s1 800576162 BZLLGHQBXGFVPX-AWEZNQCLSA-N 314.454 5.058 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90665106 ZVWOKEVNTSUNQJ-CABCVRRESA-N 318.873 5.487 30 20 DKED CCCCCCCC[C@H](O)CCCCCCCCC(=O)OC 100131951 ZWOMTUQOMSFPSL-SFHVURJKSA-N 314.510 5.392 30 20 DKED COc1cc(C(=O)/C=C/C(C)=C\c2ccccc2)ccc1SC 208022753 WEQQSEQIJDXFKQ-NYWYOEKOSA-N 324.445 5.260 30 20 DKED CCSCc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1 512277832 IAVHUOJFANDCMG-CYBMUJFWSA-N 314.429 5.124 30 20 DKED C=CCN(C(=O)Nc1ccc(C(C)C)cc1C(C)C)C1CC1 538963935 KGYYQKKPUCRSFQ-UHFFFAOYSA-N 300.446 5.116 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccccc1 588574392 CCNGBAFZIGRIHE-PFONDFGASA-N 305.421 5.190 30 20 DKED Cc1ccc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)s1 730085318 OAZVKNWVDAYXOB-KTKRTIGZSA-N 311.431 5.076 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C\c1cnc(C3CCC3)s1)C2=O 766695196 HRPVMRMNIGPXNA-RGZVIEDOSA-N 309.434 5.102 30 20 DKED CC[C@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 774170504 FIZGQUIIMVRDOL-KUHUBIRLSA-N 320.461 5.575 30 20 DKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1C)c1ccccc1 156541904 FPLKBMPTVNCJEW-GHTZIAJQSA-N 319.448 5.018 30 20 DKED C[C@H](N[C@H](C)c1cccc2ccccc12)c1cccc(C#N)c1 192943658 BXTLHJWEYUGYIJ-JKSUJKDBSA-N 300.405 5.123 30 20 DKED CC[C@H](CC1CCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303547763 LFLFTZRTZIWEAT-MRXNPFEDSA-N 312.457 5.033 30 20 DKED C=CCC[C@@H](N[C@@H]1CCCc2ccc(O)cc21)c1ccccc1 340523254 CDHMPBOJKGCIKC-NHCUHLMSSA-N 307.437 5.067 30 20 DKED N#CC[C@@H]1CC[C@H](N[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 453296113 UAUBOTPRYVEBKS-RYGJVYDSSA-N 324.855 5.101 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)CC1CCCC1 476084851 PTEYWQFWJWDCJF-MRXNPFEDSA-N 313.485 5.693 30 20 DKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CC1=CCCCC1 521606327 ISEGUJUOJTXGHK-UHFFFAOYSA-N 322.433 5.116 30 20 DKED Cc1c([C@@H](C)NCc2ccc(C#N)c(Cl)c2)oc2ccccc12 619755711 QAONRDLMVACZMW-CYBMUJFWSA-N 324.811 5.117 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)oc(C)c1C 671816921 AKHNYLMAYAVBRB-UHFFFAOYSA-N 311.425 5.309 30 20 DKED CCCCCCCCC(=O)NC1(c2nc(C)cs2)CCCC1 732946629 YRCJIPKROUWULV-UHFFFAOYSA-N 322.518 5.088 30 20 DKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2cccs2)cc1 742430733 AEJRWLOKEGMJPV-HJWRWDBZSA-N 311.431 5.076 30 20 DKED C=CCC(CC=C)c1nc(-c2ccc(C(F)(F)F)s2)no1 904970389 BYXOTUVOPPCOSP-UHFFFAOYSA-N 314.332 5.053 30 20 DKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1C)c1ccccc1 156541702 FPLKBMPTVNCJEW-WIYYLYMNSA-N 319.448 5.018 30 20 DKED CC(C)(CCC#N)CNCCC(c1ccccc1)c1ccccc1 236817697 UJZPWMROWATQRM-UHFFFAOYSA-N 320.480 5.128 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)C[C@@H](C)c1ccccc1 505017495 WUFLEXQEOYTUTH-QGZVFWFLSA-N 322.452 5.073 30 20 DKED C[C@@H](CCc1ccccc1)N[C@@H](CCCC#N)c1ccccc1 559866094 UNDFQTWDWAXFMI-RXVVDRJESA-N 306.453 5.032 30 20 DKED CC(C)(C#N)c1ccc(CNc2cccc3ccccc23)cc1 614052883 STMPLRXNOJGYAE-UHFFFAOYSA-N 300.405 5.253 30 20 DKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc2ccccc12 618806910 SKYPMXGNFAZVLM-NYHFZMIOSA-N 312.416 5.050 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccc(F)c(Cl)c2)s1 736434879 YIMBZUIEZSXQCI-ALCCZGGFSA-N 323.820 5.129 30 20 DKED C#CC[C@@H](N[C@@H](C)c1oc2ccccc2c1C)c1ccccc1 773115130 LRLTXZHZBPCVHO-QFBILLFUSA-N 303.405 5.156 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccccc1 803179076 DDUQUAQBMIAONT-VQTJNVASSA-N 319.448 5.281 30 20 DKED CCCCC1CCC(C(=O)[C@@H](C#N)c2nc3ccccc3o2)CC1 915104504 DBIRAFRLWFGZOK-UYSNPLJNSA-N 324.424 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(F)c1 189901571 CTCVMZXPYBWNKX-UHFFFAOYSA-N 311.400 5.238 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(CC)c1 189907464 HATQHLVZDDBCED-UHFFFAOYSA-N 321.464 5.282 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc[nH]c1C(C)C 286491500 MPDHCEQCMXXATA-UHFFFAOYSA-N 310.441 5.242 30 20 DKED C=CCCC[C@H](C)N[C@@H](C)c1cccc(OCc2ccccn2)c1 539257195 QVZJPCYUSDJIRK-ROUUACIJSA-N 324.468 5.056 30 20 DKED CC(C)(C)C[C@@H](N[C@@H](C#N)Cc1ccccc1)c1ccc(F)cc1 610294677 QXNSCJAHVAXPSP-WOJBJXKFSA-N 324.443 5.027 30 20 DKED CC/C(C)=C(\C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 779836735 FVOOZBFBNIORKG-UHPIZROJSA-N 318.420 5.027 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1ccc(C#N)cc1 301093159 MGWQHRLAGFVJIG-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED C[C@@H](SCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 731158267 ALMFIZVGPXMAKF-CYBMUJFWSA-N 317.841 5.237 30 20 DKED O=C(/C=C/c1cncc2ccccc12)c1ccc2ccccc2c1 772800738 AUFNSCFPWDYSBI-VAWYXSNFSA-N 309.368 5.284 30 20 DKED N#Cc1cccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)c1 818260946 UVUCUJHEDYEBIU-IZZDOVSWSA-N 315.397 5.183 30 20 DKED C[C@H](N[C@@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 192755303 PGBIZNCUVLBFRX-HOTGVXAUSA-N 300.405 5.123 30 20 DKED N#CCCC[C@@H](NCc1csc2ccccc12)c1ccccc1 353916525 QKKOFXZXMDEJLF-LJQANCHMSA-N 320.461 5.426 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@@H](CCC#N)c1ccccc1)CCC2 358336081 CAQQMRDIIKFMGB-SFTDATJTSA-N 304.437 5.007 30 20 DKED C=CCC[C@@H](N[C@@H](c1ccccc1)c1nccs1)c1ccco1 368608191 MDRGOQXSLHOXIJ-AEFFLSMTSA-N 324.449 5.123 30 20 DKED C[C@@H](CSCCCCC#N)c1ccc(C(F)(F)F)cc1 409880036 NNMRWWAAWZTUMV-LBPRGKRZSA-N 301.377 5.236 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccc(Cl)c1F 461089971 RYIZLNIWXIVLOW-SJCJKPOMSA-N 316.807 5.153 30 20 DKED Cc1ccccc1C1(CNCC(C)(C)CCC#N)CCCCC1 462779283 OJTPBAACFSROQQ-UHFFFAOYSA-N 312.501 5.117 30 20 DKED C=C[C@](C)(CC)C(=O)Nc1cccc(COC(C)(C)CC)c1C 467996322 UZWFFNTWKUSYAU-HXUWFJFHSA-N 317.473 5.241 30 20 DKED CCCCCCCCCCCN(C)[C@@H]1CC[C@@H](CC(=O)O)C1 1776784558 FTHGKOCIUUYPQZ-QZTJIDSGSA-N 311.510 5.092 30 20 DKED CC(C)(C)c1cnc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)o1 329153435 BPIAYUZCWXWBDL-SOUVJXGZSA-N 318.461 5.035 30 20 DKED CCC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 340448703 JBVOJRXZPWENMZ-RTWAWAEBSA-N 306.453 5.553 30 20 DKED C[C@H](N[C@H]1CC[C@@H](C#N)C1)c1ccccc1-c1ccc(Cl)cc1 549927991 JQKUCKSCPPHZKA-DAYGRLMNSA-N 324.855 5.350 30 20 DKED CC[C@@](C)(C#N)C(=O)Nc1ccc(Sc2ccccc2)cc1C 572277286 LNTGNOAFSLGALM-IBGZPJMESA-N 324.449 5.025 30 20 DKED CC[C@H](NCc1ccc2sccc2c1)c1ccc(C#N)cc1 580249296 BJNXEGDAXKBPTD-SFHVURJKSA-N 306.434 5.014 30 20 DKED C[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 181724839 YGJHBQBTJIODSE-UONOGXRCSA-N 306.434 5.185 30 20 DKED C=CCC[C@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccccc1 191386047 KGPJINPKRWEOMW-UZLBHIALSA-N 311.473 5.131 30 20 DKED CC(C)c1cccc(CSCCCC2(C#N)CCOCC2)c1 596426319 RFVIZPOPFSCDRL-UHFFFAOYSA-N 317.498 5.144 30 20 DKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cccc(C#N)c1 751255694 RLERFFQNBFXUDS-UHFFFAOYSA-N 324.449 5.010 30 20 DKED CC1(C)CCCC[C@@H]1CC(=O)[C@H](C#N)c1nccc2ccccc12 792108014 XPPBFVCRUQHDTA-AEFFLSMTSA-N 320.436 5.018 30 20 DKED CC[C@@H](C)c1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1 1776088970 UJQHSNLXMFUIHX-CYBMUJFWSA-N 324.424 5.043 30 20 DKED CCOc1ccccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 340447186 PFJAWFUPHOQSBY-XLIONFOSSA-N 322.452 5.171 30 20 DKED C=CCC[C@H](N[C@@H]1CCCc2ccc(O)cc21)c1ccccc1 340523221 CDHMPBOJKGCIKC-LEWJYISDSA-N 307.437 5.067 30 20 DKED N#C[C@H]1CCC[C@@H](Nc2ccc(SC3CCCC3)cc2)C1 463290607 WOTDNQUOFOEKAF-GOEBONIOSA-N 300.471 5.216 30 20 DKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/c1ccc(C#N)cn1 486121128 AYMYEZFXHYJUHV-HUZLQASOSA-N 314.310 5.089 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2c(s1)CCCC2 539048180 BOCHFUWWJUYQLX-YJBOKZPZSA-N 324.493 5.323 30 20 DKED C[C@@H](Nc1cc(C#N)c2ccccc2n1)c1cc2ccccc2o1 609890551 JCWDATBPHWXNCM-CYBMUJFWSA-N 313.360 5.026 30 20 DKED Cc1ccc2sc(/C=C\c3ccc(O[C@@H](C)C#N)cc3)nc2c1 207992189 HXVXYWHWCCSGAM-APFBBLRHSA-N 320.417 5.066 30 20 DKED C=CCC(CC=C)C(=O)Nc1cccc(-c2ccccc2OC)c1 467520772 NRMPHMAINQPHLX-UHFFFAOYSA-N 321.420 5.069 30 20 DKED C=CCOc1ccc(CNc2cccc(SC)c2)cc1Cl 522283341 YBWZIZLWORLYOG-UHFFFAOYSA-N 319.857 5.239 30 20 DKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc2ccccc12 619746889 QVBACHHPSIIUHQ-CQSZACIVSA-N 320.823 5.216 30 20 DKED C=CCCC(=O)N(CCCCCC)c1nc2ccccc2s1 726497489 ZRQWIVQLCKIDAN-UHFFFAOYSA-N 316.470 5.176 30 20 DKED CCCCCCCCCN(C)C(=O)c1cccc2cnccc12 744466356 KSQOYACAQCRJGK-UHFFFAOYSA-N 312.457 5.057 30 20 DKED COc1cc(C=NNc2cccc3ccccc23)ccc1SC 747060198 LETUTOBVLRVXSL-UHFFFAOYSA-N 322.433 5.016 30 20 DKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1csc(Cl)c1 761487559 VCWKNYYZIGEAHA-ONEGZZNKSA-N 323.801 5.046 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1cc(C)oc1C)c1ccc(F)c(F)c1 447590335 BUMAFBMDSBKSDZ-KZULUSFZSA-N 305.368 5.143 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc2c(c1)COC2)c1ccccc1 539046382 DUHZYCUGEFSYKT-HRAATJIYSA-N 307.437 5.075 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 90664720 NRVPSTWCRQWPHV-APWZRJJASA-N 324.493 5.494 30 20 DKED CCCCCCCC(=O)NC(c1cccs1)c1cccs1 303802112 XCTXYBZRNPYVIT-UHFFFAOYSA-N 321.511 5.376 30 20 DKED CCOc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 340445165 LKROZEBFMSQLCU-LAUBAEHRSA-N 322.452 5.171 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 340448041 IRMJZYQJTAISGS-IFXJQAMLSA-N 314.379 5.051 30 20 DKED Cc1ccccc1CCCNc1ccccc1SCCC#N 439531127 ZMILRIRYSPCEGN-UHFFFAOYSA-N 310.466 5.046 30 20 DKED CC(C)(C#N)CCCCN1CCC(=Cc2ccccc2F)CC1 444653709 WWNJFRMECLWYPL-UHFFFAOYSA-N 314.448 5.025 30 20 DKED N#CCCCCSCc1cc(Cl)ccc1Br 461248912 PASYIYWMJBTKBD-UHFFFAOYSA-N 318.667 5.030 30 20 DKED CC(C)Oc1ccc(-c2nc(-c3ccc(C#N)cc3)cs2)cc1 500401130 UJVXLIWBSKAFEG-UHFFFAOYSA-N 320.417 5.136 30 20 DKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1cccc(C#N)c1 603497575 BMRPIUILUSMOFE-LBPRGKRZSA-N 319.235 5.058 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)ccc1Cl 606916629 OMNILYZMXQRMPD-UHFFFAOYSA-N 315.244 5.204 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccc(O[C@H](C)CC)cc1 606942085 NORJEXZLQKGHCI-MRXNPFEDSA-N 318.461 5.074 30 20 DKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2ccccc2s1 618807427 UNRPHNHFENMLRN-ACJLOTCBSA-N 318.445 5.111 30 20 DKED C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)s1)c1ccc(C#N)cc1 902766427 KIRAHFKFFYKGQY-QWRGUYRKSA-N 324.371 5.050 30 20 DKED C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303582622 RNNLWHOXNKSHFB-HNNXBMFYSA-N 312.457 5.033 30 20 DKED C[C@@H](Sc1ccc(Br)cc1)c1ccc(C#N)cc1 303726651 TXCYWPCPJHITSJ-LLVKDONJSA-N 318.239 5.174 30 20 DKED CC[C@@H](CC(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 410443461 LFMBNJVGVUYNKT-GJZGRUSLSA-N 318.486 5.092 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@H](C)c2ccc(C#N)c(F)c2)c2ccccc21 448034010 ZKWIWVXGZSIPAN-YFZFPPMRSA-N 322.427 5.233 30 20 DKED N#CC1(CS[C@H](c2ccccc2)c2ccc(F)c(F)c2)CC1 539520783 HJIUSQHPFYHBCD-QGZVFWFLSA-N 315.388 5.091 30 20 DKED CC(C)c1ccc([C@H](C)CC(=O)Nc2ccccc2CC#N)cc1 573284047 KDXXLNYVEWGWOL-MRXNPFEDSA-N 320.436 5.008 30 20 DKED Clc1ccc(CON=Cc2cccc(Cl)c2Cl)s1 727484019 AVZNXCKAUZYGIZ-UHFFFAOYSA-N 320.628 5.259 30 20 DKED CC(C)n1cc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cn1 732714764 XNCBCTWDYACGCS-HJWRWDBZSA-N 322.433 5.089 30 20 DKED C#CC[C@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccccc1 765802306 AIUKHDDVRJCKFT-UTKZUKDTSA-N 321.464 5.279 30 20 DKED N#Cc1c(F)cccc1N[C@@H](Cc1ccccc1)c1cccs1 522646905 KWWZSXHXYKTPGQ-SFHVURJKSA-N 322.408 5.155 30 20 DKED Cc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)s1 741471623 CGPMFAFGEHETAU-BQYQJAHWSA-N 305.402 5.015 30 20 DKED N#Cc1ccc(CNc2ccccc2SCc2ccccc2)o1 770512401 LIPOWURVAGXGEI-UHFFFAOYSA-N 320.417 5.056 30 20 DKED C#CC[C@@H](N[C@H](C)c1ccc(SCC)cc1)c1ccccc1 773117263 VANFVVHKWUQMHU-OXQOHEQNSA-N 309.478 5.214 30 20 DKED N#Cc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1 917517356 OSJHCWLFKOKKSH-ZHACJKMWSA-N 315.397 5.183 30 20 DKED CC[C@@H](C#N)Sc1nc(-c2ccccc2)c(-c2ccccc2)o1 199427281 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5.352 30 20 DKED Cc1cc([C@H](NCCCC#N)c2cccc(Cl)c2)c(C)s1 571010342 YNNNOXINVYTWOR-QGZVFWFLSA-N 318.873 5.001 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1cc2cc(Cl)ccc2o1 580591282 AZXXDJZBEFCFOH-LBPRGKRZSA-N 304.821 5.067 30 20 DKED CC[C@H](C#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 593509677 GEZFXCIFWKMRLI-HUUCEWRRSA-N 324.449 5.028 30 20 DKED N#Cc1ccc(SCc2csc(C3CCCC3)n2)c(F)c1 610165799 UQGAZNQOQDQFGA-UHFFFAOYSA-N 318.442 5.104 30 20 DKED CC(C)(c1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1)C(F)(F)F 618577828 LOXHIDDRLUYIDF-SWLSCSKDSA-N 310.363 5.021 30 20 DKED CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1 619754488 AWYRSYPXHCINRN-KRWDZBQOSA-N 319.235 5.106 30 20 DKED CCSc1ccc(C(=O)/C=C/c2cncc3ccccc23)cc1 755606220 BSVZZMJUCLRESB-FMIVXFBMSA-N 319.429 5.243 30 20 DKED C[C@H](C=NOc1ccccc1C(F)(F)F)c1ccc(F)cc1 756895097 HLMMRDFKZMVRGA-LLVKDONJSA-N 311.278 5.013 30 20 DKED CC[C@@H](Nc1cccc(-c2nccs2)c1)c1ccc(C#N)cc1 447602996 UWQRUAKKMUEFPL-GOSISDBHSA-N 319.433 5.245 30 20 DKED C[C@H](N[C@@H](c1cccc(F)c1)C1CCCC1)c1cccc(C#N)c1 538393158 HJXJATIGQQMPJD-YCRPNKLZSA-N 322.427 5.279 30 20 DKED O=C(/C=C/c1ccc(O)cc1)c1ccc(-c2ccccc2)s1 747188317 MIJJJEIQXJDMPC-DHZHZOJOSA-N 306.386 5.017 30 20 DKED C=CC[C@H](N[C@@H](C)c1oc2ccccc2c1CC)c1ccncc1 776155303 FYWMWUSAFKIAPI-KXBFYZLASA-N 320.436 5.358 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC)cc1 189898888 ZLETUYIHONVSSW-UHFFFAOYSA-N 323.436 5.190 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1 358340374 KUUPEDBUDSFKRD-MOPGFXCFSA-N 312.844 5.426 30 20 DKED C=C[C@](C)(CC)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 442963439 GZVATHTVXJKPMJ-HRAATJIYSA-N 322.452 5.401 30 20 DKED CC[C@@H](N[C@H](c1ccc(F)c(C)c1)C1CC1)c1ccc(C#N)cc1 447583585 CACWCXIOGOZNNK-RTWAWAEBSA-N 322.427 5.198 30 20 DKED CC#CCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 462334669 RQPBJOOUTKPPJO-GOSISDBHSA-N 322.452 5.015 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1c(F)cccc1Oc1ccccc1 466865028 NONKBKONDBNSFI-CQSZACIVSA-N 313.372 5.159 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccc2c(c1)CCC2 486202120 YOLOILSTMCRRQY-HNNXBMFYSA-N 322.477 5.039 30 20 DKED N#Cc1ccc(SCc2csc(-c3ccsc3)n2)cc1 509653974 WFSBSIZMUQIYBF-UHFFFAOYSA-N 314.460 5.036 30 20 DKED C/C(=C\c1ccccc1)CN[C@H](CCCC#N)c1ccccc1 577166471 DFQDYQNKLNOFHQ-XXJLXKPQSA-N 304.437 5.115 30 20 DKED CC(C)(C#N)CCSCc1csc(-c2ccc(F)cc2)n1 583775476 ONXYPYBRWBOWMN-UHFFFAOYSA-N 320.458 5.122 30 20 DKED CC(C)(CCC#N)CNc1ccc(C(F)(F)C(F)(F)F)cc1 613657762 MSZSDMNMVMDLDU-UHFFFAOYSA-N 320.305 5.083 30 20 DKED CCCCCCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 743804346 XOFMFLLERRSLLV-IAGOWNOFSA-N 305.462 5.330 30 20 DKED CSc1ccc(C(=O)/C=C/c2ccc(Cl)nc2Cl)cc1 761479876 WYGZNIOOSNRWOZ-XBXARRHUSA-N 324.232 5.006 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cc2ccccc2[nH]1)c1ccccc1 775632336 YISOIGPGHGQUFJ-VQIMIIECSA-N 304.437 5.526 30 20 DKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1cccc2ccccc12 779713411 SQQRCZIYMFXUFB-CVEARBPZSA-N 316.404 5.304 30 20 DKED CC(C)[C@@H]1/C(=C\c2scnc2C2CC2)C(=O)c2ccccc21 782354393 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CCCCOc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 551787867 NQQPLXJRWCZKIS-IAGOWNOFSA-N 322.452 5.149 30 20 DKED CCCC[C@@H](CC)CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 609754459 YUWUGXDLZLMKTE-DLBZAZTESA-N 314.473 5.074 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccsc2[nH]1 682822425 MFZDUGXQGMLZLJ-UHFFFAOYSA-N 324.449 5.334 30 20 DKED CCCCCCCC(=O)Nc1cccc(Oc2ccncc2)c1 732642736 OKVLUKKGZSXJQS-UHFFFAOYSA-N 312.413 5.173 30 20 DKED Cc1nc(-c2ccc([C@H](C)/N=C\c3ccccc3O)cc2)cs1 783254893 OFVDWVZEOIZCKT-GHOUAXAESA-N 322.433 5.004 30 20 DKED C[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)CC(C)(C)C 797569354 PKYPMOZNUAZOMN-STQMWFEESA-N 320.502 5.079 30 20 DKED N#Cc1ccccc1CSCc1csc(C2CCCC2)n1 63898605 VEWVAWUBNKBLQH-UHFFFAOYSA-N 314.479 5.106 30 20 DKED CC(C)(C#N)CCCSCc1coc(-c2ccc(F)cc2)n1 161403800 ZMZBVAZKTURSBL-UHFFFAOYSA-N 318.417 5.044 30 20 DKED C=C[C@@H](CC(=O)Nc1c(C)cccc1SC)c1ccccc1 184600243 UMRSZILKKMLUNJ-HNNXBMFYSA-N 311.450 5.015 30 20 DKED C[C@@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340444765 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Cc1cccc(N(Cc2ccccc2)C(=O)CCCCCC#N)c1 588823421 TXACCZVDMQLMSV-UHFFFAOYSA-N 320.436 5.002 30 20 DKED CCCCc1nc(CS[C@H](C)c2ccc(C#N)cc2)cs1 609825480 AGMWVWPSJRXDJG-CYBMUJFWSA-N 316.495 5.352 30 20 DKED N#CCOc1ccc(CSc2cc(Cl)ccc2Cl)cc1 731155995 DSYXJSKCTJFOGY-UHFFFAOYSA-N 324.232 5.188 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(Cl)cc1 732624912 GISATBPIWUBFKN-UHFFFAOYSA-N 322.905 5.105 30 20 DKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccccc3Cl)co2)cc1 749886375 MDTKAFGUIBCSRF-ZHACJKMWSA-N 323.779 5.200 30 20 DKED C=CC[C@H](N[C@@H](CC)c1ccc(Cl)s1)c1ccncc1 766017370 ASQIJLCCFJFJCY-KBPBESRZSA-N 306.862 5.155 30 20 DKED C[C@H](N[C@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1F 512630016 LENDNXRROQSOBD-YCRPNKLZSA-N 322.427 5.279 30 20 DKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 776073915 DQDADYBEXJTMKL-RDJZCZTQSA-N 308.425 5.018 30 20 DKED C[C@@H](SCc1cc(Cl)nc(Cl)c1)c1ccc(C#N)cc1 808359610 DOOZUUKOJSJAEI-SNVBAGLBSA-N 323.248 5.254 30 20 DKED C=C[C@H](CC(=O)Nc1cc(C(C)C)c(O)cc1C)c1ccccc1 535442940 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RIOCXVAXIMHMNG-GTPINHCMSA-N 324.493 5.396 30 20 DKED N#Cc1cc(CNc2cccc(-c3cccs3)c2)ccc1F 467764479 QGTCASBHPBWQPB-UHFFFAOYSA-N 308.381 5.038 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(CC)CC 475569145 GEKUVTRLTXBRON-UHFFFAOYSA-N 302.462 5.239 30 20 DKED C=CCC[C@@H](NCc1ccc(C)cc1SC)c1ccco1 513697978 VERGBNXEFRFCHY-MRXNPFEDSA-N 301.455 5.107 30 20 DKED CCCCn1ccnc1-c1cccc(NCC(C)(C)CCC#N)c1 532741674 PRAAEPRRHRDKLM-UHFFFAOYSA-N 324.472 5.092 30 20 DKED CC[C@H](Nc1ccc(C)c(OC(F)F)c1)c1ccc(C#N)cc1 575473909 MZVWRNWYGZPDKX-INIZCTEOSA-N 316.351 5.031 30 20 DKED CCCCCCCCCC(=O)N1CCCc2sccc2C1 730554829 YFJKTOHVBJTYRU-UHFFFAOYSA-N 307.503 5.164 30 20 DKED COc1c(Cl)cc(N[C@H](C)c2cccc(C#N)c2)cc1Cl 777669472 AQISFEJYDTUNHZ-SNVBAGLBSA-N 321.207 5.047 30 20 DKED O=C(/C=C\c1ccc2oncc2c1)c1cc(Cl)sc1Cl 821037431 BXSIYIKGGABCEY-IWQZZHSRSA-N 324.188 5.092 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 90664896 KJNOOYKOOUMJMQ-ACJLOTCBSA-N 316.807 5.175 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H]1CC 191518665 WXFZYOCFXNSWCQ-QAPCUYQASA-N 314.473 5.191 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccccc3)cs2)cc1 213752588 SDCPSSHXGXBUNQ-QXMHVHEDSA-N 305.402 5.015 30 20 DKED Cc1ccc(CNc2ccccc2S[C@H](C)CC#N)cc1C 432330645 CYUOPMWAPVJJBN-MRXNPFEDSA-N 310.466 5.310 30 20 DKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)CCCC(C)(C)C#N 472443003 GCZZMGPNGGXCKZ-CYBMUJFWSA-N 312.379 5.028 30 20 DKED CCCCCCCC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 742780169 DOQRXZVKOUTHSI-CRAIPNDOSA-N 305.437 5.096 30 20 DKED CSc1ccc(C(=O)/C=C/c2cnc(C3CCC3)s2)cc1 760261990 IAAHSRWLXNURPB-MDZDMXLPSA-N 315.463 5.029 30 20 DKED CCCCCCCC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 913897905 GAEQFWWGTVYJRC-KRWDZBQOSA-N 307.865 5.364 30 20 DKED COc1ccc2cc(/C=C\C(=O)c3cc(F)ccc3F)ccc2c1 211344320 FNHFIMYHYNHUKT-OQFOIZHKSA-N 324.326 5.023 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(Cl)c1Cl 231666669 BIUSDIFQXGUKQQ-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C[C@H](C/C(O)=N/[C@@H]1CCC(O)=N[C@H]1C(C)(C)C)C1CCCCC1 329290434 QOQQBNACOKWCND-DDUZABMNSA-N 322.493 5.083 30 20 DKED N#CCCCCSCC/C=C\c1ccc(Br)cc1 480380703 AHXYAZWTGHBXIA-KXFIGUGUSA-N 324.287 5.279 30 20 DKED CO[C@@H](C)c1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 482003372 UAPUUZUYXLNASP-YCRPNKLZSA-N 320.436 5.145 30 20 DKED N#Cc1ccc(SCc2cnc3ccccc3c2)c(Cl)c1 539709093 QDYAZJHOPNCWMI-UHFFFAOYSA-N 310.809 5.052 30 20 DKED N#C[C@H](Cc1ccccc1)Sc1ccc(Cl)c(Cl)c1 610287886 WGUUNQLMXGBXIA-ZDUSSCGKSA-N 308.233 5.220 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cccc2ccccc12)c1ccncc1 749130082 WDKGQLSDNQGGHQ-HRAATJIYSA-N 302.421 5.203 30 20 DKED CC(C)(C#N)c1ccc(CNc2ccc(C(F)F)cc2)cc1 922902421 FEYQLWYAARYDOQ-UHFFFAOYSA-N 300.352 5.037 30 20 DKED COc1ccc(C)cc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 340457865 WLFMPAREOADLEZ-PXNSSMCTSA-N 322.452 5.089 30 20 DKED C=C(C)[C@H](NCc1ccc(Cl)s1)c1ccc(F)c(F)c1 479427440 YJXRIJIRVZYENL-HNNXBMFYSA-N 313.800 5.087 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(Cl)c1 487360550 DPYVBOMUCZEYPW-CYBMUJFWSA-N 316.857 5.346 30 20 DKED C/C=C/c1ccc(NCc2cccc(OCCCC#N)c2)cc1 517776744 OFSDVWDOSVLNBG-QHHAFSJGSA-N 306.409 5.014 30 20 DKED C[C@H](SCc1ccc2ccccc2n1)c1ccc(C#N)cc1 609901170 HNOGJHDWMDTVIH-AWEZNQCLSA-N 304.418 5.101 30 20 DKED C=CCN(C(=O)c1ccc(SC(C)C)cc1)c1ccccc1 614559568 BUZGEZFUISRWOJ-UHFFFAOYSA-N 311.450 5.020 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)ccc1C 189904465 VYWLJEAQQBBPOJ-UHFFFAOYSA-N 311.400 5.238 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc2c(c1)CCC2 195656693 SDTDAUQFTYYYTR-INIZCTEOSA-N 320.436 5.031 30 20 DKED C[C@H](SCCCC(C)(C)C#N)c1ccc(OC(F)F)cc1 480387672 LEJUBZABIXXKFS-LBPRGKRZSA-N 313.413 5.412 30 20 DKED O=C(/C=C\c1cccnc1Cl)c1cccc(-c2ccccc2)c1 728697236 LIVJAXJNQIDGJQ-QXMHVHEDSA-N 319.791 5.298 30 20 DKED CC(=NNc1ccc(Cl)cc1)c1sc(C(C)(C)C)nc1C 915110497 WIPXEHCDQKRAQM-UHFFFAOYSA-N 321.877 5.239 30 20 DKED C[C@H](N[C@H](C)c1cc2ccccc2s1)c1cccc(C#N)c1 181725006 HTYDPMYPTXUOKR-UONOGXRCSA-N 306.434 5.185 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(C)c1 189903493 PXYOQGCCTBUJCU-UHFFFAOYSA-N 307.437 5.408 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(OC)c1 191499543 FZCJOMZVCRQXSP-UHFFFAOYSA-N 324.424 5.191 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340457954 WZOWFEXZRXADTB-LIRRHRJNSA-N 314.379 5.051 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC[C@@H]1CC 477000685 JQNKJWWCVFDBOU-QFBILLFUSA-N 313.485 5.693 30 20 DKED C[C@H](Oc1ccccc1NCCCC(C)(C)C#N)c1ccccc1 531648174 OKWHHCCCPYRHEQ-KRWDZBQOSA-N 322.452 5.568 30 20 DKED N#CCCCCN[C@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 531960761 JFVGBEBZUXAKDD-IRXDYDNUSA-N 324.390 5.015 30 20 DKED C=C[C@H](CC(=O)N1CCCC[C@@H]1c1ccccc1)c1ccccc1 545969103 DPKWMKQBXJBXCN-WIYYLYMNSA-N 319.448 5.100 30 20 DKED CCC(CC)[C@@H](NCc1ccc(C#N)cc1C)c1cccs1 614407235 IXFBNSBIOCAQST-LJQANCHMSA-N 312.482 5.195 30 20 DKED CCC(=NNc1cccc2ncccc12)c1ccc(Cl)s1 733203739 YAFSBBFLPXSIRZ-UHFFFAOYSA-N 315.829 5.176 30 20 DKED CC(=NNc1c(C)cccc1C(C)C)c1sc(C)nc1C 812232649 JQCLHLJKQYSGIH-UHFFFAOYSA-N 301.459 5.028 30 20 DKED Cc1ccc2c(c1)CC[C@H]2N[C@H](CCCC#N)c1ccccc1 815635496 DNJIVJFGSXRCQQ-NHCUHLMSSA-N 304.437 5.007 30 20 DKED O=C(/C=C\c1ccc(Cl)cc1Cl)c1cc(F)ccc1F 916133362 JFUXQGYUXQCMSL-KXFIGUGUSA-N 313.130 5.168 30 20 DKED CC(C)CCc1nc(CSCc2ccc(C#N)cc2)cs1 65013354 BMTLGRSHHWJJJF-UHFFFAOYSA-N 316.495 5.037 30 20 DKED C=CCc1ccc2c(OC)cccc2c1OCc1ccccc1 98177873 AVWVBSGGFPKHTQ-UHFFFAOYSA-N 304.389 5.156 30 20 DKED C[C@@H]1CCC[C@H](C/C(O)=N/[C@H](C)c2ccc3c(c2)CC(O)=N3)C1 328906283 KQPSYCNJRZYUQO-MCIONIFRSA-N 314.429 5.065 30 20 DKED CC(C)C[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462728410 UEOHVMXLLKPRFK-IBGZPJMESA-N 312.844 5.089 30 20 DKED Cc1ccccc1[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 479765901 KQESMCAJTDJCNL-GOEBONIOSA-N 310.466 5.420 30 20 DKED N#Cc1ccc(SCc2ccccc2C(F)(F)F)c(F)c1 525630015 VBSGFUWZIZECRQ-UHFFFAOYSA-N 311.303 5.008 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc2ccccc12 539052190 FSTAOZMUOSWBRJ-JTSKRJEESA-N 314.432 5.535 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CC(C)(C)CCC#N 539849625 HJSVATGNVYCQEH-HUUCEWRRSA-N 306.881 5.094 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550827522 MLLRHSCYQAPXNZ-HNAYVOBHSA-N 312.844 5.426 30 20 DKED CCC(C)(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 767071265 HIIUIXVASYMLSR-IBGZPJMESA-N 320.436 5.107 30 20 DKED COc1cc(/C=C/C(=O)c2csc(Cl)c2)ccc1SC 787185814 JBVPONXOPFGUIQ-HWKANZROSA-N 324.854 5.028 30 20 DKED C=CCC[C@@H](NCc1ccc(Cl)nc1Cl)c1ccccc1 801530310 BEBOOPINQZRJCD-OAHLLOKOSA-N 321.251 5.186 30 20 DKED CCCCCCCCC(=O)N[C@H](c1ccccc1)c1ccncc1 885978909 JNBQKEKJTVASNW-OAQYLSRUSA-N 324.468 5.038 30 20 DKED Cc1ccc(-c2cc(-c3ccccc3)c(C#N)c(Cl)n2)cc1 83203934 SFSQVWCPYZDRKN-UHFFFAOYSA-N 304.780 5.249 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)CC1CC1 191424403 HLGDJFNKRZMELS-UHFFFAOYSA-N 314.473 5.192 30 20 DKED Cc1oc2ccccc2c1CN[C@H](CCCC#N)c1ccccc1 353916222 PANQGKOHJFWVRN-HXUWFJFHSA-N 318.420 5.266 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@H](CCC#N)c1ccccc1)CCC2 358336079 CAQQMRDIIKFMGB-NHCUHLMSSA-N 304.437 5.007 30 20 DKED CC(C)c1nc(CSc2ccc(C#N)cc2Cl)cs1 465389330 RMTXPOIGSUVZIP-UHFFFAOYSA-N 308.859 5.084 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C(C)C 475557379 ANZFIPTVARVINU-GOSISDBHSA-N 314.473 5.191 30 20 DKED C[C@@H](N[C@H](CC1CCC1)c1ccccc1)c1cccc(C#N)c1 495401144 JMJMVDHELXVDOZ-IIBYNOLFSA-N 304.437 5.140 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1nccc2ccccc12)c1ccccc1 558493886 YDKUOWZEUSFMHZ-LAUBAEHRSA-N 316.448 5.593 30 20 DKED C[C@H](Nc1ccc(F)cc1OC1CCCC1)c1cccc(C#N)c1 600848542 UQFSBBYDTZMUFJ-AWEZNQCLSA-N 324.399 5.192 30 20 DKED Cc1nc2cc(NCc3ccccc3C(C)(C)C#N)ccc2s1 781133325 SXEQNFUFBVBYCO-UHFFFAOYSA-N 321.449 5.018 30 20 DKED N#Cc1cccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)c1 917518061 RKDSQBPYGKVOER-MDZDMXLPSA-N 315.397 5.183 30 20 DKED C=C(Cl)CSc1nnc(-c2ccccc2)c2ccccc12 5243068 MUVNSOHPOLFBSJ-UHFFFAOYSA-N 312.825 5.141 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(F)c1 170991716 WPGYPAYRDAUYPB-UONOGXRCSA-N 314.429 5.251 30 20 DKED CC(C)C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccs1 481043189 DTIFWUADEPSRIS-MRXNPFEDSA-N 318.873 5.150 30 20 DKED CCCCOc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 585764767 DRIPFQSVHPXAHN-DLBZAZTESA-N 322.452 5.149 30 20 DKED C[C@H]1CC[C@H](NCc2ccc(C#N)c(Cl)c2)c2sccc21 590778612 FGTQVFHQXPVNJM-ZBEGNZNMSA-N 316.857 5.001 30 20 DKED C=CCC[C@@H](Nc1ccc2c(cnn2C(C)C)c1)c1ccco1 671759125 IMLCJNPMFHCEES-QGZVFWFLSA-N 309.413 5.330 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1cc(C)cc(C)c1 732624989 IMTIARHUDFMMDX-UHFFFAOYSA-N 316.514 5.069 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(C(C)(C)C)cc1)c1ccncc1 746048118 WBCBNZPANKAGPT-UZLBHIALSA-N 308.469 5.347 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1cccc(C(=O)O)c1 1776038601 SXXIFPJVMFSRPX-AWEZNQCLSA-N 304.434 5.169 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(C#N)cc1)CC2 427870204 ZBLFFRLSIGNGSO-VFNWGFHPSA-N 304.437 5.020 30 20 DKED CCc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550828962 QDNXAZHFHATPHV-LAUBAEHRSA-N 306.453 5.335 30 20 DKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1nccc2ccccc12 805929358 BFJNZRKHIQUCHS-QGZVFWFLSA-N 308.425 5.018 30 20 DKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccc(C#N)c1 181409802 UNDLYTDSDIFNQI-ORAYPTAESA-N 310.828 5.014 30 20 DKED CC[C@H](C)c1ccc([C@H](NCc2ccc(C#N)o2)C(C)C)cc1 236909955 MMVQFQPFPXGXTB-MGPUTAFESA-N 310.441 5.152 30 20 DKED Cc1cc(C)c(CNc2ccccc2S[C@H](C)CC#N)c(C)c1 520943539 FHPJMUCKHAQKBC-QGZVFWFLSA-N 324.493 5.618 30 20 DKED C[C@H](N[C@H](C)c1cccc(Cl)c1Cl)c1cccc(C#N)c1 539495697 DBZNRJYCTCNXJN-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C#CC[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccccc1 773117382 VPIQOZUNDLOYTP-KSSFIOAISA-N 317.354 5.121 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(F)c1 189868744 MNZNZQQGNTUVAN-UHFFFAOYSA-N 315.363 5.069 30 20 DKED Cc1cc([C@@H](C)Nc2cccc(OCCCC#N)c2)c(C)s1 193907631 FXFVEUHEIWXUOU-CQSZACIVSA-N 314.454 5.221 30 20 DKED C=CCOc1ccc(CN[C@H](c2ccccc2)C(C)(C)C)cc1 319863796 RKBJFDDMASXWGQ-HXUWFJFHSA-N 309.453 5.128 30 20 DKED C=CCC[C@H](C(=O)Nc1cc2[nH]ccc2cc1C)c1ccccc1 444443279 BAZHJKCXIBEGMN-SFHVURJKSA-N 318.420 5.165 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)s1 512642386 PDNTYDMNFCNRFX-IINYFYTJSA-N 322.836 5.214 30 20 DKED C=CCC[C@H](NCc1ccc(C(F)(F)F)cc1)c1ccco1 513671797 FVZJSFUOBAMOOR-HNNXBMFYSA-N 309.331 5.096 30 20 DKED CC[C@@H](C)[C@@H](NCc1ccc(C#N)s1)c1ccc(Cl)cc1 537328817 FWKRBXDRIJIJES-SJKOYZFVSA-N 318.873 5.150 30 20 DKED CCCC(C)(C)N(Cc1cccs1)C(=O)CCCCCC#N 588989469 HNDBCSPOFMMARV-UHFFFAOYSA-N 320.502 5.129 30 20 DKED CCCCCC[C@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2o1 735205831 HGZXIGXIOWNKFI-GJZGRUSLSA-N 312.413 5.001 30 20 DKED CCCCCCCC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 742780171 DOQRXZVKOUTHSI-QAPCUYQASA-N 305.437 5.096 30 20 DKED C[C@@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 743475614 SZEWQDWHRFRKMG-ZIAGYGMSSA-N 306.434 5.185 30 20 DKED C[C@@H](Sc1nc2cc(Cl)ccc2o1)c1ccc(C#N)cc1 303689697 LRDNYHKLCSQRBA-SNVBAGLBSA-N 314.797 5.206 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1cccs1)C1CC1 481911116 DCRIQPXPFYRVAG-UYAOXDASSA-N 322.477 5.128 30 20 DKED CCC(CC)[C@H](NCc1cc(C#N)ccc1F)c1cccs1 539275736 BWMAQALACQJXQQ-SFHVURJKSA-N 316.445 5.026 30 20 DKED C[C@@H](NCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541091131 ZYTIQSYIGSZEKG-OAHLLOKOSA-N 318.445 5.138 30 20 DKED N#CCCC[C@H](N[C@@H]1CC[C@H](c2ccccc2)C1)c1ccccc1 559861904 DLTUDCRLALAWPB-BDTNDASRSA-N 318.464 5.347 30 20 DKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1ncc(C(C)(C)C)o1 190904197 BGELTEITYOYQRE-OLZOCXBDSA-N 314.454 5.399 30 20 DKED N#CCCC[C@@H](NCc1ccc(F)cc1Cl)c1ccccc1 353916898 RRAPUOZMVKLRSF-GOSISDBHSA-N 316.807 5.004 30 20 DKED C[C@@H](NCc1ccccc1C#N)c1ccc(Cl)c2ccccc12 462466526 WHXVYMUEEZQGTL-CQSZACIVSA-N 320.823 5.216 30 20 DKED N#Cc1cccc(SCc2csc(-c3cccs3)n2)c1 468649261 BRTNZGJLXFBXOH-UHFFFAOYSA-N 314.460 5.036 30 20 DKED Cc1cc(C)c(CN[C@@H](CCCC#N)c2ccccc2)cc1C 570620407 RKPAIKFDPDDVMT-NRFANRHFSA-N 306.453 5.137 30 20 DKED N#CCCCCNCc1c2ccccc2c(Cl)c2ccccc12 728782509 SSYNHQVZHDSXSK-UHFFFAOYSA-N 322.839 5.430 30 20 DKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1coc2ccccc12 761478980 IXKRFKNLHAVDOS-ALCCZGGFSA-N 318.159 5.031 30 20 DKED CC(C)(C#N)c1ccccc1CNc1cccc(C(F)F)c1 131653261 YOFVDKFGBODXHC-UHFFFAOYSA-N 300.352 5.037 30 20 DKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(C)(C)C#N)cc1 267990744 WKGLFBPKRMYDII-CQSZACIVSA-N 324.449 5.028 30 20 DKED N#Cc1c(F)cccc1N[C@@H](c1ccccc1)c1ccc(F)cc1 325051252 PUKJIDKMZABFLX-FQEVSTJZSA-N 320.342 5.038 30 20 DKED Cc1ccc2cc([C@H](C)N[C@H](C)c3ccc(C#N)cc3)oc2c1 425929040 LZHKBOXLNHJBDM-CABCVRRESA-N 304.393 5.025 30 20 DKED C[C@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1ccc(C#N)cc1 463904483 HYRSLOPLSJCJKB-MGPUTAFESA-N 324.443 5.525 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC12CCCCC2 476120027 AZJDORRUNDAVEP-SFHVURJKSA-N 311.469 5.447 30 20 DKED CN(Cc1ccccc1-c1ccccc1)CC(C)(C)CCC#N 510516695 DRPNHWVMHKSKIT-UHFFFAOYSA-N 306.453 5.115 30 20 DKED C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1[C@@H](C)CC 518826241 VILBHRCBCDPKDV-LSDHHAIUSA-N 305.487 5.227 30 20 DKED CC(=NNc1cccc2ccccc12)c1c(C)nn(C(C)C)c1C 747060451 RJBOBTWOTSCRRQ-UHFFFAOYSA-N 320.440 5.070 30 20 DKED N#Cc1ccc(SCCC(F)=C(F)F)cc1C(F)(F)F 863319002 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Cc1ncccc1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 728786455 YCCJIBQIZJDABS-RMKNXTFCSA-N 323.392 5.154 30 20 DKED C#CC[C@H](N[C@H]1CCSc2cc(C)c(C)cc21)c1ccccc1 779039143 QFCXGFZCGLQSEG-PMACEKPBSA-N 321.489 5.195 30 20 DKED C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 464516198 CCPPJRVNMYJVHP-VXGBXAGGSA-N 314.256 5.115 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 551204113 ABEVUWNBBPVBSB-ZFWWWQNUSA-N 318.873 5.487 30 20 DKED C[C@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1cccc(C#N)c1 611438793 SNRWHGKYZUVEMD-QWHCGFSZSA-N 324.811 5.370 30 20 DKED CSc1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 619623937 LQFDNDCLDINDSO-OAHLLOKOSA-N 324.493 5.060 30 20 DKED Cc1ccc([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)s1 795785850 DQZUJVWOMMEVBJ-KBXCAEBGSA-N 310.466 5.047 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1csc(Cl)c1 191425058 PJGWKYHSUKJEKB-LBPRGKRZSA-N 320.845 5.257 30 20 DKED Cc1ccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc1C(=N)O 329083661 SVHRFVNSIMUMEP-VNQPRFMTSA-N 314.429 5.073 30 20 DKED CC(C)C[C@H](NCc1ccc(C#N)cc1Cl)c1cccs1 439433133 ALRREOPIGKQTQE-INIZCTEOSA-N 318.873 5.150 30 20 DKED N#Cc1ccccc1SCc1csc(-c2cccs2)n1 439711616 VBNYWRCQMVAIIA-UHFFFAOYSA-N 314.460 5.036 30 20 DKED C=CC[C@@H](C)N[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 542493477 BCMNNIPKRSXZKO-QVKFZJNVSA-N 320.411 5.018 30 20 DKED CCCc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 570521641 YAHFJRQMZJTQPO-NRFANRHFSA-N 306.453 5.164 30 20 DKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nccc2ccccc12 792106611 SFSZRJQOTUMJML-MAUKXSAKSA-N 308.425 5.018 30 20 DKED C=CCCCCC[C@H](C)Nc1ccc(NC(C)=O)c(Cl)c1 793546951 PDHAXCILVQHYIR-ZDUSSCGKSA-N 308.853 5.235 30 20 DKED C[C@H](SCC1CCC(C#N)CC1)c1ncc(C(C)(C)C)o1 902568666 XBDHSWNXPPDFSQ-HSBZDZAISA-N 306.475 5.096 30 20 DKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1cccc(C#N)c1 181409842 UNDLYTDSDIFNQI-YJYMSZOUSA-N 310.828 5.014 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)C[C@H]1C 417046386 SRRXTLPPMOUFEV-OAHLLOKOSA-N 314.473 5.191 30 20 DKED CC(C)(C#N)CCCCSCc1coc(-c2cccs2)n1 435887409 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N#Cc1ccc(CNc2ccccc2Oc2cccc(F)c2)cc1 60458526 LDQXOBHYZWOBJN-UHFFFAOYSA-N 318.351 5.102 30 20 DKED Cc1c([C@@H](NCc2cc(C#N)cs2)C(C)C)oc2ccccc12 236785453 WMNMZFHQLZNQQL-SFHVURJKSA-N 324.449 5.161 30 20 DKED CCCOc1ccc(Cl)cc1N[C@H](C)c1ccc(C#N)cc1 314613314 VINQIINHZZDLOG-CYBMUJFWSA-N 314.816 5.174 30 20 DKED Cc1ccc(C)c([C@H](C)Nc2cccc(OCCCC#N)c2)c1 321552860 FFBLGUJXTSYGFG-KRWDZBQOSA-N 308.425 5.159 30 20 DKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC(C)(C)C 476519381 NDGMAXKJZAUQCF-ZIAGYGMSSA-N 318.486 5.092 30 20 DKED N#Cc1ccnc(S[C@H](Cc2ccccc2)c2ccccc2)c1 496498460 SHTLFMZIWQYNQB-LJQANCHMSA-N 316.429 5.029 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)cc1 512658966 BGHOUUJIYXBSFG-KZULUSFZSA-N 316.807 5.153 30 20 DKED CC(C)(C#N)CCCN[C@@H](Cc1ccccc1)c1ccccc1F 539360346 ZAPACYXEYHWWQB-FQEVSTJZSA-N 324.443 5.029 30 20 DKED CSc1ccc([C@@H](C)NC2(c3ccc(C#N)cc3)CCC2)cc1 594512826 DZNYEUFRCVVBMG-OAHLLOKOSA-N 322.477 5.010 30 20 DKED O=C(/C=C\c1ccc(Cl)nc1)c1cc2cc(Cl)ccc2o1 748997690 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N#CCCSc1ccccc1NCc1ccc(Cl)c(F)c1 190551386 ROKANTWLYZBQEJ-UHFFFAOYSA-N 320.820 5.097 30 20 DKED CC1(C/N=C(/O)CCc2nc3ccccc3o2)CCCCCC1 329239298 QFRZQXPIZXAIIM-UHFFFAOYSA-N 314.429 5.077 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1 340446435 ONZZMKXUQMAILA-VQTJNVASSA-N 310.416 5.302 30 20 DKED CCCCCCCC(=O)Nc1ccccc1-c1csc(C)n1 794130179 RIUNJSYAQIAHBI-UHFFFAOYSA-N 316.470 5.418 30 20 DKED C[C@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 37201467 ZFQURRSABAIHAK-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C=C[C@H](CC(=O)Nc1c(C)cccc1SC)c1ccccc1 184600224 UMRSZILKKMLUNJ-OAHLLOKOSA-N 311.450 5.015 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCC(C)C 191439503 GGCPPMSMCDEHHG-UHFFFAOYSA-N 302.462 5.048 30 20 DKED CCc1cccc(CNc2ccccc2S[C@H](C)CC#N)c1 468963327 KORADCJQZVDKSW-OAHLLOKOSA-N 310.466 5.255 30 20 DKED Cc1ccc([C@@H](NCCCC(C)(C)C#N)c2ccccc2)cc1 471697783 QVNFZHPBAKITPT-FQEVSTJZSA-N 306.453 5.004 30 20 DKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccccc1C#N 520173030 FOFAAIPKYFSTDV-GFCCVEGCSA-N 319.235 5.058 30 20 DKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2o1 614184849 AFIUQKAGHNSIHR-OAHLLOKOSA-N 318.420 5.085 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C/c2ccc(Cl)nc2)cc1 748997120 FPGVLYFGXUWZIQ-YCRREMRBSA-N 317.841 5.132 30 20 DKED C#CCCCCC(=O)Nc1ccc(S[C@@H](C)CC)cc1C 773292582 ZGVWZRBKENNVMI-HNNXBMFYSA-N 303.471 5.018 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1ccncc1 815580043 AZLVXTRCESMQNL-BTYIYWSLSA-N 320.411 5.342 30 20 DKED C=C(C)CNc1ccccc1Oc1ncc(Cl)cc1Cl 917824445 WODYHXAFFWOWKW-UHFFFAOYSA-N 309.196 5.169 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)ccc1Cl 36991837 DGXHVGVHVRCKRD-NEPJUHHUSA-N 319.235 5.277 30 20 DKED CC(C)Oc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665036 YUHKEQQMBFXXLR-UWJYYQICSA-N 322.452 5.169 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1CC 191414912 SCAJVVCTMQCHDQ-KRWDZBQOSA-N 314.473 5.335 30 20 DKED C[C@H](S[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1 437279679 YBUSSMARMSQEIC-STQMWFEESA-N 312.394 5.022 30 20 DKED CC(C)c1cnc(S[C@H](C)c2cccc(C#N)c2)n1C(C)C 442912625 FESOQBJRXSMGDJ-CQSZACIVSA-N 313.470 5.312 30 20 DKED CC[C@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1ccc(C#N)cc1 447596098 PNMQBKOPFOGSKK-UGSOOPFHSA-N 322.383 5.245 30 20 DKED CC[C@@H](Cc1cccs1)N[C@@H](CCCC#N)c1ccccc1 590257326 LDRIZCQYRVVCDF-HKUYNNGSSA-N 312.482 5.094 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2s1 784821395 PXZQYTOVSQREJA-KGLIPLIRSA-N 314.454 5.079 30 20 DKED C=C(CC)CNC(=S)Nc1c(C(C)C)cccc1C(C)C 840826294 KEVHVGZBIOTWKE-UHFFFAOYSA-N 304.503 5.186 30 20 DKED CC[C@H](N[C@@H](C)c1ccccc1SC)c1ccc(C#N)cc1 442867558 YYURRVZFFPWYJZ-KSSFIOAISA-N 310.466 5.082 30 20 DKED Cc1cc(CN[C@H](C)c2ccc(Cl)cc2Cl)ccc1C#N 488189511 ZSZWLNRFDBQFRJ-GFCCVEGCSA-N 319.235 5.024 30 20 DKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1ccccc1)C1CCCC1)CC2 517228294 KBUQBDCNBOCCKZ-FCHUYYIVSA-N 316.448 5.067 30 20 DKED C=CCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 533393786 MLXZEBYFINKKBT-QGZVFWFLSA-N 310.441 5.178 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc2oc3ccccc3c2c1 583779105 CGLMLYBURUQJTG-UHFFFAOYSA-N 308.381 5.016 30 20 DKED CC(C)(CCC#N)CNCc1ccc(-c2ccccc2Cl)o1 584194921 FCNXOLJSQBPBHI-UHFFFAOYSA-N 316.832 5.020 30 20 DKED N#C[C@H](Cc1ccccc1)SCc1cccc2ccccc12 604502221 JRYFEMMRYUFLEV-IBGZPJMESA-N 303.430 5.208 30 20 DKED C=CCCCCC[C@@H](C)Nc1cccc(NC(=O)N(C)C)c1C 793588314 IWBOETZWUNWGMX-OAHLLOKOSA-N 317.477 5.025 30 20 DKED O=C(/C=C/c1cscc1Cl)c1c(F)cccc1Cl 809159016 GIFBEMXQSBNMIZ-SNAWJCMRSA-N 301.169 5.090 30 20 DKED C=CCC[C@@H](N[C@@H]1CCCc2nc(C)sc21)c1ccccc1 90580704 WCPHPRNTFLOWOR-SJLPKXTDSA-N 312.482 5.126 30 20 DKED C[C@H](CCCC(F)(F)F)N[C@@H](CCCC#N)c1ccccc1 340445990 MLIVRNCPMRZAIS-ZBFHGGJFSA-N 312.379 5.132 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](CC)C(C)C 476120689 LJJFVONVSREHQU-INIZCTEOSA-N 301.474 5.549 30 20 DKED Cc1ccc(C)c(CNc2ccccc2S[C@@H](C)CC#N)c1 520200803 WUBSEWREVQXTBZ-INIZCTEOSA-N 310.466 5.310 30 20 DKED CC1(C)CC[C@H]2C[C@H](NCc3ccc(C#N)s3)c3cccc1c32 538493304 ZQTVIIHLMKYAFB-UGSOOPFHSA-N 322.477 5.009 30 20 DKED CCC(CC)[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccs1 574946074 OKRQOBKPQYWBSP-AZUAARDMSA-N 324.493 5.374 30 20 DKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1cccs1 727263915 JLFGFZQLPUZOKD-XQRVVYSFSA-N 316.731 5.316 30 20 DKED Cc1c(C(=O)/C=C/c2ccc3ncccc3c2)oc2ccccc12 747139370 KZTROJDZWRQWKU-PKNBQFBNSA-N 313.356 5.186 30 20 DKED C=CCC[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccco1 796868283 FZPAOGLCILRING-KRWDZBQOSA-N 314.404 5.138 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1cccs1 417348785 JORKPFPOBJHUHR-KANFNMMFSA-N 324.493 5.265 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1 540150279 GQGFYPDOENAQKD-HNAYVOBHSA-N 313.416 5.192 30 20 DKED CC(C)Oc1ccc(CC#N)cc1-c1ccccc1C(F)F 596637638 LUHXWJALYGOSOS-UHFFFAOYSA-N 301.336 5.144 30 20 DKED CC(C)c1ccc([C@@H](C)Nc2ccccc2O[C@@H](C)C#N)cc1 780743967 CCVVHWLIHXUZTN-JKSUJKDBSA-N 308.425 5.274 30 20 DKED CC(C)(C)Nc1ccccc1NCc1ccc(C2(C#N)CC2)cc1 850285971 SXXSIBYUXLOVFA-UHFFFAOYSA-N 319.452 5.064 30 20 DKED CCN(Cc1ccc(C#N)cc1F)[C@H](C)c1cc2ccccc2o1 64348923 UDGVEGLHYCUQRA-CQSZACIVSA-N 322.383 5.027 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2cc[nH]c12 188062809 KMXYZJXEYVODIE-UHFFFAOYSA-N 318.420 5.272 30 20 DKED CC(C)(C)c1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 474099024 UCMYLBYXRIMCGZ-KRWDZBQOSA-N 320.436 5.010 30 20 DKED CCOc1cccc2cc([C@@H](C)Nc3ccc(C#N)cc3F)oc12 506835272 XPNRMIOFAGHGRW-GFCCVEGCSA-N 324.355 5.015 30 20 DKED C=C[C@@H](CC(=O)Nc1ccccc1OC(C)(C)C)c1ccccc1 533941910 SLPRNLQLZBVXFM-INIZCTEOSA-N 323.436 5.162 30 20 DKED N#CCCC[C@H](N[C@H]1CCc2ccc(Cl)cc21)c1ccccc1 551212327 ZJTDQMFEIINTNC-PMACEKPBSA-N 324.855 5.352 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1 553317474 VXWIYNFZOBRALA-CYBMUJFWSA-N 316.857 5.346 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)s1 728439432 KSILHSXQMJWJPH-WAYWQWQTSA-N 317.460 5.138 30 20 DKED COCc1cccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)c1 742429775 ZPCBAZJBNQEETC-VMPITWQZSA-N 321.203 5.036 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccsc3)cs2)cc1 749105545 UVBQDKYJVZYHOF-SREVYHEPSA-N 311.431 5.076 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1ccncc1 766018853 JIFVFHKQTGSOQD-LPHOPBHVSA-N 318.420 5.310 30 20 DKED CC(C)(C#N)CCCN1CCCC[C@H]1c1cccc(Cl)c1 444806940 VPNLZRREEQQIMC-KRWDZBQOSA-N 304.865 5.197 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(/C=C\C)cc1 497329425 PKEHAFFMYKTYPC-UTCJRWHESA-N 312.438 5.001 30 20 DKED CC[C@@H](C)Sc1ccc(NCc2ccc(C#N)cc2)c(C)c1 498638848 OLXRQWJRZSMQJF-OAHLLOKOSA-N 310.466 5.369 30 20 DKED N#CCCCCS[C@H](c1ccccc1)c1ccc(Cl)cc1 619247889 HWDVFWZGUAXYJZ-GOSISDBHSA-N 315.869 5.856 30 20 DKED O=C1/C(=C/c2nc(-c3ccccc3)cs2)CCc2sccc21 727973925 CCEHNXNUCFQYIC-JLHYYAGUSA-N 323.442 5.084 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1cc2ccccc2[nH]1)c1ccccc1 775632333 YISOIGPGHGQUFJ-QFBILLFUSA-N 304.437 5.526 30 20 DKED C[C@H](OC(=O)CCCCCC#N)c1ccccc1-c1ccccc1 805870566 SRODNQYJXYVAKH-KRWDZBQOSA-N 321.420 5.432 30 20 DKED C=CCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 102216094 MXRFLJXHSCWLRZ-UHFFFAOYSA-N 322.433 5.236 30 20 DKED CC(C)CC[C@@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1 236609264 VIQQQVLRPXLUNW-GOSISDBHSA-N 316.832 5.072 30 20 DKED C=C[C@@](C)(CC)C(=O)N1CC=C(c2cccc3ccccc23)CC1 442952738 TZSZHLLCAYNJRS-QFIPXVFZSA-N 319.448 5.058 30 20 DKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H]1CC[C@@H](CC#N)C1 453287566 GQMXBOSFVHBCSK-GBESFXJTSA-N 324.493 5.012 30 20 DKED C=CCC(C)(C)C(=O)Nc1cccc(COC(C)(C)CC)c1C 551454160 IMPVKUNZTNYUHC-UHFFFAOYSA-N 317.473 5.241 30 20 DKED N#CCCC[C@@H](NCc1cccc2ccccc12)c1ccccc1 552313206 UOUDZCAXTANYSC-JOCHJYFZSA-N 314.432 5.365 30 20 DKED N#CCCSc1ccccc1NCc1ccc(C2CCC2)cc1 576100961 DWDQRNVWILGYPS-UHFFFAOYSA-N 322.477 5.572 30 20 DKED Cc1ccccc1[C@@H](NCc1ccc(C(C)(C)C#N)cc1)C(C)C 614179621 VFDSBQUQSWOSEU-NRFANRHFSA-N 320.480 5.283 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1cc2ccccc2s1 782352060 PXQUDFFAYDFLCX-BQYQJAHWSA-N 311.431 5.131 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@H](C#N)c1nccc2ccccc12 792106613 SFSZRJQOTUMJML-QAPCUYQASA-N 308.425 5.018 30 20 DKED COc1ccc2cc(N[C@H](C)c3ccc(C#N)c(F)c3)ccc2c1 797022448 QWYNYWGETXMZKN-CYBMUJFWSA-N 320.367 5.032 30 20 DKED CC[C@H](SCCCC1(C#N)CCOCC1)c1ccc(F)cc1 281995974 WBSGNTGZUPNMOI-KRWDZBQOSA-N 321.461 5.111 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)C1CCC(F)(F)CC1 340453077 RKGRIPSJVXHHOA-YJBOKZPZSA-N 320.427 5.225 30 20 DKED Cc1cc2c(cc1C)[C@@H](N[C@H](C)c1ccc(C#N)cc1)CCS2 427589573 RSBMZJVLZOPDHE-BEFAXECRSA-N 322.477 5.063 30 20 DKED C=CCC(C)(C)CNC(=O)Nc1cc(C(F)F)ccc1Cl 433251353 DFTHPPAJOWFBAG-UHFFFAOYSA-N 316.779 5.001 30 20 DKED C=CCSc1ccccc1C(=O)Nc1cccc(Cl)c1F 485740540 GFMGZEVRZZEZMP-UHFFFAOYSA-N 321.804 5.010 30 20 DKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(C)cc1)c1ccccc1 533888266 AEHWJMPYYWMMSK-GHTZIAJQSA-N 319.448 5.018 30 20 DKED CC(=NNc1cc(C)ccc1C)c1sc(C(C)C)nc1C 751135446 XQCNKRUDXAJJAW-UHFFFAOYSA-N 301.459 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](F)c1ccccc1 789719697 IEGGJFQRWOZQST-SFHVURJKSA-N 311.400 5.188 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C)c1 340450381 XYMNLQJLESLAAS-NHCUHLMSSA-N 306.453 5.471 30 20 DKED Cc1cc(N[C@H](C)c2ccc(C#N)cc2)ccc1-c1ccncc1 427825064 HAWBVSUOSXZFIG-MRXNPFEDSA-N 313.404 5.102 30 20 DKED Cc1cc(/C=C/C(=O)c2cccs2)ccc1Oc1cccnc1 732714291 WOMZVBJJVJFVDZ-SOFGYWHQSA-N 321.401 5.140 30 20 DKED Cc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)s1 744868666 GGPCKOVVMSVXRU-SNAWJCMRSA-N 303.235 5.321 30 20 DKED C=CCCC[C@H](N[C@@H]1CCCc2oc(C)nc21)c1ccccc1 926857046 ZZYNBMJXJUXDHT-ZWKOTPCHSA-N 310.441 5.048 30 20 DKED O=C1/C(=C/c2ccccc2)CCc2nc(-c3ccccc3)sc21 60241323 KYAXUCMSNALVQS-DTQAZKPQSA-N 317.413 5.023 30 20 DKED N#CCC[C@H](NCc1cccc(Cl)c1Cl)c1ccccc1 130511847 IMMROYLRYICYSB-INIZCTEOSA-N 319.235 5.128 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1cccc(-c2ccccc2)c1 480797166 SHBVAYCYCMBHCI-QGZVFWFLSA-N 312.416 5.076 30 20 DKED C[C@@H](NCCCCC#N)c1ccc(-c2ccccc2Cl)s1 482446240 BXDAYEOOZWWZOJ-CYBMUJFWSA-N 318.873 5.413 30 20 DKED N#CCC[C@H](N[C@H]1CCCc2ccc(Cl)cc21)c1ccccc1 539048284 DETVGWGDGWHPDB-PMACEKPBSA-N 324.855 5.352 30 20 DKED CC[C@H](Cc1cccs1)N[C@@H](CCCC#N)c1ccccc1 590257332 LDRIZCQYRVVCDF-MJGOQNOKSA-N 312.482 5.094 30 20 DKED C=CC[C@H](NCc1ccc(-c2ccc(C)cc2)o1)c1ccncc1 734509033 GORJTNKKNWPRGJ-FQEVSTJZSA-N 318.420 5.057 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(OCCCC)cc1)c1ccncc1 793539199 FBBCHPWCQJVECW-UWJYYQICSA-N 324.468 5.229 30 20 DKED C=CCCCCC[C@H](C)Nc1cccc(NC(=O)N(C)C)c1C 793588307 IWBOETZWUNWGMX-HNNXBMFYSA-N 317.477 5.025 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCCC 189900226 ROKHHQMDXMYSTM-HNNXBMFYSA-N 319.514 5.399 30 20 DKED Cc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1Cl 353915284 NCYFSYOPIKOOPY-LJQANCHMSA-N 312.844 5.173 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1-c1c(F)cccc1F 494534798 VWMKWYVOIANVGU-CYBMUJFWSA-N 315.363 5.173 30 20 DKED C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1[C@@H](C)CC 518826239 VILBHRCBCDPKDV-GJZGRUSLSA-N 305.487 5.227 30 20 DKED C[C@H](SCc1ncc(Cl)cc1Cl)c1ccc(C#N)cc1 537422011 YFFKVGIMGWYQSD-JTQLQIEISA-N 323.248 5.254 30 20 DKED Cc1cc(C)c([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1C 540151856 BJGWRPMIILPTAS-GHTZIAJQSA-N 306.453 5.308 30 20 DKED CSc1ccc([C@@H](C)Nc2ccc3cc(C#N)ccc3n2)cc1 541232547 SAWDVZDKKIIFKN-CYBMUJFWSA-N 319.433 5.001 30 20 DKED C=CC[C@@H](C)N[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 542493478 BCMNNIPKRSXZKO-VFNWGFHPSA-N 320.411 5.018 30 20 DKED CC[C@H](N[C@@H](CC)c1ccc(C#N)cc1)c1ccc(Cl)cc1 579552699 WTZVMJIGVXVMNI-OALUTQOASA-N 312.844 5.404 30 20 DKED Cc1ccccc1[C@@H](NCc1ccc(C#N)o1)C1CCC(C)CC1 610270980 MIKDPFOPNHQQLN-GRXDXKALSA-N 322.452 5.117 30 20 DKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1 610830409 QSQCFSLSTRJAMU-VXGBXAGGSA-N 319.235 5.277 30 20 DKED C[C@@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)cc1F 781422468 PVLOGCSQEIAMKV-SNVBAGLBSA-N 322.355 5.185 30 20 DKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nccc2ccccc12 792091611 LUJJAFHJSJMHKI-MAUKXSAKSA-N 308.425 5.018 30 20 DKED Cc1cc(S[C@H](C)c2ccc(C#N)cc2)nc2ccccc12 303654014 BVLNSRVNBGCVAC-CQSZACIVSA-N 304.418 5.268 30 20 DKED N#CCCC[C@H](NCCSC1CCCCC1)c1ccccc1 433021173 WBVYIDKXASYRGB-IBGZPJMESA-N 316.514 5.077 30 20 DKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H]1CC[C@@H](CC#N)C1 453287556 GQMXBOSFVHBCSK-FHWLQOOXSA-N 324.493 5.012 30 20 DKED CC(/C=C\c1ccc(C#N)cn1)=C\c1cccc(C(F)(F)F)c1 486121135 AYMYEZFXHYJUHV-YNKPAJJNSA-N 314.310 5.089 30 20 DKED C=CCCSCC(=O)Nc1c(C(C)C)cccc1C(C)C 610088852 GPTPUIXLGVKWOG-UHFFFAOYSA-N 305.487 5.181 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)cc(C)c1 613901708 RXJLCFJQABWRBN-UHFFFAOYSA-N 321.464 5.337 30 20 DKED CC[C@@H](NCc1ccc(C#N)cc1F)c1cccc2ccccc12 615085942 WCVPUWLHVMOUHX-OAQYLSRUSA-N 318.395 5.091 30 20 DKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(C)o2)cc1 741467537 NSNNAYWPUZNSHS-RAXLEYEMSA-N 318.372 5.160 30 20 DKED CCCCCCCC[S@@](=O)Cc1nc(C(C)(C)C)cs1 790138814 HROWXOWPTJAJNW-HXUWFJFHSA-N 315.548 5.050 30 20 DKED Cc1ccccc1C(=O)/C=C\c1csc(-c2ccc(F)cc2)n1 797111752 WNKBHPCMZJKOES-KHPPLWFESA-N 323.392 5.154 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1sccc1OC)c1ccc(F)c(F)c1 186449994 XQRCMAYZAUJPPN-MEDUHNTESA-N 323.408 5.003 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1cccc(CC#N)c1 191538411 SPIMOQIIDZDKLJ-UHFFFAOYSA-N 320.436 5.081 30 20 DKED CC[C@H](N[C@@H](c1ccc(F)cc1)C(C)C)c1ccc(C#N)cc1 503885150 KELAXDDBXHIRMA-VQTJNVASSA-N 310.416 5.135 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@H](C#N)C1CCCCC1 522840943 CNIUHDOYHHPQKR-MRXNPFEDSA-N 306.837 5.012 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2o1 551207004 YVWCEOKOPOGWKX-LPHOPBHVSA-N 318.420 5.519 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(-c2cccs2)cc1 558236769 ZPPYQZLVZOPQCS-OAHLLOKOSA-N 312.482 5.396 30 20 DKED C=CC[C@@H](N[C@H](CC)c1ccc(Cl)s1)c1ccncc1 766017373 ASQIJLCCFJFJCY-ZIAGYGMSSA-N 306.862 5.155 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1cccnc1 917092651 VAHCBYUTWANGFU-IBGZPJMESA-N 316.489 5.276 30 20 DKED C[C@@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CCCCC1 303100369 HJXXMKTYBUWZGN-HNNXBMFYSA-N 312.457 5.033 30 20 DKED CCc1ccc([C@@H](CC)N[C@@H](CCCC#N)c2ccccc2)cc1 340460968 YPBUBMBBUJDHML-YADHBBJMSA-N 320.480 5.725 30 20 DKED CN(CCCCC(C)(C)C#N)CCc1cccc2ccccc12 444628821 UITHCBXJUYLQRO-UHFFFAOYSA-N 308.469 5.034 30 20 DKED C=CC[C@H]1N(C(=O)Nc2c(C)cccc2CC)CCCC1(C)C 444819338 RXFWUSQXQNRDOA-QGZVFWFLSA-N 314.473 5.156 30 20 DKED CC1(C#N)CCC(N[C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 449773293 MQNWFXSKBSXQFB-ZTRSQXPZSA-N 316.876 5.038 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccccc1 475551793 YVKOEJJPQZSITN-INIZCTEOSA-N 322.452 5.421 30 20 DKED Cc1cc(C)c2c(c1)CC[C@H]2N[C@H](CCCC#N)c1ccccc1 594505957 GJUODJOQGPUPEX-NHCUHLMSSA-N 318.464 5.316 30 20 DKED N#Cc1ccc(SCc2cccc(C(F)(F)F)c2)c(F)c1 610164668 OIPAWKUXCIHRIU-UHFFFAOYSA-N 311.303 5.008 30 20 DKED Cc1cc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)c(C)s1 614180131 YRNSWICEUAUTSP-AWEZNQCLSA-N 312.482 5.017 30 20 DKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 727952517 JVETUBVXEWMUBQ-WMZOPIPTSA-N 322.452 5.408 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1ccccc1 789720337 WGTCIAGHYJMRTK-BMRADRMJSA-N 319.448 5.581 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)CC(F)F 890166018 VEVGLWSUJWXZJT-UHFFFAOYSA-N 323.427 5.549 30 20 DKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C2CC2)c1 451116242 QTZQWZOYQLHBJF-INIZCTEOSA-N 318.464 5.216 30 20 DKED CC1(C)CC[C@H]2C[C@H](NCc3cc(C#N)cs3)c3cccc1c32 538487688 TUJVNQAQSDPLAL-KSSFIOAISA-N 322.477 5.009 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)cc1 553317477 VXWIYNFZOBRALA-ZDUSSCGKSA-N 316.857 5.346 30 20 DKED CSc1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1C 614057981 XMEYWFRTFNPUJR-UHFFFAOYSA-N 310.466 5.130 30 20 DKED FC(F)(F)c1ccccc1ON=C[C@H]1CCCc2ccccc21 754709674 MTNLVGLVSRYLQK-CQSZACIVSA-N 319.326 5.190 30 20 DKED O=C(/C=C\c1nc(Cl)cs1)c1cc(Cl)sc1Cl 759076849 SWWALJRDLPERGW-UPHRSURJSA-N 324.641 5.061 30 20 DKED C=CC[C@H](N[C@@H](CC)c1ccc(Cl)cc1)c1ccncc1 766022519 WOUHVEVLPQOKSB-ROUUACIJSA-N 300.833 5.093 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)CCCCC(C)(C)C)n1 805891961 ZNVXUQOJIPSJEN-CYBMUJFWSA-N 306.475 5.049 30 20 DKED COc1cccc2cc(C(=O)/C=C/c3ccc(Cl)s3)oc12 14179489 SOPFKGDMNBTIBX-FNORWQNLSA-N 318.781 5.052 30 20 DKED CCC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccsc1 443081394 VMFBBLXMUPCLLN-GOSISDBHSA-N 314.454 5.384 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 539051417 ICYSQLPPSPIGTQ-XJKSGUPXSA-N 323.358 5.657 30 20 DKED CCC(CC)[C@@H](NCc1cccc(C#N)c1F)c1cccs1 539279207 AYXXQFWGJHARKW-GOSISDBHSA-N 316.445 5.026 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccsc1Cl 594705948 QSMQYSQWZNKAMZ-LLVKDONJSA-N 322.886 5.408 30 20 DKED Cc1cccc(C)c1CNc1ccccc1SC[C@H](C)C#N 610000168 HZTYOUUSBNNUMH-CQSZACIVSA-N 310.466 5.167 30 20 DKED CCCC[C@H](ON=C(C)C)C(=O)Nc1c(C)cccc1C(C)C 768224535 QUCXHQAKFZESND-KRWDZBQOSA-N 318.461 5.028 30 20 DKED CC(C)(C#N)CCCOc1c(C=O)cc(Cl)c2ccccc12 774665267 JCRXMVNLEHOPDA-UHFFFAOYSA-N 315.800 5.014 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2)cc1 11038220 XEAJRBSVODMKGO-KRWDZBQOSA-N 312.416 5.076 30 20 DKED CSc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665225 FIARHEJDWPRALN-KXBFYZLASA-N 310.466 5.104 30 20 DKED C=CCC[C@H](C(=O)Nc1ccsc1Cl)c1ccccc1 187848654 QCNWGMZYTKLYDV-ZDUSSCGKSA-N 305.830 5.090 30 20 DKED CCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315888538 PFQCGTIMBDDKSF-IFXJQAMLSA-N 312.844 5.404 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cc(C)oc1C)c1ccc(F)c(F)c1 447590334 BUMAFBMDSBKSDZ-KPZWWZAWSA-N 305.368 5.143 30 20 DKED CCC[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccn1 729149299 IPIWMDSWEVPZDP-DGURAOSJSA-N 323.223 5.054 30 20 DKED COc1ccc2oc(C(=O)/C=C\c3ccc(C)s3)c(C)c2c1 729150740 LYTSUIMIYRBUMD-FPLPWBNLSA-N 312.390 5.016 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3cccs3)cs2)cc1 918713955 SZXYERUIXJCLNA-HJWRWDBZSA-N 311.431 5.076 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccccc1C 918723776 XPGKRRZRZYXMCH-UHFFFAOYSA-N 306.519 5.374 30 20 DKED Cc1cccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)c1 78460581 JWKGMNADBHBMRL-ZHACJKMWSA-N 305.402 5.015 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1sccc1OC)c1ccc(F)c(F)c1 186450030 XQRCMAYZAUJPPN-ZBEGNZNMSA-N 323.408 5.003 30 20 DKED O=C(/C=C\c1cccc(O)c1)c1cc2c(ccc3ccccc32)o1 211279637 IPXDHDJMPQCTNO-NTMALXAHSA-N 314.340 5.188 30 20 DKED N#CCC[C@H](Nc1nc(-c2ccccc2)cs1)c1ccccc1 301772163 GCDRSVFQFUFQSM-KRWDZBQOSA-N 319.433 5.267 30 20 DKED N#Cc1ccc(F)c(CSCc2ccc(C(F)F)cc2)c1 460779550 DBONCNDXHMPRGX-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)CCCC(C)(C)C#N 472443004 GCZZMGPNGGXCKZ-ZDUSSCGKSA-N 312.379 5.028 30 20 DKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccccc1)C1CCC1 487355934 IJYKAIVHYNXULU-OAQYLSRUSA-N 318.464 5.119 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 728438367 VLFQTYHVXYUOEZ-HJWRWDBZSA-N 311.431 5.076 30 20 DKED CCCCCCCCCC[C@H](C)Nc1nc(C)ccc1C(=O)O 1776785309 SUSAEBYIIXODEV-HNNXBMFYSA-N 320.477 5.419 30 20 DKED C[C@H](Sc1cccc(C#N)c1)c1ncc(-c2ccccc2)o1 177099344 GVNGCCRPOWGJLC-ZDUSSCGKSA-N 306.390 5.067 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 329114742 SLOMMACHMOJXAG-UWWQBHOKSA-N 323.440 5.271 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(SC)ccc1C 410392569 LHRMQTNOGJTIPE-UHFFFAOYSA-N 311.450 5.088 30 20 DKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccccc1)c1ccccc1 435107124 RYYULDSZSLQTSJ-PXNSSMCTSA-N 322.452 5.097 30 20 DKED CC[C@@H](N[C@@H](CC(C)C)c1cccs1)c1ccc(C#N)cc1 447527675 FRZJYGCVYJVFLN-MSOLQXFVSA-N 312.482 5.448 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1C(C)C 471121356 QEFSUNPKUVCRIS-UHFFFAOYSA-N 322.452 5.420 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1CC 475578157 MMUPHGJMFFUXTC-RDJZCZTQSA-N 314.473 5.191 30 20 DKED Cc1ccc(C)c(CNc2ccccc2S[C@H](C)CC#N)c1 520200804 WUBSEWREVQXTBZ-MRXNPFEDSA-N 310.466 5.310 30 20 DKED C[C@H](NCc1ccc(C2CCCC2)cc1)c1cccc(C#N)c1 588965430 YPOPUMXSLNWBKG-INIZCTEOSA-N 304.437 5.067 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@@H](C#N)c2ccccc2)cc1 595415365 PNSDMXQCIQPUOA-BEFAXECRSA-N 310.466 5.103 30 20 DKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cncc(F)c2)c1 737445725 GIHPKSVTBJAAJH-KTKRTIGZSA-N 317.363 5.092 30 20 DKED CCCCCCCC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 762722409 VUENTSWOXBHHNY-AWEZNQCLSA-N 305.466 5.031 30 20 DKED C[C@H](N[C@H](C)c1ccc(C(F)(F)F)s1)c1cccc(C#N)c1 902827761 OOPUZLRDVREHIM-WDEREUQCSA-N 324.371 5.050 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C#N)cc1 340450971 YPZIBSMIDPIIAT-SFTDATJTSA-N 317.436 5.034 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)s1 531696082 HJPUMEUUGZNTRU-RISCZKNCSA-N 304.846 5.075 30 20 DKED Cc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1-c1ccccc1 600853882 XPXRQTBWRZBZGP-QGZVFWFLSA-N 312.416 5.707 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1cc(F)ccc1F 609825853 XQILJTBVZOAKDW-NEPJUHHUSA-N 303.377 5.392 30 20 DKED Cc1ccccc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 727263481 DGSTZJQMCIZDSO-VAWYXSNFSA-N 305.402 5.015 30 20 DKED CC(C)(C#N)c1ccccc1CNc1ccc(C(F)F)cc1 901443165 LXVPGINNQBHUHR-UHFFFAOYSA-N 300.352 5.037 30 20 DKED C=CCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 175363120 ROSYACKXUGNBKJ-OAHLLOKOSA-N 312.240 5.013 30 20 DKED C[C@@H](c1ccc(Cl)cc1)N(CCCC(C)(C)C#N)C1CC1 472425402 NAXYYVMSAUWMJP-AWEZNQCLSA-N 304.865 5.195 30 20 DKED CC(C)Oc1ccccc1[C@@H](C)Nc1ccc(C#N)c(Cl)c1 518372072 ARSBDDGWIILJRN-CYBMUJFWSA-N 314.816 5.172 30 20 DKED N#Cc1cccc(C2(NCc3cccc(-c4ccccc4)c3)CC2)c1 518803060 GKZUNRFCTCIYNS-UHFFFAOYSA-N 324.427 5.004 30 20 DKED C=CCCCSc1nnc(-c2ccco2)n1C1CCCCC1 605076337 YZOWMHQIKFKFFW-UHFFFAOYSA-N 317.458 5.102 30 20 DKED O=C(/C=C/c1cccc(Cl)c1)c1cccc(-c2ccncc2)c1 741474302 XBUCECJIQCURLH-BQYQJAHWSA-N 319.791 5.298 30 20 DKED CCCCCCCC(=O)N(Cc1ccsc1)c1cccnc1 799326646 ZFBRTXKUAGKTGU-UHFFFAOYSA-N 316.470 5.037 30 20 DKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1csc2ccccc12 810216965 UCJZVAHJILIJCX-YJYMSZOUSA-N 318.445 5.111 30 20 DKED C=CCC(F)(F)C(=O)Nc1ccc(SC(C)(C)C)cc1C 815239768 VPUVZYCXJWMSKY-UHFFFAOYSA-N 313.413 5.036 30 20 DKED COc1cccc2cc(/C=C/C(=O)c3cc(C)sc3C)oc12 916156023 YBTOAHNGYNIARU-BQYQJAHWSA-N 312.390 5.016 30 20 DKED CCC/C(C)=C/C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 921009673 DLCMJIRJRCYVNB-FYWRMAATSA-N 320.392 5.035 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@@H](C)CC[C@H]1CC 475565849 QRMVDILOYODRQO-DOTOQJQBSA-N 314.473 5.333 30 20 DKED C=C(C)[C@H](N[C@H](C)c1nc(C)sc1C)c1ccc(F)c(F)c1 681401413 RURMOIWJIXQQQD-HWPZZCPQSA-N 322.424 5.006 30 20 DKED C=CCN(C(=O)Nc1ccc(SC(C)(C)C)cc1)C(C)C 726846264 DUYHOAFUWVIUAM-UHFFFAOYSA-N 306.475 5.006 30 20 DKED C=CC[C@@H](C)C(C)=NNc1nc(Cl)c(Cl)cc1Cl 727776815 HQEDBSRSVYDESU-SSDOTTSWSA-N 306.624 5.042 30 20 DKED CC(C)c1ccccc1CNc1ccccc1S[C@@H](C)CC#N 864006418 UVXRGUWCFAHJJZ-INIZCTEOSA-N 324.493 5.816 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCCC1(F)F 935606871 VWCMDVYPCDRXCE-HNNXBMFYSA-N 321.411 5.303 30 20 DKED CN(CCCC(C)(C)C#N)C1c2ccccc2-c2ccccc21 81596790 REWVUBMDQWWLCT-UHFFFAOYSA-N 304.437 5.018 30 20 DKED Cc1cc([C@@H](C)NCc2ccccc2C(C)(C)C#N)c(C)s1 182981999 MFVTVJXIBOUPES-CQSZACIVSA-N 312.482 5.017 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cl)c1 189897438 CAZUTWJKWKXCFT-UHFFFAOYSA-N 313.828 5.444 30 20 DKED CC(C)(C#N)CCCN1CCCC[C@@H]1c1cccc(Cl)c1 444806942 VPNLZRREEQQIMC-QGZVFWFLSA-N 304.865 5.197 30 20 DKED C=CCCC1(C(=O)Nc2ccccc2COC(C)(C)CC)CC1 484080491 XNCMDSZLUGPIJG-UHFFFAOYSA-N 315.457 5.077 30 20 DKED C[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1cccc(C#N)c1 538528556 NQDUVXPJPWCUNT-CYBMUJFWSA-N 319.408 5.170 30 20 DKED CCC(CC)[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cccs1 539498703 QAOWSTHZASCNAM-IFXJQAMLSA-N 312.482 5.448 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(C3CCC3)c2)n1 546678070 HZBPSRISHIWLJU-INIZCTEOSA-N 324.449 5.024 30 20 DKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1F 613114007 QTHUJJWOQKDYNX-SJCJKPOMSA-N 316.807 5.153 30 20 DKED C#Cc1cccc(N(CC)C(=S)Nc2cccc(C(C)C)c2)c1 728448002 YZVQENBPQCQMNS-UHFFFAOYSA-N 322.477 5.015 30 20 DKED C=CC[C@@H](N[C@H](CC)c1ccc(Cl)cc1)c1ccncc1 766022518 WOUHVEVLPQOKSB-QZTJIDSGSA-N 300.833 5.093 30 20 DKED Cc1cc(Cl)cc(C)c1CN[C@@H](CCC#N)c1ccccc1 344833529 XJRMNNVMRQCNTR-IBGZPJMESA-N 312.844 5.092 30 20 DKED CCOc1cccc2cc([C@H](C)Nc3ccc(C#N)cc3F)oc12 506835273 XPNRMIOFAGHGRW-LBPRGKRZSA-N 324.355 5.015 30 20 DKED CC(C)c1ccc(C(=O)[C@@H](C)Sc2ccc(C#N)cc2)cc1 525631627 SIUYIMOGRNZZPI-CQSZACIVSA-N 309.434 5.045 30 20 DKED CC(C)(C)Sc1ccc(NCc2ccc(C#N)cc2F)cc1 772937462 XSAXPKTTWVVAIK-UHFFFAOYSA-N 314.429 5.200 30 20 DKED CC(C)(C)c1ccc(C=NOCc2cccc3cccnc23)cc1 809799762 CEXRHOPYNOMOAM-UHFFFAOYSA-N 318.420 5.083 30 20 DKED C[C@@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)cc1 174121612 JKCROYHVTSAOBA-MRXNPFEDSA-N 320.436 5.191 30 20 DKED N#CCC[C@@H](Nc1cc2ccccc2c(Cl)n1)c1ccccc1 301785703 LRERFGRLRLFOGP-QGZVFWFLSA-N 321.811 5.345 30 20 DKED Cc1oc2ccc(N=C(O)C(C)(C)C3CCOCC3)cc2c1C 330098714 CFYZBYDYSOJPSM-UHFFFAOYSA-N 315.413 5.090 30 20 DKED C=CCC[C@@H](N[C@H](c1ccccc1)c1nccs1)c1ccco1 368608193 MDRGOQXSLHOXIJ-SJLPKXTDSA-N 324.449 5.123 30 20 DKED C[C@@H](NCC1CCC(C#N)CC1)c1cc2cc(Cl)ccc2o1 442867696 MAKDHUZAUCEJKU-IYXRBSQSSA-N 316.832 5.067 30 20 DKED CC(C)(C#N)CCCCNC1(c2ccc(F)cc2F)CCCC1 444689580 OIKYCUFMMVDEDU-UHFFFAOYSA-N 320.427 5.044 30 20 DKED C=C(C)[C@H](NCc1ccc(SC)cc1)c1ccc(F)c(F)c1 479399347 VNQJAXFSUFHDKP-SFHVURJKSA-N 319.420 5.094 30 20 DKED CCC[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 500747993 STCRMLCPTTUCGF-AWEZNQCLSA-N 322.408 5.034 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)CCc1ccccc1 520835875 YJQJBEZXFXGAOT-DLBZAZTESA-N 324.493 5.372 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)cc1OC 530508353 WXLDAPYBJAABGJ-UHFFFAOYSA-N 323.436 5.108 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C)c1ccc(C#N)cc1 540525313 SWGGRRHXRADVFD-BBNYVJOESA-N 324.855 5.260 30 20 DKED C=CCC(CC=C)C(=O)Nc1ccccc1COC(C)(C)CC 544453497 DATJJSZPXFIQEF-UHFFFAOYSA-N 315.457 5.099 30 20 DKED C=CCC[C@H](NCc1ccccc1N1CCCCC1)c1ccco1 552285048 AOPQUVGLKXLJFP-IBGZPJMESA-N 324.468 5.067 30 20 DKED C[C@H]1[C@@H](c2ccccc2)C[C@H]1N[C@H](CCCC#N)c1ccccc1 559861676 CEAFVAWGUBJPGE-GUGJDKNPSA-N 318.464 5.203 30 20 DKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)C1CCCC1 733076201 GPDGPOOZXQCUBT-UHFFFAOYSA-N 306.624 5.020 30 20 DKED C=CC[C@H](N[C@H]1CCCc2ccc(Cl)cc21)c1ccncc1 762477068 SVPRYXADBZLAKI-OALUTQOASA-N 312.844 5.019 30 20 DKED C=CC[C@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccncc1 795795023 LHHHPTYYMBAFFV-PMACEKPBSA-N 306.453 5.101 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H]1CC 191518696 WXFZYOCFXNSWCQ-YJBOKZPZSA-N 314.473 5.191 30 20 DKED O=C1/C(=C\c2ccccc2)CCc2nc(-c3ccccc3)sc21 207731925 KYAXUCMSNALVQS-SSZFMOIBSA-N 317.413 5.023 30 20 DKED CC[C@@H](C)c1nc(-c2cn(CCC#N)c3ccccc23)cs1 345736548 BLMBBEXSMXEIGA-CYBMUJFWSA-N 309.438 5.192 30 20 DKED N#Cc1cccc(CSCc2ccccc2C(F)(F)F)c1 507172385 CETZUWCIOVSEDQ-UHFFFAOYSA-N 307.340 5.010 30 20 DKED CC[C@@H](Nc1ccc2c(cnn2C(C)C)c1)c1ccc(C#N)cc1 618573754 AFTQQJAISZKQHH-LJQANCHMSA-N 318.424 5.052 30 20 DKED Cc1ccc([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)s1 768402875 RGRYBLHJBITHKH-VQSBYGRUSA-N 324.493 5.111 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC(C)(C)C1 191440293 PVSINYBRWXVQHB-UHFFFAOYSA-N 314.473 5.192 30 20 DKED CC[C@@H](Nc1ccc(CC(F)(F)F)cc1)c1ccc(C#N)cc1 447579920 MKZMRVXPSCCVLJ-QGZVFWFLSA-N 318.342 5.226 30 20 DKED N#C[C@@H]1CCC[C@@H](Nc2ccc(SC3CCCC3)cc2)C1 463290606 WOTDNQUOFOEKAF-GDBMZVCRSA-N 300.471 5.216 30 20 DKED Cc1c([C@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)oc2ccccc12 477850769 CTFCLZDZQBVMGG-KBPBESRZSA-N 322.383 5.164 30 20 DKED C=CCC[C@H](NCc1ccc(OCC)c(Cl)c1)c1ccco1 560538493 SEROYKDWGRHVCV-INIZCTEOSA-N 319.832 5.129 30 20 DKED C=CCC[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1ccco1 573143533 PASCDVQSNJPNEG-QWHCGFSZSA-N 307.846 5.279 30 20 DKED Cc1ccc(Oc2ccccc2NC(=O)CCCCCC#N)cc1 588816354 FRRMFKVFHKBSLZ-UHFFFAOYSA-N 322.408 5.200 30 20 DKED CC(C)c1ccc(C(=O)/C=C\c2ccc3ncccc3c2)cc1 916133003 YESMMASEXULFTO-SDQBBNPISA-N 301.389 5.254 30 20 DKED Fc1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 920385760 GXNYBOKAIDFJAG-UHFFFAOYSA-N 317.578 5.232 30 20 DKED CCCCn1c(S[C@H](C)c2ccc(C#N)cc2)nc(C)c1C 303688027 KZJBTWQCXFHYRU-OAHLLOKOSA-N 313.470 5.025 30 20 DKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 329013791 PKQXUAXTKIOIMI-ZTFGCOKTSA-N 314.429 5.489 30 20 DKED CC(C)(C#N)CCN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 540664806 IHWUJQMUFYDUEM-INIZCTEOSA-N 324.390 5.172 30 20 DKED N#CCOc1ccc(Cl)cc1CSc1ccc(Cl)cc1 735231051 NXCXCJOSUWKCPU-UHFFFAOYSA-N 324.232 5.188 30 20 DKED O=C(/C=C\c1ccc(Cl)cc1Cl)c1ccc(F)cc1F 916127567 KGEKXJMDBJXFPO-KXFIGUGUSA-N 313.130 5.168 30 20 DKED Cc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)c(C)c1 390941806 KZQMLNXPFCYFEQ-QGZVFWFLSA-N 308.425 5.159 30 20 DKED N#Cc1ccccc1SCc1csc(C2CCCCC2)n1 439705745 GQHMSFAPQZADBE-UHFFFAOYSA-N 314.479 5.355 30 20 DKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc2ccccc2s1 551806505 NOCUIVZKAUFOJU-CQSZACIVSA-N 318.445 5.113 30 20 DKED CC[C@H](C)Oc1cccc(N[C@@H](C)c2ccc(C#N)c(F)c2)c1 559876888 IVHJJWMGPVFWJZ-KBPBESRZSA-N 312.388 5.048 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1Cl 573858326 FTFZFPQPRCTOEM-KXBFYZLASA-N 312.844 5.426 30 20 DKED CC(C)CCOc1ccc([C@H](C)NCC(C)(C)CCC#N)cc1 576852007 ROKVRTJTGDIVRR-KRWDZBQOSA-N 316.489 5.092 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2c(F)cccc2Cl)s1 809159395 OQJKPSBADCPAAI-FPLPWBNLSA-N 323.820 5.129 30 20 DKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1csc2ccccc12 810216964 UCJZVAHJILIJCX-ORAYPTAESA-N 318.445 5.111 30 20 DKED O=C(/C=C/c1ccc(Cl)c(Cl)c1)c1cc(F)ccc1F 83192810 MKWSLCMQYGKXLM-QHHAFSJGSA-N 313.130 5.168 30 20 DKED CC[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1 447528944 IXSSLGFVBGGQAK-RTWAWAEBSA-N 322.427 5.279 30 20 DKED CSc1cccc(C)c1NCc1ccccc1C(C)(C)C#N 471973010 LXPUZOZQKSTGSQ-UHFFFAOYSA-N 310.466 5.130 30 20 DKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1 505028248 APQQKRAKQCOUQB-FQEVSTJZSA-N 320.436 5.174 30 20 DKED C[C@H](N[C@@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1F 512280239 OGGNMBTUNHANCK-BTYIYWSLSA-N 322.427 5.279 30 20 DKED CCC(CC)[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccs1 574946076 OKRQOBKPQYWBSP-QUCCMNQESA-N 324.493 5.374 30 20 DKED CC(C)CC[C@H](NC(=O)CCCCC#N)c1ccc(Cl)cc1 593964039 DARJYVDWCMYJIV-KRWDZBQOSA-N 320.864 5.017 30 20 DKED Cc1ncccc1/C=C/C(=O)c1ccc(SC2CCCC2)cc1 728786213 VHWNOJYVLWKWOY-JLHYYAGUSA-N 323.461 5.321 30 20 DKED CC1(C)CCC(=CC(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 817318457 ALULCCKUWUCION-IBGZPJMESA-N 324.468 5.064 30 20 DKED Cc1c(NN=C2CCC[C@H](C(C)(C)C)CC2)cccc1C(=O)O 1776087518 HVSXGTBUVHRGCX-AWEZNQCLSA-N 316.445 5.088 30 20 DKED C[C@H](N[C@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 127688387 RQRNZBVHOQENKF-NHYWBVRUSA-N 316.857 5.001 30 20 DKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1C)c1ccccc1 156541813 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313.466 5.194 30 20 DKED N#Cc1ccnc(S[C@@H](Cc2ccccc2)c2ccccc2)c1 496498459 SHTLFMZIWQYNQB-IBGZPJMESA-N 316.429 5.029 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(Cl)c1 512621517 YWHQPUMWTNUFFW-SGTLLEGYSA-N 316.807 5.153 30 20 DKED C[C@@H](S[C@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1 522962111 XAICEMQQMAMIJA-VXGBXAGGSA-N 303.377 5.392 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccccc1 559863024 NCWXECGQORJKSF-KDXIVRHGSA-N 318.464 5.203 30 20 DKED O=C(/C=C/c1cccc(F)c1F)c1cc(Cl)sc1Cl 730729124 DVWAWIWCZBFQOQ-SNAWJCMRSA-N 319.159 5.229 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(OCCCC)cc1)c1ccncc1 793539196 FBBCHPWCQJVECW-DYESRHJHSA-N 324.468 5.229 30 20 DKED CC(C)Oc1ccc(N[C@H](C)c2cccc(C#N)c2)c(Cl)c1 864009895 AVMNDKGAMAKHAK-CYBMUJFWSA-N 314.816 5.172 30 20 DKED COc1cc(/C=C/C(=O)c2cc3ccccc3o2)ccc1SC 63866798 DZAMJIJQKBHKDY-VQHVLOKHSA-N 324.401 5.059 30 20 DKED C=CCCCN(C)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 303754321 GCHNGJHYYSMPIV-UHFFFAOYSA-N 319.857 5.107 30 20 DKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)ccc1Cl 353918626 ZGLQDTAUWSKRPR-LJQANCHMSA-N 312.844 5.173 30 20 DKED CCC(CC)n1ccc(CS[C@H](C)c2cccc(C#N)c2)n1 443130544 JBYJHNLFRFEFDK-CQSZACIVSA-N 313.470 5.110 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1sccc1C)c1ccc(F)c(F)c1 480659198 CVNHPDCDJQTTOG-BLLLJJGKSA-N 307.409 5.303 30 20 DKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 784821241 NWHMLMHMMARINR-RDJZCZTQSA-N 308.425 5.018 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1cc(C)cc(C)c1 799902232 UHWRPJMZCWUSPW-UHFFFAOYSA-N 310.466 5.231 30 20 DKED CC(C)(C#N)CCCN(Cc1ccccc1)Cc1ccccc1 303859591 MFBLMLZJVSCEFI-UHFFFAOYSA-N 306.453 5.019 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(-c2ccccc2)c(C)c1 460267984 NVVKIBVXJLCFLV-UHFFFAOYSA-N 308.425 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1CC 475578156 MMUPHGJMFFUXTC-NVXWUHKLSA-N 314.473 5.191 30 20 DKED C[C@H](N[C@H](c1cccc(F)c1)C1CCCC1)c1cccc(C#N)c1 538393155 HJXJATIGQQMPJD-BTYIYWSLSA-N 322.427 5.279 30 20 DKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 727952515 JVETUBVXEWMUBQ-SJLPKXTDSA-N 322.452 5.408 30 20 DKED O=C(/C=C/c1ccc(F)c(F)c1)c1cc(Cl)sc1Cl 744866746 XNTMYUHAXPHMNU-DUXPYHPUSA-N 319.159 5.229 30 20 DKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(Cl)s1 788098935 PBWWJEMXFKUQAA-ONEGZZNKSA-N 321.810 5.014 30 20 DKED C=CCC(CC=C)c1nc(-c2ccsc2C(F)(F)F)no1 904923161 PJEDJZZUKLBSHG-UHFFFAOYSA-N 314.332 5.053 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)s1 917043102 GTJQIFCVAUYQTL-HJWRWDBZSA-N 311.431 5.076 30 20 DKED CSCc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 922145119 MCJSHDSZYDEROX-HXUWFJFHSA-N 324.493 5.074 30 20 DKED Cc1ccc(C(F)(F)F)cc1N[C@@H](C)c1cccc(C#N)c1 317026197 UMDAUNIGDZOIKE-LBPRGKRZSA-N 304.315 5.059 30 20 DKED Cc1cc(C)c(CN[C@@H](CCCC#N)c2ccccc2)c(C)c1 433014119 QWUUNYBPLXMYDZ-NRFANRHFSA-N 306.453 5.137 30 20 DKED C=CCCCC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 479602700 YCPJDDRARSALRX-QGZVFWFLSA-N 305.849 5.140 30 20 DKED Cc1ccc(Oc2ccc(NC(=O)CCCCCC#N)cc2)cc1 588147354 WBRIBLVUMDMUOZ-UHFFFAOYSA-N 322.408 5.200 30 20 DKED C=CCC[C@@H](NCc1ccccc1CC(F)(F)F)c1ccco1 624307584 OFBOKKAMIBKYTH-MRXNPFEDSA-N 323.358 5.182 30 20 DKED CCCCCC(C)(C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568292 POKYHSACZBSCML-CYBMUJFWSA-N 320.502 5.223 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1Cl 90665433 XHURBAOTQHWREO-UGSOOPFHSA-N 316.807 5.175 30 20 DKED C[C@@H](Nc1cccc(Oc2ccccc2)c1)c1ccc(C#N)cc1 324370798 JMISMXVCGWUZRR-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C=CCC[C@@H](N[C@H]1CCCc2ccc(O)cc21)c1ccccc1 340523256 CDHMPBOJKGCIKC-RTWAWAEBSA-N 307.437 5.067 30 20 DKED CC(C)(C#N)CCCCSCc1ncc(Cl)cc1Cl 435883740 ATCZNSLRFGBQLY-UHFFFAOYSA-N 317.285 5.342 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](C)CC 475550561 ONWVCQZFXNPYDJ-LSDHHAIUSA-N 302.462 5.095 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC(C)(C)C1 476090776 MCDNYJQXPOUNAY-QGZVFWFLSA-N 313.485 5.693 30 20 DKED C[C@@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1ccc(C#N)cc1 531951504 OHGFTKGNKNOZEJ-HZPDHXFCSA-N 316.404 5.230 30 20 DKED CCC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(F)cc1F 538396210 WQVWKFQVZHZDRJ-BFUOFWGJSA-N 314.379 5.028 30 20 DKED C[C@@H](N[C@H](C#N)c1ccc(Cl)cc1)c1c(F)cccc1Cl 585719316 NULGHPLVZIZSDR-MEBBXXQBSA-N 323.198 5.048 30 20 DKED C=C(C)COc1cccc(NC(=O)c2sccc2C(C)C)c1 589383655 CAEJYVPPZKVJHX-UHFFFAOYSA-N 315.438 5.079 30 20 DKED C=CCC[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccccc1 594954799 JSTSLAASDAWGLQ-NRFANRHFSA-N 316.448 5.039 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccccc1CC 732624452 AHDDWCOJEIEWGQ-UHFFFAOYSA-N 316.514 5.014 30 20 DKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747197641 LBHNWSLYHDRYKP-UONOGXRCSA-N 306.475 5.049 30 20 DKED CCc1c(C(=O)/C=C\c2nc(Cl)cs2)oc2ccccc12 759075627 MAQADLHXQMVRJU-FPLPWBNLSA-N 317.797 5.001 30 20 DKED N#Cc1csc(/C=C2\CCc3c(sc4ccccc34)C2=O)c1 763099855 GCAHTRHAPUBBJO-XYOKQWHBSA-N 321.426 5.047 30 20 DKED N#CCc1ccc(NCc2ccc(-c3ccc(Cl)cc3)o2)cc1 237810011 GJCXDZGYSDZYQO-UHFFFAOYSA-N 322.795 5.278 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 340448044 IRMJZYQJTAISGS-LIRRHRJNSA-N 314.379 5.051 30 20 DKED CC[C@@H](N[C@H](CC)c1ccc(Cl)s1)c1ccc(C#N)cc1 447526013 BSRSNJWATAMUPI-HUUCEWRRSA-N 318.873 5.465 30 20 DKED C[C@@H](CC(C)(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 476519377 NDGMAXKJZAUQCF-UONOGXRCSA-N 318.486 5.092 30 20 DKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cc2ccccc2s1 512668845 WVUXABQPJCWRHO-CHWSQXEVSA-N 324.424 5.324 30 20 DKED C/C(=C\c1cccc(C(F)(F)F)c1)CNCC(C)(C)CCC#N 515400317 IJMSDLKBBKUYHV-GXDHUFHOSA-N 324.390 5.028 30 20 DKED Cc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1C 516199290 XLYYEUSPRWJUDT-RXVVDRJESA-N 306.453 5.389 30 20 DKED C[C@@H](N[C@H](C)c1ccoc1)c1ccc(-c2cccc(C#N)c2)cc1 541175359 IUKMMXKFUOQDCY-HZPDHXFCSA-N 316.404 5.230 30 20 DKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 574027227 HLSMESWSOVEXQU-ABAIWWIYSA-N 316.857 5.001 30 20 DKED CCCC[C@H](CC)CC(=O)Nc1ccccc1SCCC#N 609754820 IAVQSEXODVOMPB-HNNXBMFYSA-N 318.486 5.237 30 20 DKED CC(C)(C#N)CCCOc1ccccc1SC(F)(F)F 755277189 NQVQHKKGLKYQPS-UHFFFAOYSA-N 303.349 5.007 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C#N)c1 903000640 LXJUOBHZHODRCO-LEWJYISDSA-N 317.436 5.034 30 20 DKED CCc1ccc(C=NOCc2c(Cl)ccc3cccnc23)cc1 917395223 GLXGLZHDDAZHLM-UHFFFAOYSA-N 324.811 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)ccc1F 189911554 GLCUTKSYEJKLIP-UHFFFAOYSA-N 311.400 5.238 30 20 DKED C(=NN=C1c2ccccc2-c2ccccc21)c1c[nH]c2ccccc12 254352789 YKJRZTJCVQULNJ-UHFFFAOYSA-N 321.383 5.020 30 20 DKED N#CCCC[C@@H](NCc1cccc(F)c1Cl)c1ccccc1 339240031 YPFWPIDMECHMLX-QGZVFWFLSA-N 316.807 5.004 30 20 DKED CSc1ccccc1[C@H](C)NCc1ccccc1C(C)(C)C#N 440626197 NMDNCKZGJPNYTB-HNNXBMFYSA-N 324.493 5.060 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@H](C)CC 475561253 LJNUNYIHCWAOBP-MRXNPFEDSA-N 316.489 5.438 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCCCc1ccccc1 484765645 FTXWICXDVICFBA-INIZCTEOSA-N 310.466 5.126 30 20 DKED CCC/C(C)=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 920322882 BZABHIBBFLJUOE-SCOADAFUSA-N 324.449 5.041 30 20 DKED C=CCC[C@H](NCc1ccc2ccccc2n1)c1ccccc1 158838951 WYRLLQCENJYBOO-FQEVSTJZSA-N 302.421 5.032 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)cccc1C 189873383 YVAADNBZLJJZNU-UHFFFAOYSA-N 321.464 5.337 30 20 DKED C=CCC[C@H](N[C@H](c1ccccc1)c1nccs1)c1ccco1 368608192 MDRGOQXSLHOXIJ-FUHWJXTLSA-N 324.449 5.123 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc2cccc(C)c2o1 410361422 AFITWJCRQYACMR-UHFFFAOYSA-N 305.377 5.112 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)CCCC(C)(C)C#N 475729064 MKMCXHNROJCKMK-CABCVRRESA-N 306.881 5.094 30 20 DKED C=C(C)[C@@H](NCc1cc(C)sc1C)c1ccc(F)c(F)c1 479405099 CHFMCXBPYIYAGG-QGZVFWFLSA-N 307.409 5.050 30 20 DKED C[C@@H]1CCC[C@@H](CCSCCCC2(C#N)CCOCC2)C1 508588662 NTXNEATVYPWIMX-SJORKVTESA-N 309.519 5.037 30 20 DKED CN(Cc1ccccc1)c1ccccc1NCCCC(C)(C)C#N 532042948 VVTYQFYANYXYIP-UHFFFAOYSA-N 321.468 5.065 30 20 DKED C=CCC(C)(C)C(=O)Nc1cccc(CSC(C)C)c1C 556339553 GTLNGADRRUHNQG-UHFFFAOYSA-N 305.487 5.177 30 20 DKED CC(C)Sc1cccc(Cl)c1C=NNc1ccccc1 786035417 CKWDZWVLIYUSRF-UHFFFAOYSA-N 304.846 5.287 30 20 DKED O=C(/C=C\c1cc(Cl)cs1)c1c(F)cccc1Cl 809158889 FLRBECRTIVOMPH-PLNGDYQASA-N 301.169 5.090 30 20 DKED N#Cc1ccc(F)c(CSc2cccc(C(F)(F)F)c2)c1 912695071 BEJUORQZJHCLKI-UHFFFAOYSA-N 311.303 5.008 30 20 DKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)o1)c1ccccc1F 916136444 OUWYVPLXPYKRCI-PKNBQFBNSA-N 310.299 5.121 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cccc(CC#N)c1 42195070 YZYWUIAOMZGWHH-UHFFFAOYSA-N 320.436 5.252 30 20 DKED C=CCC[C@@H](NCc1cc2c(F)cccc2[nH]1)c1ccccc1 436282636 HWYBPFXKJKOZAZ-LJQANCHMSA-N 308.400 5.104 30 20 DKED N#Cc1c(Cl)cccc1SCc1cnc2ccccc2c1 540809020 NABCUACUVDOTDR-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1ccc(-c2cccs2)cc1 558236768 ZPPYQZLVZOPQCS-HNNXBMFYSA-N 312.482 5.396 30 20 DKED CCCCCCCCCCn1cc(C#N)c(=O)c2ccccc21 728704243 AGLDLYWOPBNVKH-UHFFFAOYSA-N 310.441 5.014 30 20 DKED N#Cc1ccc(/C=C(\Cl)c2nc3ccccc3s2)c(F)c1 772797272 NLAPWXXLTKVQKU-WQLSENKSSA-N 314.772 5.044 30 20 DKED CC(CCC(F)(F)F)=NNc1ccnc2cc(Cl)ccc12 783783482 LNGDZCVJRVNAQT-UHFFFAOYSA-N 315.726 5.019 30 20 DKED CC(C)(C)c1ccc(-c2ccc(CNCCCCC#N)o2)cc1 439475301 OOKHXIHWJHXRPQ-UHFFFAOYSA-N 310.441 5.028 30 20 DKED C=CCCCN(C)[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 477763593 WBALNYQOBCEJGN-AWEZNQCLSA-N 318.848 5.262 30 20 DKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CC(C)(C)CCC#N 507668538 JBFBQCZRKDYJRW-LBPRGKRZSA-N 313.272 5.316 30 20 DKED N#Cc1cccc(CSCc2c(Cl)ccc3cccnc23)c1 517177886 KTIQTDLHQLDLDW-UHFFFAOYSA-N 324.836 5.193 30 20 DKED CCc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 550828963 QDNXAZHFHATPHV-UTKZUKDTSA-N 306.453 5.335 30 20 DKED O=C1/C(=C\c2ccc(Cl)c(C(F)(F)F)c2)Cc2ccccc21 727264106 MWLXDUUEJHZINX-GHXNOFRVSA-N 322.713 5.181 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2ncc(-c3ccccc3)s2)c1 770574370 LAROWUKTSTZUDP-KTKRTIGZSA-N 323.392 5.154 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(OCCCC)cc1)c1ccncc1 793539198 FBBCHPWCQJVECW-UTKZUKDTSA-N 324.468 5.229 30 20 DKED CCCCCCCCC(=O)N(Cc1ccc(C#N)cc1)C(C)C 914501522 KHIYQSSRQOQUBN-UHFFFAOYSA-N 314.473 5.046 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC 340441696 DFSSQVSAKGNQEQ-PMACEKPBSA-N 322.452 5.171 30 20 DKED C=CCCC[C@H](C)NC(=O)Nc1cccc(C(F)F)c1Cl 544629976 CGWREPWTPBNMNO-JTQLQIEISA-N 316.779 5.144 30 20 DKED CC(C)(C#N)CCN1CCCC[C@H]1c1cccc(C(F)(F)F)c1 545267919 KHPZCKYWULENQW-INIZCTEOSA-N 324.390 5.172 30 20 DKED C[C@H](CC#N)Sc1ccccc1NC[C@@H]1CCCCC1(F)F 594704306 ADVBMCYUWAOXJV-KGLIPLIRSA-N 324.440 5.318 30 20 DKED O=C(/C=C/c1ccccc1F)c1ccc(SC(F)F)cc1 734980431 KJTQGMWRSFYFGG-JXMROGBWSA-N 308.324 5.037 30 20 DKED CCc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)s1 745990545 TVNRZGRRWPRTKU-KTKRTIGZSA-N 319.429 5.269 30 20 DKED CC(C)CC[C@@H]1CCCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776033548 YAIINZXZMGOWDB-LBPRGKRZSA-N 322.836 5.042 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc2[nH]ccc12 188060973 WHSDOVXCMSNYKH-UHFFFAOYSA-N 318.420 5.272 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccccc1 189896442 RLGFYARIUABVJL-MRXNPFEDSA-N 307.437 5.281 30 20 DKED CCCCn1c(S[C@@H](C)c2ccc(C#N)cc2)nc(C)c1C 303688025 KZJBTWQCXFHYRU-HNNXBMFYSA-N 313.470 5.025 30 20 DKED C=CCCc1ccccc1NC(=O)Cc1csc2ccccc12 410375741 QCCDVIHVBYKABV-UHFFFAOYSA-N 321.445 5.201 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)CC(F)F 457744367 KGAGEEDDKBGEET-CYBMUJFWSA-N 309.400 5.158 30 20 DKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 505028882 JPFRZXFJDYMHMQ-UZLBHIALSA-N 320.436 5.030 30 20 DKED CCC(CC)[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 534169819 WFWBCFXVNFXXOU-KGLIPLIRSA-N 318.486 5.092 30 20 DKED N#Cc1ccc2c(c1)[C@@H](N[C@H](CC1CCC1)c1ccccc1)CC2 564433754 VYGYIXOAIDJVMT-FCHUYYIVSA-N 316.448 5.067 30 20 DKED C[C@@H](SCc1ccccc1C#N)c1ccc(OC(F)F)cc1 604435807 ZQDSSAMSNAPPGX-GFCCVEGCSA-N 319.376 5.154 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 784821242 NWHMLMHMMARINR-WBVHZDCISA-N 308.425 5.018 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)c2ccccc12 462465508 FBKCUFAWOUYAFK-AWEZNQCLSA-N 320.823 5.216 30 20 DKED C/C(=C/c1cccc(C(F)(F)F)c1)CNCC(C)(C)CCC#N 515400318 IJMSDLKBBKUYHV-UVTDQMKNSA-N 324.390 5.028 30 20 DKED N#Cc1ccc(CNC2(c3ccc(Cl)cc3)CCCCC2)cc1 518784524 IEFLQRIQOMUEMT-UHFFFAOYSA-N 324.855 5.161 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCCCc1ccsc1 541169087 AHKWCUNIDDLOEZ-AWEZNQCLSA-N 316.495 5.187 30 20 DKED CC(C)(CCC#N)CN[C@H]1CCCc2c1sc1ccccc21 558239737 YOSKNKMATQWAQL-INIZCTEOSA-N 312.482 5.198 30 20 DKED CCCCCCCC(=O)Nc1ccccc1S[C@@H](C)CC#N 731333395 ZXLHTQUKOGFIKW-HNNXBMFYSA-N 318.486 5.380 30 20 DKED C[C@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1F 781421803 LLQHUDRCKGTGKP-JTQLQIEISA-N 322.355 5.185 30 20 DKED CCCCCCCC[C@@H](C)C(=O)N1CCC[C@@H]1c1cc(C)no1 822163269 GULKDIOIZLHNOJ-NVXWUHKLSA-N 320.477 5.033 30 20 DKED C[C@@H](Nc1ccc(COC2CCCC2)cc1)c1cccc(C#N)c1 182224935 LZWRTARMHZJAGC-MRXNPFEDSA-N 320.436 5.191 30 20 DKED C[C@H](Nc1ccc2oc3ccccc3c2c1)c1cccc(C#N)c1 324273570 ZBEVUNYITZFAKK-AWEZNQCLSA-N 312.372 5.631 30 20 DKED Cc1nc(C2CC2)oc1/C(O)=N/C1(c2ccccc2)CCCCC1 329768152 DMIOWYPAZOKOOB-UHFFFAOYSA-N 324.424 5.025 30 20 DKED CC[C@@H](N[C@H](c1ccc(OC)cc1)C(C)C)c1ccc(C#N)cc1 447513665 YAGRNTFQFIWCSQ-RTWAWAEBSA-N 322.452 5.005 30 20 DKED CC1(C#N)CCC(N[C@@H](Cc2ccccc2)c2cccs2)CC1 449139558 LGZLNVPEOQJWDV-FDYSRKEFSA-N 324.493 5.094 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)s1 512642385 PDNTYDMNFCNRFX-HZMBPMFUSA-N 322.836 5.214 30 20 DKED N#Cc1cccc(CSCc2cc(Cl)cc3cccnc23)c1 517178403 ZIUPLHJDPFTHQJ-UHFFFAOYSA-N 324.836 5.193 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cnc2ccsc2c1)c1ccccc1 536831052 GGZJAAWWNDSJDG-YJBOKZPZSA-N 322.477 5.654 30 20 DKED CSc1ccccc1NC1CCC(C#N)(c2ccccc2)CC1 538825236 YHYWPOXTBWEPQF-UHFFFAOYSA-N 322.477 5.225 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2cccc3ccccc23)s1 736430686 DUWORAKBCRDKHQ-VAWYXSNFSA-N 321.445 5.490 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](C)C2CCCCC2)n1 747196159 HEZQJGNAMJTBRV-ZFWWWQNUSA-N 318.486 5.049 30 20 DKED CCCC[C@@H](CC)CC(CC)=NNc1cccc(C(=O)O)c1C 1776089833 IRLHBINGFBPZDB-OAHLLOKOSA-N 318.461 5.478 30 20 DKED CC(C)(C#N)CCCOc1cc(C(F)(F)F)ccc1Cl 476456656 GVIRHGHROXENAK-UHFFFAOYSA-N 305.727 5.068 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc(C)cc1Cl 485758750 WUZAIYHTVZXBBI-UHFFFAOYSA-N 317.841 5.179 30 20 DKED C=CCC[C@H](N[C@H]1CCSc2c(F)cccc21)c1ccco1 513692071 YEMFQHPTJSOZDV-HOTGVXAUSA-N 317.429 5.253 30 20 DKED CC(C)(C)c1ccc(CN[C@@H](CCC#N)c2ccccc2)s1 533497634 MIBOVLSYEKPONS-KRWDZBQOSA-N 312.482 5.180 30 20 DKED C[C@H](N[C@@H](C)c1ccoc1)c1ccc(-c2cccc(C#N)c2)cc1 541175358 IUKMMXKFUOQDCY-HOTGVXAUSA-N 316.404 5.230 30 20 DKED CC[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(Cl)c1 594925190 MKPAXRZAFOVQRK-IBGZPJMESA-N 324.855 5.136 30 20 DKED N#Cc1ccccc1-c1ccc(CSCc2ccccn2)cc1 611470362 KVFZTGXSJUTTCV-UHFFFAOYSA-N 316.429 5.054 30 20 DKED Cc1cc2c(cc1C)[C@@H](N[C@H](C)c1cccc(C#N)c1)CCS2 614633862 JECXHNGSPQVNFI-BEFAXECRSA-N 322.477 5.063 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(C)C)cc1 642393766 BKHCMDXJRPICFS-UHFFFAOYSA-N 314.454 5.092 30 20 DKED C=C(C)[C@@H](NCc1cscc1Cl)c1ccc(F)c(F)c1 681375324 RLMIXJXUGQMAGO-OAHLLOKOSA-N 313.800 5.087 30 20 DKED Cc1c(C(=O)/C=C/c2cc(F)c(F)c(F)c2)oc2ccccc12 727975527 ZTQNAEUEFCVJPE-VOTSOKGWSA-N 316.278 5.055 30 20 DKED CC(/C=C/C1=C(C)CCCC1(C)C)=NNc1nccnc1Cl 733079667 PPFOXMRJRRYJBQ-QLGZWBLUSA-N 318.852 5.001 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 746047339 MGOXUVUKOJKITO-CXAGYDPISA-N 320.358 5.068 30 20 DKED CC1(C#N)CCN(Cc2c3ccccc3cc3ccccc23)CC1 780782276 OLUGWQHWMSNCME-UHFFFAOYSA-N 314.432 5.119 30 20 DKED CC1(C)CCCC[C@H]1CC(=O)[C@H](C#N)c1nccc2ccccc12 792108101 XPPBFVCRUQHDTA-WMZOPIPTSA-N 320.436 5.018 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567523 JOWHJRRYRQPXIA-ZIAGYGMSSA-N 320.502 5.223 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccc2c(c1)CCC2 799900868 QZDNTGCZWXGTLY-UHFFFAOYSA-N 322.477 5.103 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc3ccccc23)cc1[N+](=O)[O-] 810198305 PBJMSBOWCCVISD-HJWRWDBZSA-N 323.373 5.014 30 20 DKED CCCCCCC[C@H](N[C@H]1CCn2ccnc21)c1ccccc1 834835949 JYYOUKFMTCJHGO-OALUTQOASA-N 311.473 5.019 30 20 DKED C=CCN(C(=O)Nc1ccc(Oc2ccc(C)cc2)cc1)C(C)C 916707690 SMURAAICQGIGIS-UHFFFAOYSA-N 324.424 5.216 30 20 DKED CCCOc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 181574135 FTGBZRYQHLKTJH-UTKZUKDTSA-N 322.452 5.171 30 20 DKED N#CCCC[C@H](NCc1csc2ccccc12)c1ccccc1 353916516 QKKOFXZXMDEJLF-IBGZPJMESA-N 320.461 5.426 30 20 DKED CCc1ccc(CCNc2ccccc2SC[C@@H](C)C#N)cc1 462236787 MEBXINFEVWIESE-INIZCTEOSA-N 324.493 5.155 30 20 DKED CC(C)(C#N)CCCSc1nc(-c2ccccc2)ccc1C#N 476484119 RGWDVXLYIGHHAL-UHFFFAOYSA-N 321.449 5.042 30 20 DKED CCC(CC)[C@H](NCc1cccc(C#N)c1F)c1cccs1 539279208 AYXXQFWGJHARKW-SFHVURJKSA-N 316.445 5.026 30 20 DKED CSc1ccc([C@H](C)Nc2ccc3cc(C#N)ccc3n2)cc1 543781449 SAWDVZDKKIIFKN-ZDUSSCGKSA-N 319.433 5.001 30 20 DKED CC(C)C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccs1 561139589 DXFPTKPCURMCDJ-RTBURBONSA-N 324.493 5.374 30 20 DKED C=C(CN[C@H](C)[C@H](C)c1nc2ccccc2s1)c1ccccc1 675783603 MBOAAGDVPGMTIF-JKSUJKDBSA-N 322.477 5.091 30 20 DKED COc1ccc2cc(/C=C/C(=O)c3sccc3C)ccc2c1 733748666 GKXZIOHFVDSHSN-XBXARRHUSA-N 308.402 5.114 30 20 DKED CCC[C@@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748618327 HFSMZWGJJKJTET-UZLBHIALSA-N 320.436 5.107 30 20 DKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 784821239 NWHMLMHMMARINR-DOTOQJQBSA-N 308.425 5.018 30 20 DKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1F 108407645 VEZOSUIYWJIDGL-ZIAGYGMSSA-N 314.429 5.251 30 20 DKED C[C@@H]1CC[C@@H](N[C@@H](CCC#N)c2ccccc2)c2sccc21 453183373 YDJUZEHRCAWJEI-FHLIZLRMSA-N 310.466 5.321 30 20 DKED C[C@@H](N[C@@H](c1cccc(F)c1)C1CCCC1)c1ccc(C#N)cc1 540593398 IAIXAZORSMNAMR-QVKFZJNVSA-N 322.427 5.279 30 20 DKED Cc1cccc2c1[C@H](C)C[C@H]2N[C@H](CCCC#N)c1ccccc1 581375553 LXYSNVSCQRQWRA-DUXKGJEZSA-N 318.464 5.568 30 20 DKED Cc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1-c1ccccc1 600853881 XPXRQTBWRZBZGP-KRWDZBQOSA-N 312.416 5.707 30 20 DKED C=CCCCCCN(C)Cc1csc(-c2cccs2)n1 606902287 VOOYFHYFUGTIBY-UHFFFAOYSA-N 306.500 5.050 30 20 DKED C=CCC[C@H](Nc1ccc(OC)c(SC)c1)c1ccco1 840774725 QGZMVPQWGIGNBM-AWEZNQCLSA-N 303.427 5.130 30 20 DKED Cc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)c(C)c1 390941805 KZQMLNXPFCYFEQ-KRWDZBQOSA-N 308.425 5.159 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(Cl)c1 487404731 YKFRVYLFDKSTBN-ZDUSSCGKSA-N 316.857 5.204 30 20 DKED CC(=C/c1ccccc1C(F)(F)F)/C=C/c1ccncc1C#N 504720040 GTRWELQFJZMYLH-OZGSBZGKSA-N 314.310 5.089 30 20 DKED Cc1ccccc1[C@H](N[C@H](C)c1cccc(C#N)c1)C(C)(C)C 540592176 UEFZTYROKPPWQG-UZLBHIALSA-N 306.453 5.305 30 20 DKED Cc1ccccc1[C@@H](C)N(CC(C)C)C(=O)CCCCCC#N 588990247 NOHDSVQDKCPWKY-GOSISDBHSA-N 314.473 5.015 30 20 DKED N#Cc1cc(F)ccc1CSc1cccc(C(F)(F)F)c1 728441642 NKZDSTQPBRJLEA-UHFFFAOYSA-N 311.303 5.008 30 20 DKED N#Cc1cc(/C=C(/Cl)c2nc3ccccc3s2)ccc1F 756263066 UUFFQCUDPUAETM-XYOKQWHBSA-N 314.772 5.044 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)CC[C@@H]1C 191462093 LKCOWRHUZPPTQA-CVEARBPZSA-N 314.473 5.191 30 20 DKED CC(C)(c1ccc(NCc2cccc(C#N)c2)cc1)C(F)(F)F 428578983 ZOFGJMXJDLPGAX-UHFFFAOYSA-N 318.342 5.010 30 20 DKED N#CC1CCC(CN[C@@H]2CCCc3c2sc2ccccc32)CC1 442848183 AABKGPNOTKJCQK-JTTJXQCZSA-N 324.493 5.198 30 20 DKED CC(C)(CCC#N)CN[C@H](Cc1ccc(F)cc1)c1ccccc1 554359739 PPOWIRIRCAATNH-HXUWFJFHSA-N 324.443 5.029 30 20 DKED CCC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 610830015 XOUZYUJVPGPNAX-IFXJQAMLSA-N 312.844 5.404 30 20 DKED CC(C)c1ccc(C=NO[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 756847899 LKWZKASWTLJXKC-AWEZNQCLSA-N 314.429 5.207 30 20 DKED C#CCCCCC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 773280669 CUBMQDMJOAGRMN-QGZVFWFLSA-N 319.448 5.085 30 20 DKED CCCCCCCCCC[C@H](C)Nc1ccc(C(=O)O)cn1 1776785305 SDXCYNOAQZSREN-HNNXBMFYSA-N 306.450 5.111 30 20 DKED C=CCOc1ccc(CN[C@H](C)c2cccc3ccccc23)cc1 60833732 DYUJTODEJCISNU-QGZVFWFLSA-N 317.432 5.255 30 20 DKED CC(C)c1nc(CS[C@H](C)c2cccc(C#N)c2)cs1 443162777 UDUOOWVCDXGCID-GFCCVEGCSA-N 302.468 5.133 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc21 447539382 ADOABYMEPJYDPZ-IWMITWMQSA-N 304.437 5.093 30 20 DKED O=C(/C=C\c1ccccc1F)c1cc(Cl)sc1Cl 744869000 QAGCNIVDCZKLBU-WAYWQWQTSA-N 301.169 5.090 30 20 DKED C=CC[C@@H](N[C@@H](CC)c1cccc(Cl)c1)c1ccncc1 746048274 ZVZWYMVIAUZQQA-ZWKOTPCHSA-N 300.833 5.093 30 20 DKED CC[C@@H](N[C@@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 774170503 FIZGQUIIMVRDOL-IFXJQAMLSA-N 320.461 5.575 30 20 DKED CC[C@H](N[C@@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 774170505 FIZGQUIIMVRDOL-LIRRHRJNSA-N 320.461 5.575 30 20 DKED CCCCCCCC(=O)N1CCCCC[C@@H]1c1ccc(C)o1 303749205 LBKMMQHWMMFMHB-QGZVFWFLSA-N 305.462 5.392 30 20 DKED N#CCCC[C@H](N[C@H]1CCSc2ccccc21)c1ccccc1 340428910 CCRFRKVAAORIPZ-OALUTQOASA-N 322.477 5.248 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1cccc(C#N)c1)CC2 427854783 BNHXDXNWTOECBD-YCRPNKLZSA-N 304.437 5.020 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 538393281 LBLLLRUOPCJHHK-HZPDHXFCSA-N 324.493 5.471 30 20 DKED Cc1ccccc1C(=O)/C=C/c1csc(-c2ccc(F)cc2)n1 797111753 WNKBHPCMZJKOES-ZHACJKMWSA-N 323.392 5.154 30 20 DKED CC(C)Oc1cccc(/C=C/C(=O)c2ccccc2Cl)c1 921261899 WLHXEBYPMDVYEH-ZHACJKMWSA-N 300.785 5.023 30 20 DKED C=CCC(C)(C)CNC(=O)N(c1ccccc1)c1ccccc1 432292517 WDOMYRAEJNVRKT-UHFFFAOYSA-N 308.425 5.137 30 20 DKED C=CCCCC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 481135805 HNCKJMJEFZPMLE-UHFFFAOYSA-N 319.326 5.066 30 20 DKED Cc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 521280924 HDSWHWTYOACEMF-RXVVDRJESA-N 306.453 5.389 30 20 DKED Cc1ccc2c(c1)C/C(=C/c1csc(-c3cccs3)n1)C2=O 728440164 KUBMOUJSNIMDMV-LCYFTJDESA-N 323.442 5.002 30 20 DKED C=CC[C@H](N[C@H](CC)c1cccc(Cl)c1F)c1ccncc1 763537389 CTGAAOLNKOMYCM-SJORKVTESA-N 318.823 5.232 30 20 DKED C#CC[C@H](N[C@H](CC)c1ccc(Cl)s1)c1ccccc1 773114664 JMENAINIQTYAMC-CABCVRRESA-N 303.858 5.207 30 20 DKED C=CCOc1ccc(CNc2ccc3occc3c2)cc1Cl 864017376 IAWXMOBJHCQZIN-UHFFFAOYSA-N 313.784 5.263 30 20 DKED N#Cc1ccc(CSc2cccc(C(F)(F)F)c2)c(F)c1 912695077 BKYLEIORVCYVBB-UHFFFAOYSA-N 311.303 5.008 30 20 DKED N#C[C@@H](C(=O)CCCC1CCCCC1)c1ccc2ccccc2n1 916849437 UXTGGLXNCRFDCD-GOSISDBHSA-N 320.436 5.162 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 179235982 JOIABDVERJPUJN-CABCVRRESA-N 310.466 5.082 30 20 DKED CC[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(F)cc1 281995981 WBSGNTGZUPNMOI-QGZVFWFLSA-N 321.461 5.111 30 20 DKED CC(C)COc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 325107328 AXCXPRUHPUORAZ-SJORKVTESA-N 322.452 5.005 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1cc(-c2ccc(C)o2)ccc1C 432991857 LSTDLQBFEQJTLN-KRWDZBQOSA-N 324.424 5.136 30 20 DKED CCCC[C@@H](CC)CC(=O)Nc1ccc(C(C)(C)C#N)cc1 522666945 HZTFPKDTPSOUSW-OAHLLOKOSA-N 300.446 5.033 30 20 DKED C=CCC[C@@H](C(=O)Nc1cc(F)ccc1Cl)c1ccccc1 547952157 WOAQNUSYRPIIHC-OAHLLOKOSA-N 317.791 5.168 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C(CC)CC 573133995 SKCVUOWAKHGHSB-UHFFFAOYSA-N 316.489 5.581 30 20 DKED COc1ccc2[nH]cc(C(=O)/C=C/C(C)=C\c3ccccc3)c2c1 734307632 PZOJJQSGLCWRKG-QUHNVXOFSA-N 317.388 5.019 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(OC)cc1 191513526 GBVZELNCYHHQOY-UHFFFAOYSA-N 324.424 5.191 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1occc1C(C)C 285059326 UPWYQVJKCWARQL-UHFFFAOYSA-N 311.425 5.507 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc2ccccc12 539052191 FSTAOZMUOSWBRJ-VGOFRKELSA-N 314.432 5.535 30 20 DKED CC[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1 579412992 DSZASJNKJFYKSW-LSDHHAIUSA-N 316.857 5.001 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(OC(C)C)cc1)c1ccc(C#N)cc1 584699840 MKUBFCBPGPNBHI-HRAATJIYSA-N 322.452 5.147 30 20 DKED CCSc1ccc(C(=O)/C=C\c2nccc3ccccc23)cc1 755606887 MYIRZIVJSUSUTG-QXMHVHEDSA-N 319.429 5.243 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(C)cc1C 794995102 LCEOBKQIYWORBP-UHFFFAOYSA-N 324.493 5.079 30 20 DKED O=C(/C=C/c1ccc(Cl)s1)c1c(F)cccc1Cl 809159471 PYBVUCLCHINTLN-GQCTYLIASA-N 301.169 5.090 30 20 DKED CC(C)CCOc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1 863995728 FXAFZNKGIYFSSC-MRXNPFEDSA-N 308.425 5.156 30 20 DKED C=CCCC[C@H](NCc1ccc(C(F)F)nc1)c1ccccc1 883325193 RPFQKBYKVPYNAG-KRWDZBQOSA-N 316.395 5.206 30 20 DKED C[C@@H](SCc1cc(F)cc2cccnc12)c1ccc(C#N)cc1 345155329 ULSUIIIFGBXIKL-CYBMUJFWSA-N 322.408 5.240 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(C(C)C)c1 515385396 MRMBHSHORRQBDK-UHFFFAOYSA-N 308.425 5.030 30 20 DKED O=C(/C=C\C1=Cc2ccccc2OC1)c1ccc2ccccc2c1 726741270 DECHQKUCDIMLHE-XFXZXTDPSA-N 312.368 5.055 30 20 DKED FC(F)(F)C1CCC(C=NNc2cccc3ccccc23)CC1 767378775 GGIZDRKTBQCBGB-UHFFFAOYSA-N 320.358 5.606 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nccc2ccccc12 792091614 LUJJAFHJSJMHKI-QAPCUYQASA-N 308.425 5.018 30 20 DKED CCCCCCCCC(=O)[C@@H](C#N)c1nccc2ccccc12 792096738 QMEXLFHYLZOAEK-GOSISDBHSA-N 308.425 5.162 30 20 DKED CCCCCCCC(=O)Nc1ccc(OC)cc1C(F)(F)F 916425303 UFHQHKHQTVGKLI-UHFFFAOYSA-N 317.351 5.013 30 20 DKED Cc1cc(F)ccc1CNc1ccccc1S[C@H](C)CC#N 181848564 GDBBQLAHKSMLCT-CQSZACIVSA-N 314.429 5.141 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccccc1C 189868466 QLPLCEVYGUHZSU-UHFFFAOYSA-N 307.437 5.028 30 20 DKED CC1(C)Cc2occc2[C@H](N[C@H](CCCC#N)c2ccccc2)C1 340450323 XDFQLJIPGFWDOQ-RTBURBONSA-N 322.452 5.318 30 20 DKED CCC(C)(C)OCc1cccc(NCCCC(C)(C)C#N)c1C 531648219 ISSDCKTUHDLREA-UHFFFAOYSA-N 316.489 5.442 30 20 DKED Cc1ccccc1[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)C(C)C 539608285 CFPFEWJDKBESPN-FOIQADDNSA-N 310.416 5.054 30 20 DKED CC(C)[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 565568337 BOBHVZBITFNWSL-VQTJNVASSA-N 324.855 5.186 30 20 DKED Cc1cc(N[C@@H](C)c2cccc(C#N)c2)cc(C(F)(F)F)c1 600853119 WUOOWCXIZZYGND-LBPRGKRZSA-N 304.315 5.059 30 20 DKED N#C[C@H](Cc1ccccc1)Sc1c(Cl)cccc1Cl 603451588 GNCHWFSAYDHMSJ-LBPRGKRZSA-N 308.233 5.220 30 20 DKED O=C(/C=C/c1nccc2ccccc12)c1ccc2c(c1)CCCC2 740765136 QNSCFWIJZCTXOU-VAWYXSNFSA-N 313.400 5.010 30 20 DKED CC(=NNc1nc2ccccc2cc1C)C1CCC(F)(F)CC1 788726568 WGYBHSFLHBBVNC-UHFFFAOYSA-N 317.383 5.157 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1cccc(OC)c1 886552591 KBCMHBMBKBMDKF-IBGZPJMESA-N 317.473 5.109 30 20 DKED C=CCC[C@@H](Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)C1CC1 538628181 MCZQGCWVXVOFTK-QGZVFWFLSA-N 314.473 5.136 30 20 DKED CCc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550828961 QDNXAZHFHATPHV-DYESRHJHSA-N 306.453 5.335 30 20 DKED CCCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 735203179 CHFJKZNATMAATO-AEFFLSMTSA-N 322.452 5.408 30 20 DKED CSc1ccc(C(=O)/C=C/c2ccc(Cl)s2)cc1F 741847651 RJKYJYWVZHYLTG-HWKANZROSA-N 312.818 5.159 30 20 DKED CC(C)(C#N)CCCSc1nc(-c2ccccc2)cs1 747805191 XJJNLMGAHGHQSL-UHFFFAOYSA-N 302.468 5.232 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccncc3)cc2F)s1 751520455 AYFIQABWTQAOJM-AATRIKPKSA-N 323.392 5.154 30 20 DKED CCC(CC)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 759144937 QJVMELRIEVEXOQ-HXUWFJFHSA-N 320.436 5.107 30 20 DKED C#CC[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccccc1 783258402 HVZFNDMSIAGLQU-CRAIPNDOSA-N 305.446 5.317 30 20 DKED CCCCCCCC[C@H](C)C(=O)Nc1ccc(C)cc1C(=O)O 1776786134 PEOFVYVRYYPHIX-HNNXBMFYSA-N 319.445 5.018 30 20 DKED CCSc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 358345847 PKXOJMJPJQWHCT-OXJNMPFZSA-N 324.493 5.494 30 20 DKED C=C(C)[C@@H](N[C@H](C)CCCC(F)(F)F)c1ccc(F)c(F)c1 480669014 NXADLOAJXOAQQM-IAQYHMDHSA-N 321.333 5.293 30 20 DKED CC(C)C[C@@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 520924073 HTDIEEZYBDRLMT-CABCVRRESA-N 318.486 5.092 30 20 DKED CC(C)c1nc2cc(N[C@@H](C)c3ccc(C#N)cc3F)ccc2o1 540976167 IEEQGAOPSCBHIY-LBPRGKRZSA-N 323.371 5.135 30 20 DKED N#Cc1ccccc1-c1ccc(CNc2cccc3cc[nH]c23)cc1 548467427 PHXFNGLLIMTVFX-UHFFFAOYSA-N 323.399 5.319 30 20 DKED Cc1cc(C#N)ccc1CS[C@@H](C)c1nc2ccccc2o1 614394910 YOPYRXMUDBTMQB-ZDUSSCGKSA-N 308.406 5.002 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)o1 727264717 VLWMMWAFJRXHFL-XQRVVYSFSA-N 314.690 5.156 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc2ncccc2c1 742437571 VMVCONHKBJGYAT-KBVGCWLLSA-N 323.442 5.057 30 20 DKED CC(=NNc1ccc(Cl)cc1)c1ccc(-c2ccncc2)cc1 745193246 KSJYIMUWUYMZJK-UHFFFAOYSA-N 321.811 5.238 30 20 DKED CCCCCCCC[C@@H](C)CC(=O)N1CC2(C1)CC(F)(F)C2 775617187 SDWRMIVGXYRBST-OAHLLOKOSA-N 315.448 5.021 30 20 DKED CCc1cccc(Cl)c1C=NNc1ccc(Cl)c(OC)c1 788468339 SUEASRIAHTUZBI-UHFFFAOYSA-N 323.223 5.010 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1coc2ccccc12 925599901 DGLYKXBGXOLXMF-HNAYVOBHSA-N 304.393 5.128 30 20 DKED CC[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 37748882 HRUHKZQPKJAWNU-QGZVFWFLSA-N 319.235 5.106 30 20 DKED Cc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cc1 60370799 VVZWIAGFEQNBJE-VAWYXSNFSA-N 305.402 5.015 30 20 DKED CC(C)Oc1cccc(/C=C/C(=O)c2cc3ccccc3o2)c1 83201443 BVYIKBQJFMEMNP-ZHACJKMWSA-N 306.361 5.116 30 20 DKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 303745932 FXZSJXDTGRWPBH-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340457953 WZOWFEXZRXADTB-KUHUBIRLSA-N 314.379 5.051 30 20 DKED N#CCCC[C@@H](NCc1cc(Cl)ccc1F)c1ccccc1 353915912 OMYLKWNCTMAJEI-GOSISDBHSA-N 316.807 5.004 30 20 DKED Cc1ccc([C@H](Nc2cccc(OCCCC#N)c2)C2CC2)cc1 391873154 LMQCYXUKINIOMG-NRFANRHFSA-N 320.436 5.241 30 20 DKED CSc1ccccc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 417354927 AELAIHCEEAKYJY-AUUYWEPGSA-N 322.477 5.008 30 20 DKED CC[C@@H](C)[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462751733 BFGMYHONWHYJHS-AUUYWEPGSA-N 312.844 5.089 30 20 DKED N#Cc1ccc(CN[C@@H](CC2CCCC2)c2ccccc2)s1 538426254 CNXJYNYBEQNVFE-IBGZPJMESA-N 310.466 5.031 30 20 DKED Cc1cc([C@@H](NCCCC#N)c2cccc(Cl)c2)c(C)s1 571010339 YNNNOXINVYTWOR-KRWDZBQOSA-N 318.873 5.001 30 20 DKED O=C1/C(=C\c2cnc(-c3cccs3)s2)CCc2ccccc21 751513061 NFXSXLXIFBLZTB-RAXLEYEMSA-N 323.442 5.084 30 20 DKED C=CCC[C@H](Nc1ccc(OC(F)F)c(F)c1)c1ccco1 796870762 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Cc1ccsc1/C=C\C(=O)c1nc(-c2ccccc2)cs1 732570734 HHYNDFVPVHAKPW-FPLPWBNLSA-N 311.431 5.076 30 20 DKED FC(F)(F)C1CCC(C=NNc2cccc3ncccc23)CC1 767370615 JZHDYPFXFSCVAO-UHFFFAOYSA-N 321.346 5.001 30 20 DKED CC(CCCC(F)(F)F)=NNc1ccccc1C(F)(F)F 774309419 LDJSWEFFYCJJHK-UHFFFAOYSA-N 312.257 5.226 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C/c1cnc(-c3ccco3)s1)C2=O 789149535 ZJHRBFWSSZPONE-ZENNRRHLSA-N 321.401 5.095 30 20 DKED C=CCN(C(=O)Nc1ccc2c(c1)oc1ccccc12)C(C)C 916708831 LTCFXBFWOALBSD-UHFFFAOYSA-N 308.381 5.014 30 20 DKED Cc1cc(N[C@@H](CCC#N)c2ccccc2)c2cccc(F)c2n1 301788622 MVJIZSLXLWBNRN-SFHVURJKSA-N 319.383 5.139 30 20 DKED N#CCc1ccc(NCc2cc(Cl)cc(C(F)(F)F)c2)cc1 436273338 JSZWLGCMSQOUMZ-UHFFFAOYSA-N 324.733 5.037 30 20 DKED N#CCc1ccccc1NC(=O)c1ccc(C2CCCCC2)cc1 588987533 IXSVFBFIHZALEP-UHFFFAOYSA-N 318.420 5.053 30 20 DKED C=C(C)CN(CC)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 60791577 VYXOAHLNAMPKGA-UHFFFAOYSA-N 319.857 5.107 30 20 DKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2)oc1C 183015100 PMAIWPDHDDUMJX-AWEZNQCLSA-N 317.392 5.003 30 20 DKED C=C(C)[C@H](CC(=O)Nc1c(CCC)cccc1C(C)C)OCC 276288123 HGARBZYYWPFCLJ-SFHVURJKSA-N 317.473 5.072 30 20 DKED CC[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)cc1 439433036 XZIJSZVKOSRELI-QGZVFWFLSA-N 319.235 5.106 30 20 DKED COc1ccccc1[C@H](CC(C)C)NCCCCC(C)(C)C#N 444675937 OSEJJBPXOLBLMG-SFHVURJKSA-N 316.489 5.092 30 20 DKED CC(C)Sc1ccc([C@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 538393283 LBLLLRUOPCJHHK-JKSUJKDBSA-N 324.493 5.471 30 20 DKED O=C(/C=C\c1ccc(F)cc1)c1cc(Cl)sc1Cl 744868703 IPROTUQVANNUCT-UTCJRWHESA-N 301.169 5.090 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](C)C2CCCCC2)n1 747196157 HEZQJGNAMJTBRV-HIFRSBDPSA-N 318.486 5.049 30 20 DKED O=C(/C=C\c1ccc2cnccc2c1)c1cccc2ccccc12 782300547 GRMVSKLXKVFVRH-LUAWRHEFSA-N 309.368 5.284 30 20 DKED N#CCC[C@@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1 130461122 BSZZDVSCALNBMG-QGZVFWFLSA-N 319.235 5.128 30 20 DKED Cc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cc1 303148668 MFLROCGYAOGZAY-VAWYXSNFSA-N 305.402 5.015 30 20 DKED Cc1cc(Cl)ccc1CN[C@H](CCCC#N)c1ccccc1 353916339 QAWIZRNSQGGMMM-LJQANCHMSA-N 312.844 5.173 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@H](C)[C@H]1C 417035372 FYKKECBNHGOUSZ-HRCADAONSA-N 314.473 5.047 30 20 DKED CC(C)(C)[C@H](N[C@H]1CC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1 442852376 XWYPAPNDVHLQMC-UHOFOFEASA-N 324.390 5.074 30 20 DKED Cc1ccc(F)c(CNc2ccccc2S[C@@H](C)CC#N)c1 453076901 AHPAMYFKYQUWGT-AWEZNQCLSA-N 314.429 5.141 30 20 DKED C[C@H](NCCCC#N)c1ccc(-c2ccc(Cl)cc2)s1 544387108 VPVQLDJPRHDEIW-LBPRGKRZSA-N 304.846 5.023 30 20 DKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(C(C)C)cc1 746345467 FVOYFVVAYOEYSF-XFXZXTDPSA-N 310.441 5.100 30 20 DKED C[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)C1CCCCC1 792102922 KAZTYQWVHOUZNI-DNVCBOLYSA-N 320.436 5.018 30 20 DKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)C1CCCCC1 797157989 LGCGRIXZJGMGPM-ZHACJKMWSA-N 315.413 5.112 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C1(C)CC1 191420519 ZVGHEBNECZJJHY-HNNXBMFYSA-N 314.473 5.191 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(SC(C)(C)C)cc1C 303905009 TUNNJKHLDKTEPN-UHFFFAOYSA-N 320.502 5.316 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C[C@H]1CCC[C@H](C)C1 330173552 HMBCGUIUPDELAQ-ZFWWWQNUSA-N 311.429 5.190 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)s1 537407764 ZUJDUJPDIABUGI-QMTHXVAHSA-N 322.836 5.214 30 20 DKED N#CC1CCC(CN[C@@H]2CCCC[C@@H](c3ccccc3)C2)CC1 441377824 GRXAYKYIZYZFGU-OWQMCBFZSA-N 310.485 5.022 30 20 DKED CC(/C=C/c1ccc(C#N)cn1)=C\c1ccccc1C(F)(F)F 443442421 CRMNHQRDHLDVJZ-YXBXOZLWSA-N 314.310 5.089 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(Cl)s1 447526011 BSRSNJWATAMUPI-CABCVRRESA-N 318.873 5.465 30 20 DKED C=CCC[C@@H](C(=O)Nc1cccc(C(F)F)c1)c1ccccc1 488709450 BKSYPXDFTKIWOX-QGZVFWFLSA-N 315.363 5.313 30 20 DKED CC(C)(CCC#N)CN1CCC[C@H]1c1cccc2ccccc12 511759391 UGYDPNYZMIHZSM-FQEVSTJZSA-N 306.453 5.307 30 20 DKED Cc1cc(N[C@H](C)c2cccc(C#N)c2)cc(C(F)(F)F)c1 600853118 WUOOWCXIZZYGND-GFCCVEGCSA-N 304.315 5.059 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1 358344685 XDYFMXUIXNESCI-RTBURBONSA-N 312.844 5.426 30 20 DKED N#C[C@@H]1CCC[C@@H](Nc2ccccc2SC2CCCC2)C1 463288678 NQANDYIXSRNJBX-HUUCEWRRSA-N 300.471 5.216 30 20 DKED CC(C)(CCC#N)CN[C@@H](c1cc2ccccc2o1)C(C)(C)C 566756206 ZNWPYIWTXLHLFK-SFHVURJKSA-N 312.457 5.440 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 766019297 LKNXUZSFCJAKQJ-YVEFUNNKSA-N 321.251 5.356 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cc(C)cc(C)c1 795000073 QKWWVHPSVPRRNM-UHFFFAOYSA-N 324.493 5.079 30 20 DKED C[C@H]1C[C@@H](Nc2ccc(CCC#N)cc2)c2ccsc2S1 903298591 XQVAZRIUFXXDAP-BLLLJJGKSA-N 314.479 5.242 30 20 DKED C=CCC1(c2nc(-c3c(Cl)cccc3Cl)no2)CCC1 904309569 CKFLKLQZPLILOF-UHFFFAOYSA-N 309.196 5.041 30 20 DKED N#Cc1ccc(SCc2ccccc2Oc2cccnc2)cc1 109573374 JWOLKGWHFPIRJY-UHFFFAOYSA-N 318.401 5.038 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H](C)C1 191482237 MKQYORSGHCJEBL-INIZCTEOSA-N 314.473 5.192 30 20 DKED C=CCCc1ccccc1NC(=O)c1c(Cl)ccc(F)c1C 410352329 OJFGUKOYNAAHOW-UHFFFAOYSA-N 317.791 5.158 30 20 DKED CC[C@H](N[C@@H](c1ccccc1C)C1CC1)c1ccc(C#N)cc1 447526553 CXBNMMIZFPNZEV-LEWJYISDSA-N 304.437 5.059 30 20 DKED CCC(CC)(CNCC(C)(C)CCC#N)c1ccc(Cl)cc1 462776318 RQXFJYYNGOKJQL-UHFFFAOYSA-N 320.908 5.317 30 20 DKED CCC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1F 538396216 WQVWKFQVZHZDRJ-DJJJIMSYSA-N 314.379 5.028 30 20 DKED N#CCC[C@@H](/N=C\c1c(O)ccc2ccccc12)c1ccccc1 747690596 OSKKVCSBTLOIEM-QKYYUXOMSA-N 314.388 5.009 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567520 JOWHJRRYRQPXIA-KGLIPLIRSA-N 320.502 5.223 30 20 DKED C[C@@H](SCc1cc(Cl)nc(Cl)c1)c1cccc(C#N)c1 808365564 CXCYHMAUCKTXNX-SNVBAGLBSA-N 323.248 5.254 30 20 DKED CCc1ccc(C=NOCc2ccc(Cl)c3cccnc23)cc1 917395394 LVIALZCGMQCUOY-UHFFFAOYSA-N 324.811 5.001 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1cccnc1-c1ccc(Cl)s1 187119859 CSXNMCXVDLHNML-LLVKDONJSA-N 320.845 5.004 30 20 DKED Cc1noc(C)c1C(C)(C)/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329224665 CONVPHQBPOBVEQ-HRCADAONSA-N 318.461 5.090 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1 340446434 ONZZMKXUQMAILA-UXHICEINSA-N 310.416 5.302 30 20 DKED N#Cc1ccccc1SCc1cc(Cl)cc2cccnc12 439693236 MHBCHOARCQXETO-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C=CCCC[C@H](C)NC(=O)Nc1c(CC=C)cccc1C(C)C 475548049 LOWKJSGKEGJYLM-INIZCTEOSA-N 314.473 5.405 30 20 DKED C[C@H]1CC[C@@H](NCc2ccc(C#N)c(Cl)c2)c2sccc21 590778611 FGTQVFHQXPVNJM-MEDUHNTESA-N 316.857 5.001 30 20 DKED CC(C)(C#N)c1ccc(CNc2csc3ccccc23)cc1 614057993 YVQYIOLXANBEIL-UHFFFAOYSA-N 306.434 5.315 30 20 DKED CC[C@H](C)c1ccccc1OC(=O)C[C@H](CC#N)c1ccccc1 796523076 CCCPWXJECJRDBO-WMZOPIPTSA-N 321.420 5.193 30 20 DKED C[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1 36991839 DGXHVGVHVRCKRD-VXGBXAGGSA-N 319.235 5.277 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 460038594 YFMWAGWSVIAHFE-QMMMGPOBSA-N 306.620 5.188 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCC(c2cccc3ccccc23)CC1 464656762 ZRBSLPRVYFFMIP-KRWDZBQOSA-N 321.464 5.148 30 20 DKED CC(C)(C#N)CCSCc1csc(C2CCCCC2)n1 573240082 HNOLCQGYUGALSW-UHFFFAOYSA-N 308.516 5.364 30 20 DKED Cc1c(C(=O)/C=C\c2nccc3ccccc23)oc2ccccc12 740764839 HYRZJPPOSWXWLA-KHPPLWFESA-N 313.356 5.186 30 20 DKED CCCCCCCCCC[C@@H](C)Nc1ncc(C(=O)O)s1 1776785218 IKTMOIXWQNYGCD-CYBMUJFWSA-N 312.479 5.173 30 20 DKED CC(C)[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 315134039 CHRKXMLOTVSWJK-KUHUBIRLSA-N 312.844 5.260 30 20 DKED CC(C)[C@H](NCC1CCC(C#N)CC1)c1cc2ccccc2o1 442871297 FIAHRZHTTLXXGZ-PMTKGXAQSA-N 310.441 5.049 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(Cl)cc1F 485037539 YWVZNJGJCQCKPT-UHFFFAOYSA-N 324.827 5.079 30 20 DKED CC(C)c1ccc(SCCCC2(C#N)CCOCC2)cc1 539705097 QESKKZWMEJDKBF-UHFFFAOYSA-N 303.471 5.003 30 20 DKED CC[C@@H](Cc1ccccc1)N[C@H](CCCC#N)c1ccccc1 574059311 LCPSEMDOGWJTAG-LEWJYISDSA-N 306.453 5.032 30 20 DKED CC[C@@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1 579412989 DSZASJNKJFYKSW-CABCVRRESA-N 316.857 5.001 30 20 DKED C[C@H](NCc1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1 618302252 PWQGGULZWDBVII-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CCc1oc2ccccc2c1C=NNc1nc2ccccc2s1 730539941 DEQURGBRDMYEHW-UHFFFAOYSA-N 321.405 5.051 30 20 DKED CC(C)CC1(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)CCCC1 756228711 SNSSFMAVSJLJTF-KRWDZBQOSA-N 320.436 5.018 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(SCC)cc1)c1ccncc1 756925685 GRUBPZQWAGTHPK-DNVCBOLYSA-N 312.482 5.162 30 20 DKED CCCCCCC(=O)N(Cc1ccccc1)c1ccccc1C#N 918584031 CVMZWUHMYCIBON-UHFFFAOYSA-N 320.436 5.062 30 20 DKED C[C@H](Sc1ccc(C#N)cc1)c1ncc(-c2ccccc2)o1 78056141 AVMIMFDWZWREQL-ZDUSSCGKSA-N 306.390 5.067 30 20 DKED CCC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC)cc1 90665392 PDLHHQYJNHGLEB-NHCUHLMSSA-N 322.452 5.171 30 20 DKED Cc1coc2ccc(N=C(O)C[C@H]3CCO[C@@H](C(C)C)C3)cc12 330043172 FBAVBQOBGMQWIL-KBXCAEBGSA-N 315.413 5.171 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CC=CCC1 475575248 ZMDSMVZIOXKFLS-INIZCTEOSA-N 312.457 5.016 30 20 DKED N#CCCC[C@@H](NC1CC(c2cccc(F)c2)C1)c1ccccc1 559864147 SDVGHVNCCQYZRH-DQVLVPHSSA-N 322.427 5.096 30 20 DKED C[C@@H](NCC1(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 568802381 MKSYHLPLKUYTMQ-GFCCVEGCSA-N 316.857 5.023 30 20 DKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1csc2ccccc12 729987073 VAFBDCXPWBEVET-SNVBAGLBSA-N 314.360 5.224 30 20 DKED CC[C@H](CCC(F)(F)F)N[C@@H](CCCC#N)c1ccccc1 872072720 JDUCEPINLYDXGX-CVEARBPZSA-N 312.379 5.132 30 20 DKED CC[C@H](C)c1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1 1776088971 UJQHSNLXMFUIHX-ZDUSSCGKSA-N 324.424 5.043 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)ccc1F 189874947 LQTJGOOLXASQPS-UHFFFAOYSA-N 315.363 5.069 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(Oc2cccc(C)c2)cc1 303932414 XLEJHWWADMYNIV-UHFFFAOYSA-N 324.424 5.217 30 20 DKED C=CCC[C@H](N[C@H]1CCCc2ccc(O)cc21)c1ccccc1 340523257 CDHMPBOJKGCIKC-SFTDATJTSA-N 307.437 5.067 30 20 DKED CCCC(CCC)C(=O)Nc1ccccc1SC[C@H](C)C#N 510514916 ONGFBYPMFWIQLU-CQSZACIVSA-N 318.486 5.093 30 20 DKED CCCC[C@@H](CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 521734346 MFNSGKGVMQUXOA-HUUCEWRRSA-N 318.486 5.093 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1ccc(F)c(F)c1 522962108 XAICEMQQMAMIJA-NEPJUHHUSA-N 303.377 5.392 30 20 DKED C[C@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1ccc(C#N)cc1 540596823 JFWHSXLOZHVJSF-QWHCGFSZSA-N 324.811 5.370 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cccc(O[C@@H](C)CC)c1 578472947 WGPHWGRVKQQTRH-INIZCTEOSA-N 318.461 5.074 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)CCCCCC#N 588807026 YMWHUGJMMIXIKU-UHFFFAOYSA-N 300.446 5.346 30 20 DKED CCC[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(C)ccn1 601272047 CNNUJAYOWBXGSI-LJQANCHMSA-N 323.440 5.026 30 20 DKED CCCCCCCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 916848314 AEFMZIRFWRDTME-SFHVURJKSA-N 322.452 5.552 30 20 DKED C=CCCC[C@H](N[C@H]1CCCc2oc(C)nc21)c1ccccc1 926857044 ZZYNBMJXJUXDHT-ROUUACIJSA-N 310.441 5.048 30 20 DKED C[C@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccc(C#N)cc1 195613871 GWGVYOBOSIMNLB-YWZLYKJASA-N 304.437 5.022 30 20 DKED C=C(C)[C@@H](CC(=O)Nc1c(CCC)cccc1C(C)C)OCC 276288121 HGARBZYYWPFCLJ-GOSISDBHSA-N 317.473 5.072 30 20 DKED C[C@@H](c1cccc(Cl)c1)[S@](=O)CCC1(C#N)CCCCC1 417181613 RTHDAOCYTUBWOV-LHSJRXKWSA-N 323.889 5.014 30 20 DKED N#CCc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)cc1 541327983 KXPDRFHQQMECLK-FQEVSTJZSA-N 324.855 5.037 30 20 DKED C[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1cc2ccccc2o1 594517007 UAEVNPDACOGRDQ-OAHLLOKOSA-N 316.404 5.034 30 20 DKED CC[C@@H](C)Sc1ccc(N[C@@H](C#N)Cc2ccccc2)c(C)c1 604526571 OCLLPYUUJKGRPD-SJLPKXTDSA-N 324.493 5.432 30 20 DKED Cc1ccsc1C(=O)/C=C\c1ncc(-c2ccccc2)s1 770571835 JSFGRNDYJHGTAF-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C[C@@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)c(F)c1 777598928 ICZASEUYFLVOFM-SNVBAGLBSA-N 322.355 5.185 30 20 DKED CCCCCCCC(=O)N(CC)c1nc2ccccc2s1 918555154 BGCUXKARBFQOJH-UHFFFAOYSA-N 304.459 5.010 30 20 DKED CCC/C(C)=C\C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 921009674 DLCMJIRJRCYVNB-SQFISAMPSA-N 320.392 5.035 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc2ccccc2c1 192755315 PGBIZNCUVLBFRX-CVEARBPZSA-N 300.405 5.123 30 20 DKED N#C[C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 463290671 TWULLXWMBLHUPS-UIAACRFSSA-N 324.855 5.101 30 20 DKED N#CCCCCN[C@@H](CCCc1ccccc1)c1ccccc1 532215945 FUMFOZLHZGJXSO-NRFANRHFSA-N 306.453 5.034 30 20 DKED CC[C@@H](N[C@H](C)c1ccccc1OC(C)C)c1ccc(C#N)cc1 583544869 IVSSQWAUYCLOHS-OXQOHEQNSA-N 322.452 5.147 30 20 DKED Cc1ccccc1[C@H](C)N(CC(C)C)C(=O)CCCCCC#N 588990248 NOHDSVQDKCPWKY-SFHVURJKSA-N 314.473 5.015 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccccc3)s2)cc1 734303501 RLRLSYDVGOJFSF-VAWYXSNFSA-N 305.402 5.015 30 20 DKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(-c2cccs2)cc1 742725612 ZDMAHXCUECCDSY-OAHLLOKOSA-N 318.445 5.138 30 20 DKED COc1ccc2cc(/C=C\C(=O)c3ccc(C)s3)ccc2c1 917043520 JMYYIOKTAKHSHA-UITAMQMPSA-N 308.402 5.114 30 20 DKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1cccc2ccccc12 921261883 WBMPGNMACYFKCN-NTMALXAHSA-N 308.764 5.095 30 20 DKED O=C(/C=C\c1ccc(Cl)s1)c1ccc(F)c(Cl)c1 208805019 IQCMCSVQHXDQLR-DJWKRKHSSA-N 301.169 5.090 30 20 DKED N#Cc1ccc(CNc2cccc(COC3CCCCC3)c2)cc1 237844622 BYLRGSQZKPOQMW-UHFFFAOYSA-N 320.436 5.020 30 20 DKED C=CCC(CC=C)C(=O)N1CCCC[C@H]1c1cccc(Cl)c1 436437734 GEWJYUTVXTUZNZ-SFHVURJKSA-N 317.860 5.162 30 20 DKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H]1CCC[C@@H](C#N)C1 463281506 KXGJURALLNTYJT-QRVBRYPASA-N 324.493 5.012 30 20 DKED O=C1/C(=C/c2cnc(-c3ccccc3)s2)CCc2ccccc21 727263910 JIBHECGZSATEQL-FOWTUZBSSA-N 317.413 5.023 30 20 DKED O=C1/C(=C/c2ccc(Cl)c(C(F)(F)F)c2)Cc2ccccc21 727264107 MWLXDUUEJHZINX-KPKJPENVSA-N 322.713 5.181 30 20 DKED COCc1cccc(/C=C\C(=O)c2cccc(Cl)c2Cl)c1 742435341 VYGSAFVCEMCXGQ-HJWRWDBZSA-N 321.203 5.036 30 20 DKED COc1cc(C)c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1C 753688776 VDKFPTKWSWHTHB-XLIONFOSSA-N 322.452 5.008 30 20 DKED C=CC[C@@H](N[C@H](C)c1cc(Cl)cc(Cl)c1)c1ccncc1 766019503 MCSWWLULRXTUDI-SJKOYZFVSA-N 321.251 5.356 30 20 DKED C#CC[C@H](NCc1csc(C2CCCCC2)n1)c1ccccc1 775399261 QOLSBJPMOSTZQD-IBGZPJMESA-N 324.493 5.045 30 20 DKED CC(C)(C#N)CCCOC(=O)c1sc2ccccc2c1Cl 781950812 GWTSOXLXHOCBHM-UHFFFAOYSA-N 321.829 5.041 30 20 DKED CCCC(=CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)CCC 797570692 IVYWLNIKHDWLIU-AWEZNQCLSA-N 318.486 5.143 30 20 DKED CC[C@@H](N[C@@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 447525569 ARAIATSKDGGPDP-KBXCAEBGSA-N 320.461 5.575 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1sccc1OC)c1ccccc1 471578775 RUBHDBOKZZMIFH-GOEBONIOSA-N 301.455 5.115 30 20 DKED C=CCCc1ccccc1NC(=O)N(CC=C)Cc1ccccc1 505010933 NTJFANVEVPTFIM-UHFFFAOYSA-N 320.436 5.025 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)cc1F 512655052 REYSRZBGIPKWHX-AUUYWEPGSA-N 310.416 5.135 30 20 DKED CCC(C)(C)OCc1cccc(NCc2ccc(C#N)cc2)c1C 531165128 VUAFMUAYZNOXNW-UHFFFAOYSA-N 322.452 5.184 30 20 DKED C[C@H](NCc1ccc(CC#N)cc1)c1cc2cc(Cl)ccc2o1 558409134 OTTAADPVCBNCJT-ZDUSSCGKSA-N 324.811 5.003 30 20 DKED Cc1cccc2[nH]c(CN[C@H](CCCC#N)c3ccccc3)cc12 594943086 GWRWREHMLLWDOU-HXUWFJFHSA-N 317.436 5.001 30 20 DKED C=CCN(CC=C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 498855637 MQNCXMQEKXHTTG-OAHLLOKOSA-N 318.486 5.092 30 20 DKED C[C@H](SCc1cc(-c2ccccc2)no1)c1ccc(C#N)cc1 609825297 PRDXQURRWQNZMI-AWEZNQCLSA-N 320.417 5.208 30 20 DKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 727952511 JVETUBVXEWMUBQ-AEFFLSMTSA-N 322.452 5.408 30 20 DKED C=CCOc1ccc(CN[C@@H](C)c2csc3ccccc23)cc1 730019081 FSEAVUFGKAULTK-HNNXBMFYSA-N 323.461 5.317 30 20 DKED O=C(/C=C/c1cccc(F)c1F)c1cccc(Cl)c1Cl 734981759 SXDJSCBQOHOXDG-BQYQJAHWSA-N 313.130 5.168 30 20 DKED CCCc1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 740764656 BGRYATYHXVDCQZ-OUKQBFOZSA-N 301.389 5.083 30 20 DKED CCCCCCCC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1 742131708 MSIPOHFGQODACL-YJBOKZPZSA-N 305.437 5.096 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 744015248 KSICKBYUZGCBFX-WBVHZDCISA-N 308.425 5.018 30 20 DKED O=C(/C=C\c1ccc(O)cc1)c1ccc(-c2ccccc2)s1 747188319 MIJJJEIQXJDMPC-FLIBITNWSA-N 306.386 5.017 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1cc2oc3ccccc3c2cc1OC 767045986 IDBIJZWDLATLFZ-ZDUSSCGKSA-N 323.392 5.135 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nc2ccccc2s1 776075430 XQFBVRPMZHEORS-KGLIPLIRSA-N 314.454 5.079 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1Cl 97465040 KOGXNPGTCWAFON-AWEZNQCLSA-N 314.816 5.196 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1csc(Cl)c1 191388364 JZJNLTXRUDQPOU-DOMZBBRYSA-N 304.846 5.097 30 20 DKED CC(C)c1ccc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 192995228 KIIISJIOQNVSBW-IRXDYDNUSA-N 322.452 5.124 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(C2CC2)c1 356172404 QKGIUMPQRWMOGI-UHFFFAOYSA-N 320.436 5.063 30 20 DKED CC(C)(C#N)c1ccccc1CSc1ccc(N)cc1Cl 502133736 ZWOZZDOYDKTBOB-UHFFFAOYSA-N 316.857 5.016 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cc(C)c(C)o1)c1ccc(F)c(F)c1 502433308 VNTWZZUFVUOADL-KPZWWZAWSA-N 305.368 5.143 30 20 DKED CC(C)(C)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 737502290 GELFSGBGDSJSQY-LJQANCHMSA-N 320.436 5.107 30 20 DKED CCCCCCCC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 919754128 AVLIEUOJZRCXBJ-UHFFFAOYSA-N 314.429 5.257 30 20 DKED CCCC1CCC(C(C)=NNc2cccc(C(=O)O)c2C)CC1 1776089075 AJVGXQVFXCYNOA-UHFFFAOYSA-N 316.445 5.088 30 20 DKED N#Cc1ccc(CN2CCC[C@H]2c2cccc3ccccc23)cc1 60040206 CNFCHVCMEHLFFK-QFIPXVFZSA-N 312.416 5.049 30 20 DKED C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1 182333121 INDJHQZQRRCYOQ-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED CCOc1ccccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 340447184 PFJAWFUPHOQSBY-FXAWDEMLSA-N 322.452 5.171 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccccc1C(F)(F)F 444670935 HCELHBMKZOOHOW-ZDUSSCGKSA-N 312.379 5.076 30 20 DKED Cc1ccc(-c2csc(CSCCC(C)(C)C#N)n2)cc1 507122597 UTRFFGSLOIYDCH-UHFFFAOYSA-N 316.495 5.292 30 20 DKED C[C@H](N[C@@H]1CC[C@H](C#N)C1)c1ccccc1-c1ccc(Cl)cc1 549927996 JQKUCKSCPPHZKA-RLFYNMQTSA-N 324.855 5.350 30 20 DKED Cc1cccc2c1C/C(=C\c1csc(-c3cccs3)n1)C2=O 729150503 KRRPDLYXARBRGZ-XYOKQWHBSA-N 323.442 5.002 30 20 DKED COCc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1 741840349 QJRFCHJLJUEUHE-TWGQIWQCSA-N 321.203 5.036 30 20 DKED C#CC[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccccc1 773116176 QDRAYGBFHYTTQH-RDTXWAMCSA-N 317.354 5.121 30 20 DKED C=CC[C@H](N[C@@H]1CCCc2ccc(SC)cc21)c1ccncc1 842842358 XFKZNBZCGARJFI-VQTJNVASSA-N 324.493 5.088 30 20 DKED O/C(=N/Cc1ncoc1-c1ccccc1)[C@@H]1C[C@@H]1C1CCCCC1 329829112 JQECKNVDEMENMJ-IAGOWNOFSA-N 324.424 5.015 30 20 DKED C=CCC[C@H](NCc1ccc(C(F)F)cc1)c1ccccc1 461373439 NLKFJXHGFIHYEA-SFHVURJKSA-N 301.380 5.421 30 20 DKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1 520959474 MRNCLPLUINUAMK-HXUWFJFHSA-N 324.855 5.233 30 20 DKED C[C@H](CC(=O)Nc1ccccc1SCCC#N)CC(C)(C)C 609375572 RJZIGONDKYTWOH-CQSZACIVSA-N 318.486 5.093 30 20 DKED N#C[C@H](Sc1ncc(-c2ccc(F)cc2)o1)C1CCCCC1 609649006 SOOXMMSVZKAGRW-INIZCTEOSA-N 316.401 5.045 30 20 DKED CC(C)c1ccc(Sc2ccc(NC(=O)[C@@H](C)C#N)cc2)cc1 609920972 WAQDRJPADJTLHU-AWEZNQCLSA-N 324.449 5.059 30 20 DKED CC1(C)CCC[C@H](CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)C1 756518993 LNORBECQCDVTKN-WBVHZDCISA-N 320.436 5.018 30 20 DKED O=C(/C=C/c1cc(Cl)cs1)c1c(F)cccc1Cl 809158891 FLRBECRTIVOMPH-SNAWJCMRSA-N 301.169 5.090 30 20 DKED C=C(C)[C@@H](N[C@@H](CC)c1cccs1)c1ccc(F)c(F)c1 480698729 MXWZGOLWGURQQT-DOTOQJQBSA-N 307.409 5.384 30 20 DKED C[C@H](C#N)CSc1ccccc1NC[C@@H]1CCCCC1(F)F 594706018 RZQVDCDKQSBLJG-KGLIPLIRSA-N 324.440 5.176 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1ccnc2ccccc12 731311292 AVVQAOARBYZNMH-UHFFFAOYSA-N 323.399 5.407 30 20 DKED CCCCCCCCCC[C@H](C)Nc1ccc(C(=O)O)c(C)n1 1776785261 LZTXTCYQZOFTJF-HNNXBMFYSA-N 320.477 5.419 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)cc1F 189889980 GVELBKPAZGKRCJ-UHFFFAOYSA-N 311.400 5.238 30 20 DKED Cc1cc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc(C)c1F 358336084 CBRSIPXGEAFNMY-QFBILLFUSA-N 310.416 5.138 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1 358340377 KUUPEDBUDSFKRD-RTBURBONSA-N 312.844 5.426 30 20 DKED C=C(C)[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1ccc(F)c(F)c1 479416428 YMBSLPSSLREDFD-YFROIQMUSA-N 317.379 5.088 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)s1 537407765 ZUJDUJPDIABUGI-YGRLFVJLSA-N 322.836 5.214 30 20 DKED CC(C)(CCC#N)CN[C@H](c1cc2ccccc2o1)C(C)(C)C 566756205 ZNWPYIWTXLHLFK-GOSISDBHSA-N 312.457 5.440 30 20 DKED C=CCC[C@@H](C(=O)Nc1cccc(F)c1Cl)c1ccccc1 584685400 YLIURRWWKVQBNJ-CQSZACIVSA-N 317.791 5.168 30 20 DKED C=CCC[C@H](NCc1ccccc1CC(F)(F)F)c1ccco1 624307583 OFBOKKAMIBKYTH-INIZCTEOSA-N 323.358 5.182 30 20 DKED O=C(/C=C\C1=Cc2ccccc2OC1)c1cccc2ccccc12 726739539 BLEJRXOANAGCHC-SEYXRHQNSA-N 312.368 5.055 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1cc(C)ccc1F 799900845 QMTISCHGKZHQOS-UHFFFAOYSA-N 314.429 5.062 30 20 DKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)cc1 1776784617 RLTCDKJDDIZOTO-UHFFFAOYSA-N 319.489 5.347 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1csc(Cl)c1 191388378 JZJNLTXRUDQPOU-SWLSCSKDSA-N 304.846 5.097 30 20 DKED C=CCC[C@H](NCc1nc(C(C)(C)C)cs1)c1ccccc1 538260120 XPIQRRVVZKUKNX-INIZCTEOSA-N 314.498 5.238 30 20 DKED C=CCCC[C@H](C)NC(=O)Nc1cc(C(F)F)ccc1Cl 557703755 AQQGXBZNSJMUNB-JTQLQIEISA-N 316.779 5.144 30 20 DKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cncc(F)c2)c1 737445727 GIHPKSVTBJAAJH-MDZDMXLPSA-N 317.363 5.092 30 20 DKED O=C(/C=C/C=C\c1ccccc1)c1ccc(-c2ccncc2)cc1 745990123 KUMDNWRRLSDPIN-MVTUOISNSA-N 311.384 5.201 30 20 DKED C[C@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1F 781421938 IXZZSYNOTFIYLE-QWHCGFSZSA-N 324.424 5.324 30 20 DKED CCC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1 340448701 JBVOJRXZPWENMZ-LEWJYISDSA-N 306.453 5.553 30 20 DKED N#CCCC[C@@H](NCc1c(F)cccc1Cl)c1ccccc1 433021146 VXIUCPSLSCNESX-GOSISDBHSA-N 316.807 5.004 30 20 DKED CC(C)(C#N)CCCCSC[C@H]1CCC2(CCCCC2)O1 435881449 AWFHCPVIRMFAKN-MRXNPFEDSA-N 309.519 5.322 30 20 DKED C[C@@H](NCC1CCC(C#N)CC1)c1cc(Cl)sc1Cl 442865614 IONMFJKLKXFDTK-KPPDAEKUSA-N 317.285 5.035 30 20 DKED CC(C)C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccs1 512668090 SQRGQFGDNLNIFR-CXAGYDPISA-N 316.445 5.197 30 20 DKED CC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)s1 539497247 SAWCEEASBPFZQV-FZMZJTMJSA-N 304.846 5.075 30 20 DKED Cc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(O)c1C 815635341 ATXJFENZLHLXPD-YLJYHZDGSA-N 322.452 5.095 30 20 DKED CCCCCCCCCC(=O)Nc1cc(NC(C)=O)ccc1C 915296729 ONJPJRPCLFPSDU-UHFFFAOYSA-N 318.461 5.033 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ncco1)c1ccc(C(F)(F)F)cc1 925598200 QOZYKFVZQLOJLX-SWLSCSKDSA-N 324.346 5.052 30 20 DKED N#Cc1ccc(-c2cc(F)c(-c3ccc(C#N)cc3)cc2F)cc1 2048532817 SGPVRBSOMVYSER-UHFFFAOYSA-N 316.310 5.042 30 20 DKED C=C(C)[C@H]1CC=C(C)C(=NNc2ncc(Cl)cc2Cl)C1 7860040 QCAMUWGVVONTCE-NSHDSACASA-N 310.228 5.089 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 329114741 SLOMMACHMOJXAG-QILLFSRXSA-N 323.440 5.271 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 466310504 YDXCVSGGMDSDBR-XXFQCFAGSA-N 317.498 5.135 30 20 DKED CCSc1ccc(Cl)cc1N[C@@H](C)c1ccc(C#N)cc1 522842468 XUZIQTXGMKYTKZ-LBPRGKRZSA-N 316.857 5.497 30 20 DKED CCC[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 610830016 XOUZYUJVPGPNAX-KUHUBIRLSA-N 312.844 5.404 30 20 DKED CO[C@H](C)c1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 726893453 ZYCWCVRSACDQPN-SNVBAGLBSA-N 324.207 5.157 30 20 DKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 805845265 RZXUQMARNWYANP-INIZCTEOSA-N 308.425 5.018 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(C)ccc1OC 90665147 WDESSFVDQZWPRJ-PMACEKPBSA-N 322.452 5.089 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)ccc1F 340457952 WZOWFEXZRXADTB-IFXJQAMLSA-N 314.379 5.051 30 20 DKED C[C@@H]1C[C@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 391788230 FSJFKMQYPQTJCX-QRWLVFNGSA-N 306.409 5.030 30 20 DKED C[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1cccc(C#N)c1 426321380 CLMHKIMMAQQSJR-IAQYHMDHSA-N 316.857 5.001 30 20 DKED CC[C@H](N[C@@H](C)c1cc2ccccc2o1)c1ccc(C#N)cc1 447517598 SWQTUIIFNSSMAQ-KSSFIOAISA-N 304.393 5.106 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1cccc(F)c1 917819631 VWAYCRFUOTYRMI-SFHVURJKSA-N 305.437 5.240 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CCCc2sccc21 360876056 YRXOOGSIWNKYKQ-RBUKOAKNSA-N 322.477 5.054 30 20 DKED C[C@H](Nc1cccc(OC2CCCC2)c1)c1ccc(C#N)cc1 540839982 SLWMWSAGIYDQPD-HNNXBMFYSA-N 306.409 5.053 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550827520 MLLRHSCYQAPXNZ-BEFAXECRSA-N 312.844 5.426 30 20 DKED CC[C@H](CNc1ccccc1SC[C@H](C)C#N)CC(F)F 594704915 HKIOQOQTYSVAME-OLZOCXBDSA-N 312.429 5.032 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccccc1Cl 732625174 KWZRFXIDUQGZGK-UHFFFAOYSA-N 322.905 5.105 30 20 DKED Cn1cc(C(=O)/C=C\c2ccc(C(F)F)cc2)c2ccccc21 794934476 LIWBVBXIDILKBI-FLIBITNWSA-N 311.331 5.012 30 20 DKED CC(C)[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315860938 MKJRHCKLCGTDHY-AUUYWEPGSA-N 312.844 5.260 30 20 DKED C=CCCc1ccccc1NC(=O)Cc1c(C)oc2ccccc12 410344119 HYASIFOJKZAPNE-UHFFFAOYSA-N 319.404 5.041 30 20 DKED CC[C@@H](Nc1cnn([C@H](C)CC)c1C1CC1)c1ccc(C#N)cc1 447596643 QPNSOZNJYSLZIT-RDTXWAMCSA-N 322.456 5.166 30 20 DKED CC(C)(C)CCC(=O)Nc1sc(-c2ccccc2)cc1C#N 523103964 SEFLHCDBFMWWFX-UHFFFAOYSA-N 312.438 5.052 30 20 DKED C=CCC[C@@H](N[C@@H]1CCCc2c(O)cccc21)c1ccccc1 565109657 HTELNAUDAYRVGU-WOJBJXKFSA-N 307.437 5.067 30 20 DKED Cc1ccsc1C(=O)/C=C/c1csc(-c2ccccc2)n1 733749117 DSPMEQUDYJFVCT-BQYQJAHWSA-N 311.431 5.076 30 20 DKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1coc2ccccc12 761478982 IXKRFKNLHAVDOS-FNORWQNLSA-N 318.159 5.031 30 20 DKED Cc1cccc(C)c1-c1cccc(OC(=O)CCCCCC#N)c1 811219423 FJRHYBIEINHXNS-UHFFFAOYSA-N 321.420 5.350 30 20 DKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(F)cc3)cs2)cc1 918713723 QVACESJETFDCOP-KHPPLWFESA-N 323.392 5.154 30 20 DKED C[C@H](Oc1ccc(C#N)c(Cl)c1)c1ncc(-c2ccccc2)o1 438906617 DLROYDYXSWUOPX-LBPRGKRZSA-N 324.767 5.007 30 20 DKED CC[C@@H](N[C@@H](C)c1cccc(OC(C)C)c1)c1ccc(C#N)cc1 447538011 AHYYJWZHQFADQS-HRAATJIYSA-N 322.452 5.147 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1cccc(COC(C)(C)CC)c1C 466514567 LIOCHDCLAKTZFP-OAHLLOKOSA-N 317.473 5.241 30 20 DKED CC(C)(C#N)CCCSc1ncc(-c2ccc(Cl)cc2)o1 476510723 RXVXOUMUMWIOTE-UHFFFAOYSA-N 320.845 5.417 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC[C@H]1CC 477000687 JQNKJWWCVFDBOU-VQIMIIECSA-N 313.485 5.693 30 20 DKED C[C@@H](N[C@H](C)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1 531951389 MMQFRZBBRKYEPM-VXGBXAGGSA-N 319.235 5.277 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@@H](C)c1ccc(C#N)cc1 609825104 GLFOIKUQALGZDP-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C\C1CCCCC1 735426681 RXXRZQKXUZOWAW-FLIBITNWSA-N 323.889 5.053 30 20 DKED C[C@@H](c1ccccc1)c1ccc(OC(=O)CCCCCC#N)cc1 805875948 CJQOSSMDZPTUJQ-KRWDZBQOSA-N 321.420 5.218 30 20 DKED C=CC[C@@H](CC)NC(=O)Nc1c(C(C)C)cccc1C(C)C 466409388 XEXDGKJBZYSKJP-OAHLLOKOSA-N 302.462 5.410 30 20 DKED N#Cc1ccc2c(c1)[C@H](N[C@H](c1ccccc1)C1CCCC1)CC2 517228295 KBUQBDCNBOCCKZ-FGZHOGPDSA-N 316.448 5.067 30 20 DKED C[C@H](N[C@H](c1ccc(F)cc1)C1CCCC1)c1ccc(C#N)cc1 561454071 DOSRVHVRFZLMAN-BTYIYWSLSA-N 322.427 5.279 30 20 DKED C=CCC[C@H](N[C@@H]1CCc2sc(Cl)cc21)c1ccco1 573143532 PASCDVQSNJPNEG-OLZOCXBDSA-N 307.846 5.279 30 20 DKED C#CC[C@H](NC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 757778746 QYDBIQQIKNMUIL-IBGZPJMESA-N 320.436 5.005 30 20 DKED C[C@H](Nc1ccc(COC2CCCC2)cc1)c1ccc(C#N)cc1 174121601 JKCROYHVTSAOBA-INIZCTEOSA-N 320.436 5.191 30 20 DKED C[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CCCCC1 303100376 HJXXMKTYBUWZGN-OAHLLOKOSA-N 312.457 5.033 30 20 DKED CC[C@H](CC#N)NC1CCC(c2cccc(C(F)(F)F)c2)CC1 432920035 WSDPITYBZARJLB-BLDCVEFLSA-N 324.390 5.013 30 20 DKED C=C(CC)CSCC(=O)Nc1c(C(C)C)cccc1C(C)C 537992982 GKNUHENTAXCHBF-UHFFFAOYSA-N 319.514 5.571 30 20 DKED CC(C)[C@H](NCC(C)(C)CCC#N)c1ccc(Cl)cc1F 554076446 DPJCNZLWOPBGBK-INIZCTEOSA-N 310.844 5.096 30 20 DKED CC[C@H](NCc1c(Cl)cccc1Cl)c1ccc(C#N)cc1 556063409 DGFMWYQXWXYBJI-KRWDZBQOSA-N 319.235 5.106 30 20 DKED C=CC[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccncc1 766017740 CSSYRAOUTICKQG-LRDDRELGSA-N 321.251 5.356 30 20 DKED C=CCC[C@@H](Nc1ccc(OC)c(SC)c1)c1ccco1 840774749 QGZMVPQWGIGNBM-CQSZACIVSA-N 303.427 5.130 30 20 DKED C=CC[C@H](N[C@H](C)c1c(C)oc2ccccc12)c1ccncc1 925074518 ICTOQFCPZSKCHD-KDOFPFPSSA-N 306.409 5.104 30 20 DKED C[C@H]1C[C@@H](C(O)=Nc2ccc3c(c2)oc2ccccc23)CCC1=O 328909473 DRYSPIYRRJMNGP-STQMWFEESA-N 321.376 5.179 30 20 DKED CCSc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 358345846 PKXOJMJPJQWHCT-JXFKEZNVSA-N 324.493 5.494 30 20 DKED CC(C)(C)C[C@H](N[C@@H](C#N)Cc1ccccc1)c1ccc(F)cc1 610294675 QXNSCJAHVAXPSP-UXHICEINSA-N 324.443 5.027 30 20 DKED O=C(/C=C/c1nccc2ccccc12)c1cccc2ccccc12 740763738 HLLCKYSCCRDPML-OUKQBFOZSA-N 309.368 5.284 30 20 DKED O=C1/C(=C/c2cnc(-c3cccs3)s2)CCc2ccccc21 751513057 NFXSXLXIFBLZTB-JLHYYAGUSA-N 323.442 5.084 30 20 DKED O=C(/C=C\c1ccc(C(F)F)cc1)c1c[nH]c2cc(F)ccc12 794934691 MBYXVAWJNSVTDG-BAQGIRSFSA-N 315.294 5.141 30 20 DKED CCCC[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 799891280 CGRVCVOJXUUPEX-OXJNMPFZSA-N 320.436 5.107 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C(C)C 276393287 IWYPXWUMHBYZGZ-HNNXBMFYSA-N 302.462 5.047 30 20 DKED Cc1ccccc1[C@H](Sc1ccc(C#N)cn1)c1ccccc1 603504982 NUUBKRHMFRAPRG-HXUWFJFHSA-N 316.429 5.143 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(C(C)C)cc1C(C)C 605907668 DJBKMLDEKDVYTP-UHFFFAOYSA-N 302.462 5.363 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(C)(C)C 606934120 BLXCHRLCFUQDMI-UHFFFAOYSA-N 302.462 5.194 30 20 DKED CCCCCCCCCCCN(C)[C@H](C)c1ccc(C(=O)O)o1 1776784586 LWPXXSZLCLFCSA-MRXNPFEDSA-N 323.477 5.501 30 20 DKED C=CCC[C@@H](N[C@H](C)c1sc(C)nc1C)c1ccccc1 181507449 KSUNFAOIDKYXIV-RHSMWYFYSA-N 300.471 5.118 30 20 DKED Cc1c([C@H](NCc2ccc(C#N)cc2)C(C)C)oc2ccccc12 236734918 RPHBTNIFEQLGCS-HXUWFJFHSA-N 318.420 5.100 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCC2 340449457 VISPDJMUFYZLIT-HTAPYJJXSA-N 318.464 5.261 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCCc2ccccc21)c1ccccc1 340454891 SUKSMEPDDULGPV-NHCUHLMSSA-N 304.437 5.089 30 20 DKED N#Cc1ccc(SCc2cccc3cccnc23)c(Cl)c1 499477163 ZXKKQLSVWUZSEI-UHFFFAOYSA-N 310.809 5.052 30 20 DKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1ccccc1)C1CCCC1)CC2 517228297 KBUQBDCNBOCCKZ-YADHBBJMSA-N 316.448 5.067 30 20 DKED C=CCC[C@H](Nc1ccc2cnn(C(C)C)c2c1)c1ccco1 552281611 DLBRRAFJDXZFIF-KRWDZBQOSA-N 309.413 5.330 30 20 DKED CC(C)n1nccc1/C=C/C(=O)c1cccc(-c2ccccc2)c1 794934386 JTXNKANBGFWVOX-VAWYXSNFSA-N 316.404 5.027 30 20 DKED Cc1coc(-c2ccc(C)c(N[C@H](C)c3cccc(C#N)c3)c2)n1 180035047 UWWOLLYTVPQSTA-OAHLLOKOSA-N 317.392 5.003 30 20 DKED C=CCC[C@@H](N[C@H](C)c1csc(C(C)C)n1)c1ccccc1 469802829 VXJVJNWMHORYHO-NVXWUHKLSA-N 314.498 5.625 30 20 DKED C[C@H](SCc1ccc2ncccc2c1)c1ccc(C#N)cc1 546020214 KMXIZDBPKALREL-AWEZNQCLSA-N 304.418 5.101 30 20 DKED C=CCCC(=O)Nc1cccc(CSCc2ccccc2)c1 609696782 LRZYVCNIFAZTMP-UHFFFAOYSA-N 311.450 5.025 30 20 DKED CCCC(=CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)CCC 797570693 IVYWLNIKHDWLIU-CQSZACIVSA-N 318.486 5.143 30 20 DKED O=C(/C=C/c1ccc(-c2ccccc2)o1)c1ccc(F)cc1F 917516634 BWLXOLFYDIKVLR-JXMROGBWSA-N 310.299 5.121 30 20 DKED Cc1ncsc1C(=O)/C=C\c1cc(-c2ccccc2)cs1 917519351 QTPPSCNDIJFLPQ-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C=C(C)CNc1ccc(Oc2ncc(Cl)cc2Cl)cc1 917819106 LGRXRACQTYWZJN-UHFFFAOYSA-N 309.196 5.169 30 20 DKED C[C@@H](N[C@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 174358511 UNSBDNIFOHUVFT-HZPDHXFCSA-N 300.405 5.123 30 20 DKED C[C@H](Nc1ccccc1O[C@H](C)C#N)c1ccc2ccccc2c1 182260499 WCPAKKPIBRAXSP-CVEARBPZSA-N 316.404 5.304 30 20 DKED C[C@@H](CNCC(C)(C)CCC#N)c1c(Cl)cccc1Cl 237337193 KXTVFTLLIDYCHD-LBPRGKRZSA-N 313.272 5.016 30 20 DKED Cc1cc(CNc2ccccc2S[C@@H](C)CC#N)c(C)s1 435900148 ZSAIJWJZNAPMGU-LBPRGKRZSA-N 316.495 5.371 30 20 DKED CCOc1ccccc1[C@H](CC)N[C@H](CC)c1ccc(C#N)cc1 447546766 YQYABJQJDYXAIH-UXHICEINSA-N 322.452 5.149 30 20 DKED C[C@@H](Nc1cccc(C(F)F)c1Cl)c1ccc(C#N)cc1 541741797 VGPKTRLLMVGWEJ-SNVBAGLBSA-N 306.743 5.322 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(F)cc3)s2)cc1 734303347 MCOMSNPTROBXBO-ZHACJKMWSA-N 323.392 5.154 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2cccc(-c3ccccn3)c2)c1 763292019 GIPYBFLZQLTKMI-PKNBQFBNSA-N 317.363 5.092 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1c(C)cccc1C 794995202 NDNNMJWLSYLJTK-UHFFFAOYSA-N 324.493 5.079 30 20 DKED C=C(C)[C@@H](N[C@@H](CC)c1ccccc1O)c1ccc(F)c(F)c1 186446352 XWEJQKNIZUWXII-PKOBYXMFSA-N 317.379 5.029 30 20 DKED CC(C)c1ccc(NCc2cccc(OCCCC#N)c2)cc1 236668036 OMDYBNBCTRYJPO-UHFFFAOYSA-N 308.425 5.105 30 20 DKED CCC[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1 321666321 SYQGRFFIPOXOMM-FQEVSTJZSA-N 308.425 5.322 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340429792 DTTGFIVHWRFMCK-SFTDATJTSA-N 322.452 5.171 30 20 DKED CCc1ccc([C@@H](CC)N[C@H](CCCC#N)c2ccccc2)cc1 340460934 YPBUBMBBUJDHML-FGZHOGPDSA-N 320.480 5.725 30 20 DKED C=CCC[C@H](NCc1cc(F)cc2cccnc12)c1ccccc1 341937692 BWLOZLFFKXWWKQ-FQEVSTJZSA-N 320.411 5.171 30 20 DKED C=CCCc1ccccc1NC(=O)CCCc1sccc1C 410344060 JRGBZTFKCIYOJB-UHFFFAOYSA-N 313.466 5.137 30 20 DKED C=CC1CCN(C(=O)Nc2ccc(C(C)C)cc2C(C)C)CC1 522086833 WXMLEOPZCXKBOW-UHFFFAOYSA-N 314.473 5.363 30 20 DKED C[C@@H]1[C@H](N[C@H](CCCC#N)c2ccccc2)C[C@H]1c1ccccc1 559861679 CEAFVAWGUBJPGE-ZHNGQKSSSA-N 318.464 5.203 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1Cl 97465041 KOGXNPGTCWAFON-CQSZACIVSA-N 314.816 5.196 30 20 DKED C[C@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1 195614544 AAGPACDQCUUSMF-LIRRHRJNSA-N 310.416 5.135 30 20 DKED C=CCCCS[C@@H](C)c1nc(Cc2ccc(Cl)cc2)no1 437272519 WKIZJEGSRSDXJS-LBPRGKRZSA-N 322.861 5.074 30 20 DKED CC[C@@H](Nc1cccc(CC(F)(F)F)c1)c1ccc(C#N)cc1 447590798 AOZMAMJCZLHIBZ-QGZVFWFLSA-N 318.342 5.226 30 20 DKED C=C(C)CN(CC)[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 488611288 QVHLNLYOZAJYCX-CQSZACIVSA-N 318.848 5.262 30 20 DKED CCCC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC)cc1 539496771 UMYKQUDNLQZWRS-IIBYNOLFSA-N 322.452 5.149 30 20 DKED CC(C)[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1 611390405 XXCDBFRIERQTFF-NHCUHLMSSA-N 322.427 5.062 30 20 DKED FC(F)(F)c1ccccc1ON=Cc1ccc2ccccc2c1 754711864 CUOKJHYTNBRNJV-UHFFFAOYSA-N 315.294 5.272 30 20 DKED C=CCCCCC[C@H](C)Nc1ccc(C)c(NC(C)=O)c1C 793547704 MDZOFDKETUXJCC-HNNXBMFYSA-N 302.462 5.199 30 20 DKED CCCCCCCC[C@@H](C)C(=O)N1CCC[C@H]1c1cc(C)no1 822163271 GULKDIOIZLHNOJ-WBVHZDCISA-N 320.477 5.033 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CSC(C)(C)C 189868148 TZVBVZGAPPUFJN-UHFFFAOYSA-N 305.487 5.009 30 20 DKED N#CCCC[C@@H](N[C@H]1CCCc2ccc(F)cc21)c1ccccc1 340445562 FIAQUKZPQAPTLP-RTWAWAEBSA-N 322.427 5.228 30 20 DKED CC(C)(C#N)CCCCSc1nc2ccccc2n1C(F)F 436188469 UPJVSAVHSJFJGC-UHFFFAOYSA-N 323.412 5.244 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C#N)s1 486656805 MDBJQSIGPBELMW-UHFFFAOYSA-N 312.438 5.119 30 20 DKED C[C@@H](Sc1cc(C#N)ccn1)c1ccc(Cl)c(Cl)c1 515850278 LXFKTDNERMIVGX-SECBINFHSA-N 309.221 5.113 30 20 DKED C[C@H](Sc1nc2ccc(Cl)cc2o1)c1ccc(C#N)cc1 522823292 YEHBTQRTXOMMSZ-JTQLQIEISA-N 314.797 5.206 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccccc1OC 727806708 AGMIPWAYTSWRNQ-SFHVURJKSA-N 317.473 5.109 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2coc3ccccc23)s1 747705059 KAWKHHYTEGXEFM-HJWRWDBZSA-N 311.406 5.083 30 20 DKED C=CCC[C@H](NCc1nc(Cl)ccc1Cl)c1ccccc1 766853169 QCPGQBPOBAYOEJ-HNNXBMFYSA-N 321.251 5.186 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(C)o1 789719381 ORBXMUCFUWMPLF-OAHLLOKOSA-N 311.425 5.182 30 20 DKED Cc1cc2cc([C@@H](C)NCC3CCC(C#N)CC3)oc2cc1C 442864604 GJXOJMMCTRIFEA-KLAILNCOSA-N 310.441 5.030 30 20 DKED CC(C)[C@@H]1C[C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc21 618569975 LWRDLQUOPOLRAP-ONGXBYRLSA-N 304.437 5.093 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)o1 727264716 VLWMMWAFJRXHFL-GQCTYLIASA-N 314.690 5.156 30 20 DKED CCCCCCCCCC(=O)N1CC[C@@H]1c1cccc(F)c1 742866888 BEDRRKAOHMRRAB-GOSISDBHSA-N 305.437 5.240 30 20 DKED O=C(/C=C\c1csc(Cl)c1Cl)c1ccccc1F 761475300 PCIUYOFDSBWVJZ-WAYWQWQTSA-N 301.169 5.090 30 20 DKED Fc1cc(NN=Cc2cscc2C(F)(F)F)ccc1Cl 811643951 OELBCSQQJIFXCA-UHFFFAOYSA-N 322.714 5.005 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 90664895 KJNOOYKOOUMJMQ-UGSOOPFHSA-N 316.807 5.175 30 20 DKED C=CCC[C@H](NCc1ncc(-c2cccs2)o1)c1ccccc1 180048430 UULRUHSEKIWIBN-INIZCTEOSA-N 324.449 5.200 30 20 DKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 414136151 IQHFITHHOPQZHN-UTKZUKDTSA-N 322.452 5.089 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[S@@](=O)CCC1(C#N)CCCCC1 414238804 KLZJDDBXRHLJCG-QKKBWIMNSA-N 323.889 5.014 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1cccs1 505058620 XVKZUYZSSPFLOA-CQSZACIVSA-N 314.454 5.092 30 20 DKED C=CCC[C@@H](NCc1ccccc1OC(F)F)c1ccccc1 540456177 GFUBWWIAHQJPLR-QGZVFWFLSA-N 317.379 5.085 30 20 DKED CCCCCCC[S@](=O)Cc1csc(C2CCCC2)n1 133173054 QFOJRYQMOMSZJV-HXUWFJFHSA-N 313.532 5.020 30 20 DKED C=CCN(C(=O)Nc1c(C(C)C)cccc1C(C)C)C1CC1 271315924 ATFUPHHEOONLJS-UHFFFAOYSA-N 300.446 5.116 30 20 DKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C2CC2)cc1 419334198 GOPYZFVBXXXKQI-INIZCTEOSA-N 318.464 5.216 30 20 DKED N#CCCC[C@@H](NCC/C=C/c1ccccc1)c1ccccc1 451067467 XCASCRCYLHICPQ-CDDKBXLESA-N 304.437 5.115 30 20 DKED C[C@@H](NCCCCC#N)c1ccc(SC2CCCC2)cc1 482436153 ISENGBNPSZSNNW-OAHLLOKOSA-N 302.487 5.066 30 20 DKED Cc1ccc(C2CC(N[C@H](CCCC#N)c3ccccc3)C2)cc1 519690144 QCVYALNJQAVMHS-LZBANZJXSA-N 318.464 5.266 30 20 DKED CCCC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(OC)cc1 539496769 UMYKQUDNLQZWRS-HRAATJIYSA-N 322.452 5.149 30 20 DKED CCc1ccc(CNc2ccccc2SC[C@H](C)C#N)cc1 600847645 KRVQIXOMQUPEOL-OAHLLOKOSA-N 310.466 5.113 30 20 DKED CCC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 733680660 BAMRQTMUVLFYOH-CVEARBPZSA-N 324.424 5.001 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nc2ccccc2s1 744016359 LPGQSZJHJYDSRF-KGLIPLIRSA-N 314.454 5.079 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 784821240 NWHMLMHMMARINR-NVXWUHKLSA-N 308.425 5.018 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C/c1cnc(-c3ccco3)s1)C2=O 789149530 ZJHRBFWSSZPONE-CDCQXCROSA-N 321.401 5.095 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccccc1Cl 109002258 NTLFTQFFQVVJHQ-ZDUSSCGKSA-N 316.857 5.346 30 20 DKED COc1ccc([C@H](CCC(C)C)NCC(C)(C)CCC#N)cc1 558238723 JCVQXOVXJVHADL-IBGZPJMESA-N 316.489 5.092 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2cccs2)cc1 559888992 XOEJPJINSXBYPL-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)c(F)c1 560907962 DCKAVGMAQGIMPW-ACJLOTCBSA-N 316.807 5.175 30 20 DKED CC[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)s1 618802367 JBHWOGTVGPIAGP-GJZGRUSLSA-N 316.857 5.001 30 20 DKED Cc1ccc2cc(C(=O)/C=C\c3cccc4cnccc34)oc2c1 754828139 FKPUPBAVOCKOQD-FPLPWBNLSA-N 313.356 5.186 30 20 DKED Cc1nc(C(C)C)sc1[C@H](C)Nc1ccc(CCC#N)cc1 903297673 IVGNKUXMPXAYNM-ZDUSSCGKSA-N 313.470 5.204 30 20 DKED CC(C)(C#N)CCCNc1ccccc1SCC(F)(F)F 133657600 XJNCDRCPQXFVDF-UHFFFAOYSA-N 316.392 5.083 30 20 DKED C[C@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1F 512668848 WVUXABQPJCWRHO-QWHCGFSZSA-N 324.424 5.324 30 20 DKED CCOc1ccccc1[C@@H](CC(C)C)NCCCC(C)(C)C#N 540426531 GMRGNCZXIAJNEJ-GOSISDBHSA-N 316.489 5.092 30 20 DKED Cc1ccc2cc(C(=O)/C=C\c3ccc4cnccc4c3)oc2c1 782354265 LLMKYTZJKTURDT-DAXSKMNVSA-N 313.356 5.186 30 20 DKED FC(F)C1CCC(=NNc2ccnc3cc(Cl)ccc23)CC1 799465210 DNJZUQITQYWNSF-UHFFFAOYSA-N 323.774 5.111 30 20 DKED C=CCC[C@@H](N[C@@H]1CCc2nc(Cl)ccc21)c1ccccc1 806149296 RJLLGEXRSAQTKU-IAGOWNOFSA-N 312.844 5.019 30 20 DKED CCC/C(C)=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 920221018 KCFADUKTTMPCQW-FZWACIFYSA-N 318.420 5.027 30 20 DKED CCC[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 25437522 ZJHLNQRLAHTEIR-LJQANCHMSA-N 320.436 5.010 30 20 DKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccco1 33936497 HIMBINHOUAYCOC-CLFYSBASSA-N 321.357 5.045 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CC[C@@H](C)C1 429624113 SOLCVZMESIANGR-WBVHZDCISA-N 314.473 5.191 30 20 DKED CCC(C)(C)OCc1ccccc1NC1CCC(C)(C#N)CC1 449236402 JYMSOCMBYDHINT-UHFFFAOYSA-N 314.473 5.276 30 20 DKED C[C@@H](Sc1ncc(C#N)cc1Cl)c1ccc(Cl)cc1 513623166 CSBUEEQUBOMCKV-SECBINFHSA-N 309.221 5.113 30 20 DKED COc1ccccc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(C#N)cc1 538392997 GDISCAGFAGLZJZ-OXJNMPFZSA-N 322.452 5.005 30 20 DKED N#CCc1ccc(NCc2cc(C(F)(F)F)ccc2Cl)cc1 546780270 LKGRONXYLDMQHX-UHFFFAOYSA-N 324.733 5.037 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 747193618 KTXUGNKRJYJXOF-GJZGRUSLSA-N 318.486 5.049 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1cccc(F)c1 789718408 GXZWHKNBVRXZFN-OUKQBFOZSA-N 323.411 5.330 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1O 815636135 PRVRQCGWXYIOCT-PMACEKPBSA-N 322.452 5.177 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(C)c1 189885991 NHQQILBAUZFPNC-UHFFFAOYSA-N 307.437 5.408 30 20 DKED Cc1cc(S[C@@H](C)c2ccc(C#N)cc2)nc2ccccc12 303654012 BVLNSRVNBGCVAC-AWEZNQCLSA-N 304.418 5.268 30 20 DKED C[C@H](Sc1cccc(Br)c1)c1ccc(C#N)cc1 303718793 RHEBPWXCCBDHHC-NSHDSACASA-N 318.239 5.174 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 329550544 CQVQYPNTYWJJIB-BZUAXINKSA-N 323.440 5.271 30 20 DKED CC[C@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 447522958 RNUZBWDZKUECSK-AOMKIAJQSA-N 314.432 5.513 30 20 DKED CC1(C#N)CCC(N[C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1 449773288 MQNWFXSKBSXQFB-IZIZEDOESA-N 316.876 5.038 30 20 DKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2o1 584486581 KXNZGIRZTKVOMQ-KUHUBIRLSA-N 316.404 5.033 30 20 DKED C[C@H](Nc1cc(C#N)c2ccccc2n1)c1cc2ccccc2o1 609890552 JCWDATBPHWXNCM-ZDUSSCGKSA-N 313.360 5.026 30 20 DKED CCCCCCCC(=O)N(C)[C@H](c1ccccc1)C(F)(F)F 728499876 YVMURHXHKNJPKQ-MRXNPFEDSA-N 315.379 5.109 30 20 DKED CCOc1cccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 815635545 FDRVTAPPFBTLGU-UTKZUKDTSA-N 322.452 5.171 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCCCCC(F)(F)F 151924692 MPHBVOPCGDJHOL-LBPRGKRZSA-N 316.392 5.225 30 20 DKED CCCCC[C@H](C)CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 742575303 DRCDQJNDJYXBTM-IRXDYDNUSA-N 314.473 5.074 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H]2CCCCC2(C)C)n1 752513573 VEKYWZSPFMIWNB-KGLIPLIRSA-N 318.486 5.049 30 20 DKED Cc1ccc2cc([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc2c1 425929041 LZHKBOXLNHJBDM-GJZGRUSLSA-N 304.393 5.025 30 20 DKED C=CCCCCCN(C)C(=O)Nc1c(Cl)ccc(C)c1C 434490790 ZVFUAEOZJFIEMP-UHFFFAOYSA-N 308.853 5.167 30 20 DKED N#CC1CCC(CN[C@H]2CCCC[C@@H](c3ccccc3)C2)CC1 441377820 GRXAYKYIZYZFGU-FMFRFZGHSA-N 310.485 5.022 30 20 DKED CC[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccc(C#N)cc1 447528943 IXSSLGFVBGGQAK-NHCUHLMSSA-N 322.427 5.279 30 20 DKED N#CC1(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)CCCC1 471443609 XQIYMLRDTZPQJJ-UHFFFAOYSA-N 324.811 5.029 30 20 DKED Cc1csc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3)c2)n1 539735130 PEMJTWKMZGBPBD-CQSZACIVSA-N 319.433 5.163 30 20 DKED C[C@H](NN=Cc1sc2ccccc2c1Cl)c1ccccc1 920383657 XZMZAGCLCJXAIV-LBPRGKRZSA-N 314.841 5.239 30 20 DKED N#CCC[C@@H](NCc1ccc(Cl)cc1Cl)c1ccccc1 130606983 NTDIKKCZIHYROD-QGZVFWFLSA-N 319.235 5.128 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1cc(Cl)ccc1Cl 444670995 CGLWIGKEJBXKEW-LBPRGKRZSA-N 313.272 5.364 30 20 DKED C=C[C@](C)(CC)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 468012582 WMVIRWKXCCKTGS-LJQANCHMSA-N 312.413 5.006 30 20 DKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cccc2ccccc12 560260931 FBFQHVZNFFTVDK-INIZCTEOSA-N 312.416 5.051 30 20 DKED C[C@@H]1CC[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340450315 XCKMQWNCMOBDBP-WTNAPCKOSA-N 318.464 5.650 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1cc2ccccc2s1 444678345 WIJFMTAKFQLAAF-AWEZNQCLSA-N 300.471 5.272 30 20 DKED Cc1ccc(CCNc2ccccc2S[C@@H](C)CC#N)cc1 486055509 ZNXMZMZOPDOKFE-INIZCTEOSA-N 310.466 5.044 30 20 DKED C[C@@H](Nc1ccc2nc(C3CC3)sc2c1)c1cccc(C#N)c1 537534470 WKZYQLBIWQOFMF-GFCCVEGCSA-N 319.433 5.218 30 20 DKED C[C@@H](N[C@@H](c1cccc(F)c1)C1CCCC1)c1cccc(C#N)c1 538393156 HJXJATIGQQMPJD-QVKFZJNVSA-N 322.427 5.279 30 20 DKED C[C@@H](Nc1ccc(-c2ccco2)cc1F)c1cccc(C#N)c1 600848293 DFWZGKIXRRTMLA-CYBMUJFWSA-N 306.340 5.130 30 20 DKED Cc1cc(F)ccc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 731322473 ZWJDLAKBSIGTEL-CSKARUKUSA-N 323.392 5.154 30 20 DKED COc1cc(C(=O)/C=C/c2sccc2Cl)ccc1SC 782330374 YXCXLSWDAATQSM-GQCTYLIASA-N 324.854 5.028 30 20 DKED C=C[C@H](CC(=O)N1CCCCC[C@H]1c1ccco1)c1ccccc1 135275398 ZZFMWEOUHJACJH-MJGOQNOKSA-N 323.436 5.083 30 20 DKED Cc1c([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)oc2ccccc12 178176787 JQDTVNLYJCSVIM-LSDHHAIUSA-N 304.393 5.025 30 20 DKED CC(C)c1ccc(NC(=O)c2cc(C#N)cs2)c(C(C)C)c1 437674855 NEXCYNXIHWNMNS-UHFFFAOYSA-N 312.438 5.119 30 20 DKED C[C@@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)c(F)c1 539604168 IHNCVYLCXOSKFA-HUUCEWRRSA-N 318.395 5.262 30 20 DKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(-c2cccs2)c1 665927465 JJSPSZUDLKBEHZ-CALCHBBNSA-N 324.449 5.130 30 20 DKED CCCCCC1=CCCC1=NNc1cccc(C(F)(F)F)n1 739421686 OZCYTHHESOMOCL-UHFFFAOYSA-N 311.351 5.169 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 766018911 JQHFVCSFGAQQNM-SJKOYZFVSA-N 321.251 5.356 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1nccc2ccccc12 792104118 WUZFYNDFOBCTGL-CRAIPNDOSA-N 308.425 5.018 30 20 DKED C=CCC[C@H](Nc1ccc(OC(F)F)c(OC)c1)c1ccco1 850560668 GZUSTOSKIYSJOG-ZDUSSCGKSA-N 323.339 5.009 30 20 DKED N#Cc1cccc(CSCc2ccc(C(F)F)cc2)c1F 460768949 NAMYNGADPQWNNO-UHFFFAOYSA-N 307.340 5.068 30 20 DKED CC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1cccs1 481667671 HCQFXYGITFCIGC-ROUUACIJSA-N 310.466 5.128 30 20 DKED CC(C)(CCC#N)CNc1cccc(-c2ccc3c(c2)CCO3)c1 500733286 PUQFFTQBKGKPFS-UHFFFAOYSA-N 320.436 5.030 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](C)c1cc(Cl)ccc1Cl 614406821 ALBISMOFJAIKOA-GFCCVEGCSA-N 319.235 5.024 30 20 DKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1ccc2ccccc2c1 742429345 MNTFLYLSWOQLMM-OUKQBFOZSA-N 324.383 5.126 30 20 DKED CCC(=NNc1nc2cc(C(F)(F)F)ccc2s1)C(C)C 743445265 MGDWBYRCOPFQDZ-UHFFFAOYSA-N 315.364 5.149 30 20 DKED CC1(C)CCC[C@@H](CC(=O)[C@H](C#N)c2ccc3ccccc3n2)C1 756518989 LNORBECQCDVTKN-DOTOQJQBSA-N 320.436 5.018 30 20 DKED C#CC[C@@H](N[C@H]1CCSc2cc(C)c(C)cc21)c1ccccc1 779039160 QFCXGFZCGLQSEG-UXHICEINSA-N 321.489 5.195 30 20 DKED CCCCCCCCC(=O)N(C)c1nc2ccccc2s1 918560839 ZJHMFBKVWMWXIR-UHFFFAOYSA-N 304.459 5.010 30 20 DKED C=CCCCCCSc1nnc(-c2c[nH]c3ccccc23)o1 447301357 JTMAQLHFCMULSH-UHFFFAOYSA-N 313.426 5.056 30 20 DKED CC[C@H](Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccc(C#N)cc1 447596642 QPNSOZNJYSLZIT-KSSFIOAISA-N 322.456 5.166 30 20 DKED C=C(C)[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 479416421 YMBSLPSSLREDFD-ODYMNIRHSA-N 317.379 5.088 30 20 DKED CC(C)(C#N)CCCSCc1ccc(Cl)c2cccnc12 480418770 HZQJFFRSTBROJC-UHFFFAOYSA-N 318.873 5.451 30 20 DKED N#Cc1ccccc1-c1ccc(CSC[C@H]2CCCCO2)cc1 517284062 DSTDJJFCONAPHV-LJQANCHMSA-N 323.461 5.028 30 20 DKED CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccccc2CC#N)cc1 573284046 KDXXLNYVEWGWOL-INIZCTEOSA-N 320.436 5.008 30 20 DKED C[C@H](Sc1ccc(C#N)cn1)c1ccc(Cl)cc1Cl 603946567 JYAYHXDTZGLYJC-VIFPVBQESA-N 309.221 5.113 30 20 DKED CC(C)c1ccc2c(Cl)c(C(=O)OCCCC#N)sc2c1 732684392 JXRAIFOJZRIWBD-UHFFFAOYSA-N 321.829 5.139 30 20 DKED Cc1ccsc1C(=O)/C=C/c1csc(-c2cccs2)n1 733749646 RNOSQNQCRYOBHG-SNAWJCMRSA-N 317.460 5.138 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1cc2ccccc2o1 760265485 SHTOLLWXZNFLMX-HJWRWDBZSA-N 309.390 5.053 30 20 DKED Cc1c(C(=O)/C=C\c2ccc3cnccc3c2)oc2ccccc12 782315433 VYVZFGHUYLPHIR-CLFYSBASSA-N 313.356 5.186 30 20 DKED C=CCC[C@H](N[C@@H]1CCc2nc(Cl)ccc21)c1ccccc1 806149271 RJLLGEXRSAQTKU-DLBZAZTESA-N 312.844 5.019 30 20 DKED C=CCC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)c1ccccc1 90580751 KIIAPOVPBGRLHD-IERDGZPVSA-N 322.452 5.003 30 20 DKED Cc1cc(C#N)ccc1C(=O)Nc1c(C(C)C)cccc1C(C)C 162390752 AWTZOTJSYACLIY-UHFFFAOYSA-N 320.436 5.366 30 20 DKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H]1CCC[C@H](C#N)C1 463281504 KXGJURALLNTYJT-FHWLQOOXSA-N 324.493 5.012 30 20 DKED C=C[C@@H](CC(=O)Nc1ccccc1NC(C)(C)C)c1ccccc1 466455821 OHTQUJLUUFSTPY-INIZCTEOSA-N 322.452 5.195 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)c1ccc(C#N)cc1 540525309 SWGGRRHXRADVFD-AFHBHXEDSA-N 324.855 5.260 30 20 DKED CCC(CC)[C@H](NCc1ccc(CC#N)cc1)c1cccs1 541325504 AHDSOKYVNHKUNN-IBGZPJMESA-N 312.482 5.081 30 20 DKED C=C[C@H](CC(=O)N1CCCC[C@H]1c1ccccc1)c1ccccc1 545969101 DPKWMKQBXJBXCN-NQIIRXRSSA-N 319.448 5.100 30 20 DKED C=CCN(CC=C)C(=O)Nc1cccc(Sc2ccccc2)c1 594910702 BQZHZZRJWFNJOV-UHFFFAOYSA-N 324.449 5.044 30 20 DKED C[C@@H](Nc1ccccc1CCC(F)(F)F)c1cccc(C#N)c1 611475538 QSTXOSTUDDZUDB-CYBMUJFWSA-N 318.342 5.226 30 20 DKED Cc1cc2c(cc1C)[C@H](N[C@@H](C)c1cccc(C#N)c1)CCS2 614633867 JECXHNGSPQVNFI-HNAYVOBHSA-N 322.477 5.063 30 20 DKED CC(/C=C\C1=C(C)CCCC1(C)C)=NNc1nccnc1Cl 733079665 PPFOXMRJRRYJBQ-IRUSHPATSA-N 318.852 5.001 30 20 DKED CC(C)OCc1ccc(N=Cc2c(O)ccc3ccccc23)cc1 920178471 RIZRCNZSNIBZPR-UHFFFAOYSA-N 319.404 5.221 30 20 DKED C[C@H](CC#N)Sc1ccccc1NC[C@@H]1C[C@H]1c1ccccc1 461754823 QGYCPOOHBWGFLJ-NJAFHUGGSA-N 322.477 5.296 30 20 DKED CC[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1cccs1 507629915 LZMRVFSWWMFXJS-QPIRBTGLSA-N 324.493 5.193 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512625783 QMDQPIWONFCKGW-CABCVRRESA-N 310.416 5.233 30 20 DKED Cc1cc(C)c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1C 577634386 PONOLNLNSWRPIQ-KNQAVFIVSA-N 320.480 5.698 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1 610830406 QSQCFSLSTRJAMU-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C#CC[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccccc1 773116171 QDRAYGBFHYTTQH-KBXCAEBGSA-N 317.354 5.121 30 20 DKED CC(=NNc1ncc(Cl)cc1Cl)C1CCC(F)(F)CC1 788702060 CJHFCPYYLUTCLK-UHFFFAOYSA-N 322.186 5.002 30 20 DKED CCCCC[C@@H](C(=O)[C@H](C#N)c1nccc2ccccc12)C(C)C 792089856 AQOXQYTTWUAPHM-IEBWSBKVSA-N 322.452 5.264 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C(\C)c1ccco1 834314460 MUJMMEGDQBWHSH-FYWRMAATSA-N 309.409 5.174 30 20 DKED Cc1c(Cl)cccc1NN=Cc1ccccc1C(F)(F)F 915051415 TXOKXPGWFPDNFQ-UHFFFAOYSA-N 312.722 5.113 30 20 DKED N#Cc1ccccc1CNc1ccccc1Oc1cccc(F)c1 60458496 KYCNPZWCYMGZQC-UHFFFAOYSA-N 318.351 5.102 30 20 DKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 181724859 YGJHBQBTJIODSE-ZIAGYGMSSA-N 306.434 5.185 30 20 DKED CC(C)(C)[C@@H](NCCCCC#N)c1cccc(C(F)(F)F)c1 181971211 RWISDMGFBQMLMR-HNNXBMFYSA-N 312.379 5.076 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(Cl)cc1Cl 235506718 WMLPZYGMHLSUMV-LBPRGKRZSA-N 313.272 5.364 30 20 DKED CC(C)(C#N)c1ccc(CNc2cccc(C(F)F)c2)cc1 614056206 JJNXIEKFDCJEGN-UHFFFAOYSA-N 300.352 5.037 30 20 DKED C#Cc1cccc(N(CC)C(=S)Nc2ccc(C(C)C)cc2)c1 728447600 JHYPNFMMVRSJRA-UHFFFAOYSA-N 322.477 5.015 30 20 DKED CCC[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 341752983 ZOGPTDQNHIIPBN-NHCUHLMSSA-N 304.437 5.067 30 20 DKED C=C(C)CCSCCCC(=O)Nc1c(C)cc(C)cc1C 507082635 REQPGRBOFLIAEF-UHFFFAOYSA-N 305.487 5.030 30 20 DKED C=CCC[C@H](Nc1cccc(CC(F)(F)F)c1)c1ccco1 552282340 BRQJRCXSZYERQG-HNNXBMFYSA-N 309.331 5.504 30 20 DKED CC[C@@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(Cl)cc1 579552701 WTZVMJIGVXVMNI-RTBURBONSA-N 312.844 5.404 30 20 DKED C[C@@H](SCc1ccnc(C#N)c1)c1ccc2ccccc2c1 610954198 HAEAWVARGHJIHB-CQSZACIVSA-N 304.418 5.101 30 20 DKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H](c1ccccc1)C1CCC1 611391881 CQEBHJFRZIWCQS-VXKWHMMOSA-N 316.448 5.067 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1cccc(C)c1C 732625131 JUNDIULTAKWFFQ-UHFFFAOYSA-N 316.514 5.069 30 20 DKED CC(C)(C)c1ncc(/C=C2\CCCc3ccccc3C2=O)s1 736430804 IJFBDUANAMTBFD-SDNWHVSQSA-N 311.450 5.043 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1csc2ccccc12 743475612 SZEWQDWHRFRKMG-KGLIPLIRSA-N 306.434 5.185 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H]2CCCCC2(C)C)n1 752513577 VEKYWZSPFMIWNB-ZIAGYGMSSA-N 318.486 5.049 30 20 DKED Cc1ccc(C(=O)/C=C/c2csc3ccccc23)cc1[N+](=O)[O-] 810198304 PBJMSBOWCCVISD-CMDGGOBGSA-N 323.373 5.014 30 20 DKED CC(CCc1ccc(C)cc1)=NNc1nccc2sccc12 920374997 OADZHIAATJTQEG-UHFFFAOYSA-N 309.438 5.025 30 20 DKED CC(C)(C#N)CCCN(Cc1cccs1)Cc1cccs1 174812010 XWTGXQBYBPFXJG-UHFFFAOYSA-N 318.511 5.142 30 20 DKED COc1cc(/C=C\C(=O)c2cc3ccccc3o2)ccc1SC 214922391 DZAMJIJQKBHKDY-CLFYSBASSA-N 324.401 5.059 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2 427865329 NIQSNPDOJKUSPX-LHSJRXKWSA-N 322.427 5.159 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@](C)(CC)C1 475552375 LVHAYJICSIVLRB-HXUWFJFHSA-N 314.473 5.192 30 20 DKED C=CCC(C)(C)C(=O)Nc1cccc(COc2ccccc2)c1C 560135089 MHTBZQZCROQYQY-UHFFFAOYSA-N 323.436 5.115 30 20 DKED O=C(/C=C/c1cccnc1)c1ccc(SC2CCCC2)cc1 914702737 KNMGLVQVFXBZQX-KPKJPENVSA-N 309.434 5.012 30 20 DKED CCC(=NNc1nc(-c2ccccc2)cs1)c1cccs1 916545460 JWSHGIKSBBJEPM-UHFFFAOYSA-N 313.451 5.098 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1ccc[nH]1 918012024 NYDVOMYSVZFJRT-GOSISDBHSA-N 304.478 5.209 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2C1 191443964 WDQABVRVRPVZNB-UHFFFAOYSA-N 320.436 5.086 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)c1cccnc1 356221473 RBNHKUVPUKBVMW-MRXNPFEDSA-N 322.452 5.066 30 20 DKED C=CCCc1ccccc1NC(=O)N1[C@H]2CC[C@H]1c1ccccc12 505001242 QMHFSPBQVIBFKH-PMACEKPBSA-N 318.420 5.229 30 20 DKED C#Cc1ccccc1CC(=O)Nc1c(C(C)C)cccc1C(C)C 812822533 SIIZAJLAOSPWRU-UHFFFAOYSA-N 319.448 5.096 30 20 DKED C=CC[C@@H]1CCN1C(=O)Nc1c(C(C)C)cccc1C(C)C 929142142 NQNCARDIATYNTE-OAHLLOKOSA-N 300.446 5.116 30 20 DKED Cc1ccnc(Oc2cc(NCCCC(C)(C)C#N)ccc2C)c1 154171205 KZZSXUZRPVGIKY-UHFFFAOYSA-N 323.440 5.233 30 20 DKED N#CCCC[C@H](N[C@@H]1CCCc2ccccc21)c1ccccc1 340454885 SUKSMEPDDULGPV-LEWJYISDSA-N 304.437 5.089 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 559859774 OHMVVBXKDGXXSH-KXBFYZLASA-N 312.844 5.426 30 20 DKED CC(C)(C#N)CCSCc1csc(-c2ccsc2)n1 564090081 IPOOBTBHNDGXGX-UHFFFAOYSA-N 308.497 5.045 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 741451962 ZENIIUAGMKRDNV-UHFFFAOYSA-N 323.399 5.407 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C/c1cnc(C3CCC3)s1)C2=O 766695193 HRPVMRMNIGPXNA-DZZSIBQASA-N 309.434 5.102 30 20 DKED CC(C)CC1(C(=O)[C@@H](C#N)c2nccc3ccccc23)CCCC1 792106505 ROJVOJOYFVBJMO-SFHVURJKSA-N 320.436 5.018 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCC(C)(F)F 297697190 HFMQWSRPUKPWQH-UHFFFAOYSA-N 324.415 5.095 30 20 DKED N#C[C@@H]1CCC[C@H](Nc2ccccc2SC2CCCC2)C1 463288676 NQANDYIXSRNJBX-CABCVRRESA-N 300.471 5.216 30 20 DKED COc1cccc2cc(C(=O)/C=C/c3ccc(SC)cc3)oc12 916130562 WZRKHLODMPBWTI-DHZHZOJOSA-N 324.401 5.059 30 20 DKED C[C@@H](Nc1ccc(CC#N)cc1)c1cc(Cl)ccc1Cl 37071322 HHNNLYFPNGQQMK-LLVKDONJSA-N 305.208 5.233 30 20 DKED CCC(CC)(NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 110333379 NFQYJVFYHURHAV-UHFFFAOYSA-N 312.844 5.017 30 20 DKED N#Cc1ccc(N[C@@H](c2ccccc2)c2ccc(F)cc2)c(F)c1 303189204 YWSHRTGKDMWFPM-FQEVSTJZSA-N 320.342 5.038 30 20 DKED Cc1oc2ccccc2c1CNc1cccc(OCCCC#N)c1 325355704 LUSWYDGASFDGBK-UHFFFAOYSA-N 320.392 5.036 30 20 DKED Cc1cc(CNc2ccccc2S[C@H](C)CC#N)c(C)s1 435900147 ZSAIJWJZNAPMGU-GFCCVEGCSA-N 316.495 5.371 30 20 DKED CC[C@H](C)n1ncc(N[C@H](CC)c2ccc(C#N)cc2)c1C1CC1 447596640 QPNSOZNJYSLZIT-KBXCAEBGSA-N 322.456 5.166 30 20 DKED C=C(C)[C@@H](NCc1ccc(C(F)F)cc1)c1ccc(F)c(F)c1 474925656 FPLMHQXMQBLJKC-QGZVFWFLSA-N 323.333 5.309 30 20 DKED CCC(CC)[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccs1 539498704 QAOWSTHZASCNAM-KUHUBIRLSA-N 312.482 5.448 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cccc(Cl)c1Cl 606935308 RUSZRVGMJGPEKM-UHFFFAOYSA-N 315.244 5.204 30 20 DKED CCC(C)(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 608847743 CCCGHYFZIGEGCA-UHFFFAOYSA-N 322.408 5.034 30 20 DKED C[C@H](c1ccc(Cl)cc1)[S@@](=O)CCCCC1(C#N)CCC1 899276069 HYBNHWNWZOKJHL-SZNDQCEHSA-N 323.889 5.014 30 20 DKED CC(C)(C#N)CCCN1Cc2ccccc2C[C@@H]1c1ccccc1 472227107 UXSUWSWGOHDWBY-OAQYLSRUSA-N 318.464 5.116 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc2c(c1)CCC2 486051769 LSEPWSIKQSBWNL-HNNXBMFYSA-N 322.477 5.182 30 20 DKED C=CC[C@@H](C(=O)Nc1cccc(SC)c1C)c1ccccc1 489652769 JJQKEDADLXADDG-MRXNPFEDSA-N 311.450 5.015 30 20 DKED C[C@H](N[C@@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 541176030 OTBOZNDPBIFHNC-HOTGVXAUSA-N 316.404 5.230 30 20 DKED C[C@H](NCc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 543877334 YBADFECZIDQDBC-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CC(C)(C#N)CCCCSCc1ccc(C(F)(F)F)cn1 559953540 CGAMFRCCINOHRP-UHFFFAOYSA-N 316.392 5.054 30 20 DKED C=C(CN[C@@H](C)[C@H](C)c1nc2ccccc2s1)c1ccccc1 675783601 MBOAAGDVPGMTIF-HOTGVXAUSA-N 322.477 5.091 30 20 DKED C=CCC[C@H](N[C@@H](C)c1nc(C)sc1C)c1ccccc1 678602220 BBSMOMZFPMSBGF-GUYCJALGSA-N 300.471 5.118 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(CCCC)cc1)c1ccncc1 766018058 FRDBZSGMHCWNQI-DYESRHJHSA-N 308.469 5.392 30 20 DKED N#Cc1cccc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)c1 834766793 YZKHVTLSIVSNID-CSKARUKUSA-N 323.351 5.354 30 20 DKED N#CCC[C@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1 130595331 CXQYCCPZHPYOIP-KRWDZBQOSA-N 319.235 5.128 30 20 DKED Cc1cc([C@H](C)NCc2ccccc2C(C)(C)C#N)c(C)s1 182982025 MFVTVJXIBOUPES-AWEZNQCLSA-N 312.482 5.017 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2ccccc2s1 188258724 FLEYJYQVBIGNFF-MAUKXSAKSA-N 320.461 5.597 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccc(CC)o1)c1ccc(F)c(F)c1 480691478 BVKLICGZAMZAIZ-XIKOKIGWSA-N 305.368 5.088 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(Cl)c1 512621516 YWHQPUMWTNUFFW-KZULUSFZSA-N 316.807 5.153 30 20 DKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2o1 584486582 KXNZGIRZTKVOMQ-LIRRHRJNSA-N 316.404 5.033 30 20 DKED CC(C)c1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619746880 PWSGEQYZMZOUMV-AWEZNQCLSA-N 312.844 5.186 30 20 DKED N#Cc1cc(/C=C(\Cl)c2nc3ccccc3s2)ccc1F 756263064 UUFFQCUDPUAETM-WQLSENKSSA-N 314.772 5.044 30 20 DKED Cc1cnc([C@H](C)/N=C(/O)C2(C3CCCCC3)CCCCC2)o1 329434931 LIKHQHMMGWTDSZ-HNNXBMFYSA-N 318.461 5.531 30 20 DKED CC[C@](C)(/N=C(/O)c1cc(C(C)C)oc1C)c1nc(C)cs1 330612462 QFCOEVKJUFLRTL-KRWDZBQOSA-N 320.458 5.106 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CC[C@H](C)C1 429624111 SOLCVZMESIANGR-RDJZCZTQSA-N 314.473 5.191 30 20 DKED C[C@H](c1ccc(CNc2cccc(CC#N)c2)cc1)C(F)(F)F 453135448 AQSBRJVMJQBEAB-CYBMUJFWSA-N 318.342 5.031 30 20 DKED Cc1c([C@@H](C)Nc2c(F)cc(C#N)cc2F)oc2ccccc12 500490221 LFWDDIVQZLYDKZ-LLVKDONJSA-N 312.319 5.064 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccccc1 512659677 JECHBTBVCMLGMV-YWZLYKJASA-N 308.400 5.055 30 20 DKED N#CCCC[C@H](NCc1ccc(C2CCC2)cc1)c1ccccc1 555586903 KLPBKAIXIBNEAX-QFIPXVFZSA-N 318.464 5.479 30 20 DKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cc2ccccc2o1 614184845 AFIUQKAGHNSIHR-HNNXBMFYSA-N 318.420 5.085 30 20 DKED Cc1ccccc1C(=O)/C=C/c1csc(-c2ccccc2)n1 916155835 FLILYEMYGAIKSA-VAWYXSNFSA-N 305.402 5.015 30 20 DKED CCCCCC(CCCCC)=NNc1cccc(C(=O)O)c1C 1776087320 UZMNUZANZFXOKT-UHFFFAOYSA-N 318.461 5.622 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747193619 KTXUGNKRJYJXOF-HUUCEWRRSA-N 318.486 5.049 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)cs1 759337275 IKGAVKUVIRSWNJ-UHFFFAOYSA-N 319.857 5.506 30 20 DKED C=CCN(C(=S)Nc1c(C(C)C)cccc1C(C)C)C1CC1 771541330 FQUQLSQQLBSXDD-UHFFFAOYSA-N 316.514 5.281 30 20 DKED CC(C)c1ccc([C@H](C)Nc2ccc(F)cc2OCC#N)cc1 783697128 XNFJXYHLHBWLLL-AWEZNQCLSA-N 312.388 5.025 30 20 DKED O=C(/C=C/c1ccc(Cl)s1)c1ccc(F)c(Cl)c1 111170727 IQCMCSVQHXDQLR-GORDUTHDSA-N 301.169 5.090 30 20 DKED Cc1nc(C2CC2)oc1/C(O)=N/C1CCC2(CCCCC2)CC1 329941691 GUFFYKCINQAYME-UHFFFAOYSA-N 316.445 5.058 30 20 DKED CC(C)c1ccc([C@H](N[C@@H]2CC[C@H](C#N)C2)c2cccs2)cc1 442647976 LLEGDUPFAHNLCW-CVAIRZPRSA-N 324.493 5.243 30 20 DKED N#CCCCCN1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1 446711058 JOGULUWCTLDXQQ-HXUWFJFHSA-N 324.855 5.133 30 20 DKED CCCCCCCC(=O)Nc1ccccc1S[C@H](C)CC#N 731333396 ZXLHTQUKOGFIKW-OAHLLOKOSA-N 318.486 5.380 30 20 DKED C#Cc1cccc(NC(=O)N(CCC)[C@H](CC)c2ccccc2)c1 746658100 BBUMCPQRHASUSW-HXUWFJFHSA-N 320.436 5.063 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@@]2(C)[C@H](C1)C2(F)F 816786869 OXHFGNASNYHWQW-RDJZCZTQSA-N 315.448 5.021 30 20 DKED Cc1ccc2nc(/C=C/c3ccc(O[C@@H](C)C#N)cc3)ccc2c1 110967433 JWHVUCIFJXERBK-YCOJEUHLSA-N 314.388 5.005 30 20 DKED C=CCOc1ccc(CN[C@@H](CC)c2cccc(Cl)c2)cc1 315457196 NLBPSTZCFCAPHF-IBGZPJMESA-N 315.844 5.146 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc21 447539383 ADOABYMEPJYDPZ-JHVJFLLYSA-N 304.437 5.093 30 20 DKED C=CCC[C@@H](NCc1ccc(C(C)(F)F)cc1)c1ccco1 559876002 CZMVZKUUVJVSDG-MRXNPFEDSA-N 305.368 5.188 30 20 DKED C[C@H](CC#N)Sc1ccccc1NC[C@H]1CCCCC1(F)F 594704308 ADVBMCYUWAOXJV-ZIAGYGMSSA-N 324.440 5.318 30 20 DKED Cc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1C(F)(F)F 600850410 APYQBHFKLCWIPQ-GFCCVEGCSA-N 304.315 5.059 30 20 DKED C[C@@H](S[C@H](C#N)Cc1ccccc1)c1ccc(Cl)cc1 604485848 VXMITCZOSUXRLY-DYVFJYSZSA-N 301.842 5.269 30 20 DKED Cc1ccc2cc([C@@H](C)NCc3ccc(C#N)c(Cl)c3)oc2c1 619755743 RADSUEFFZCLOGS-CYBMUJFWSA-N 324.811 5.117 30 20 DKED CCc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)s1 741474625 XRRYKFLMJAKMNB-HJWRWDBZSA-N 319.429 5.269 30 20 DKED O=C1/C(=C/c2cccc(-c3cccnc3)c2)CCc2sccc21 768490802 SEQUNWMRSSLOMX-FOWTUZBSSA-N 317.413 5.023 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C2CC2)c1 340445485 DUDDDBYHASELKJ-JTSKRJEESA-N 318.464 5.650 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccccc1SCC=C 410345363 AJZGIJFURQNDHA-UHFFFAOYSA-N 323.461 5.336 30 20 DKED Cc1nc2cc(Cl)c(NCCCC(C)(C)C#N)cc2s1 530372874 DNZPXGUNGRJMFK-UHFFFAOYSA-N 307.850 5.000 30 20 DKED CCCCCC[C@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 741900868 XKEQDYHKSLKUEF-DLBZAZTESA-N 314.473 5.074 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccccc3F)s2)cc1 757475272 REIKUDBFWONRSZ-ZHACJKMWSA-N 323.392 5.154 30 20 DKED C[C@H](C=NNc1ccc(Cl)c(C(=O)O)c1)CC1CCCCC1 1776033614 IMBDEEXBEIRXTQ-LBPRGKRZSA-N 322.836 5.042 30 20 DKED CC(C)(C#N)CCCCN[C@H](c1ccc(Cl)cc1)C1CC1 444674097 JZBIVVDSVKBKIB-KRWDZBQOSA-N 304.865 5.101 30 20 DKED Cc1ccc(-c2cccnc2)cc1N[C@@H](C)c1cccc(C#N)c1 479823710 RIJSGTINCCCKRF-INIZCTEOSA-N 313.404 5.102 30 20 DKED CCCC[C@H](CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 521734345 MFNSGKGVMQUXOA-GJZGRUSLSA-N 318.486 5.093 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc2c(c1)COC2)c1ccccc1 539046383 DUHZYCUGEFSYKT-IERDGZPVSA-N 307.437 5.075 30 20 DKED O=C(/C=C\c1ccc(Cl)cc1)c1cccc(-c2ccncc2)c1 741471596 BOBKWRFJTWIACR-TWGQIWQCSA-N 319.791 5.298 30 20 DKED C[C@@H](Nc1ccc(OC2CCCCC2)cc1)c1ccc(C#N)cc1 743476077 DBKXGYCTSJKXFN-MRXNPFEDSA-N 320.436 5.443 30 20 DKED O=C1/C(=C\c2cnc(C3CCC3)s2)[C@@H]2CCCc3cccc1c32 763288672 IPPCUHTWRHTZMV-HAKPAVFJSA-N 321.445 5.110 30 20 DKED CCC[C@H](C=NOc1ccccc1C(F)(F)F)c1ccccc1 769584883 JYNNLAKEMWMEKA-OAHLLOKOSA-N 321.342 5.654 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1cc(C)no1 917172808 BXGPIZOTKJNHTD-QGZVFWFLSA-N 320.477 5.177 30 20 DKED O=C(/C=C/c1ccc(F)c(F)c1)c1cccc(Cl)c1Cl 734981929 ZMEPCWWPJIBSCT-FNORWQNLSA-N 313.130 5.168 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(Cl)ccc1Cl 410351274 GNUPCECDKOUMRB-UHFFFAOYSA-N 320.219 5.364 30 20 DKED CC(C)(C#N)CCCCN[C@H](c1ccccc1)c1ccc(F)cc1 444668612 VXAVBZFFKAJGAZ-HXUWFJFHSA-N 324.443 5.225 30 20 DKED C=C(C)[C@@H](NCc1ccc2occc2c1)c1ccc(F)c(F)c1 511913164 VXUQRWDYIMPRMZ-LJQANCHMSA-N 313.347 5.118 30 20 DKED C=CCC[C@@H](NCc1ccc(OCC)c(Cl)c1)c1ccco1 560538495 SEROYKDWGRHVCV-MRXNPFEDSA-N 319.832 5.129 30 20 DKED C(=Nn1cnc2ccccc21)c1c2ccccc2cc2ccccc12 725848548 WZACDDLDCGKKBB-UHFFFAOYSA-N 321.383 5.225 30 20 DKED Cc1cc2ccccc2nc1NN=C1CCC[C@H](C(F)(F)F)C1 783522743 ZTUALNBFVPGNSC-ZDUSSCGKSA-N 321.346 5.064 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C2CC2)c1 340308470 FHGRQGRDNQXTNL-IERDGZPVSA-N 304.437 5.260 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccncc1Cl)c1ccccc1 421831312 DSGGGRZEOMSRCU-KDOFPFPSSA-N 300.833 5.093 30 20 DKED C=CCC[C@H](NCc1ncc(Cl)cc1Cl)c1ccccc1 538628624 NWGAMULJIALTFL-INIZCTEOSA-N 321.251 5.186 30 20 DKED CC(C)[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 565568338 BOBHVZBITFNWSL-WOJBJXKFSA-N 324.855 5.186 30 20 DKED CC(C)c1ccc([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618802070 FNJSWFIARHUGTP-YCRPNKLZSA-N 304.437 5.020 30 20 DKED CCSc1ccccc1[C@H](C)N[C@H]1CCc2cc(C#N)ccc21 618807753 WHLOPGPBXMESGG-LIRRHRJNSA-N 322.477 5.008 30 20 DKED Cc1ccsc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 733749784 YTDBBZPZDHDEHV-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C=CC[C@@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccncc1 766022859 YDBSZLIZXSXINC-SJKOYZFVSA-N 321.251 5.356 30 20 DKED CC(C)(C#N)CCCNc1ccc([C@@H](F)C(F)(F)F)cc1 902132168 YTURDIYMIQTCHY-CYBMUJFWSA-N 302.315 5.001 30 20 DKED CCc1ccccc1NN=C(C)c1sc(C(C)(C)C)nc1C 915112131 VOENEKKJNRCJOD-UHFFFAOYSA-N 315.486 5.148 30 20 DKED Cc1nc2cc(Cl)c(NCC(C)(C)CCC#N)cc2s1 360772754 OJOXWLADFQEQIY-UHFFFAOYSA-N 307.850 5.000 30 20 DKED CC[C@@H](CSc1ccc(Cl)cc1)NCC(C)(C)CCC#N 554364774 NBCCYBBKIYMREE-HNNXBMFYSA-N 324.921 5.130 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(OC(C)C)cc1)c1ccc(C#N)cc1 584699846 MKUBFCBPGPNBHI-KKSFZXQISA-N 322.452 5.147 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(SC)c1 632750606 LLKUETCUHNHDMF-UHFFFAOYSA-N 315.438 5.106 30 20 DKED CC(C)Oc1ccc(/C=C/C(=O)c2ccccc2Cl)cc1 733081201 QSMMIZNBLDSPKU-FMIVXFBMSA-N 300.785 5.023 30 20 DKED CCCCCCCCCN(C)C(=O)c1nccc2ccccc12 748836987 DJKZIPSKNIHDCC-UHFFFAOYSA-N 312.457 5.057 30 20 DKED COc1cc(C(=O)/C=C/c2cc3ccccc3o2)ccc1SC 750907800 BMHHIGYKTOPEHS-CMDGGOBGSA-N 324.401 5.059 30 20 DKED Cc1nc(-c2ccc([C@@H](C)/N=C\c3ccccc3O)cc2)cs1 783254897 OFVDWVZEOIZCKT-RBFBNPFJSA-N 322.433 5.004 30 20 DKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1nc(C(C)C)cs1 784877375 AVACIAWSMNKEOH-KBPBESRZSA-N 306.475 5.049 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccccc1 191386063 KGPJINPKRWEOMW-JXFKEZNVSA-N 311.473 5.131 30 20 DKED C[C@H](NC1CCC(C)(C#N)CC1)c1cccc(Cl)c1Cl 449156742 OSJRPEVFDFJGLX-FZWSLVFFSA-N 311.256 5.116 30 20 DKED Cc1c(COC(C)(C)C)cccc1NCC(C)(C)CCC#N 537718829 WSHBNFMHRVCVIA-UHFFFAOYSA-N 302.462 5.052 30 20 DKED N#CCCC[C@@H](NC1CC(c2ccc(F)cc2)C1)c1ccccc1 559864623 OZOUCLFABNVPPQ-DQVLVPHSSA-N 322.427 5.096 30 20 DKED C=CCCCCCN(C)C(=O)c1sccc1-c1ccccc1 606814838 SXCFQZVGIYDCEF-UHFFFAOYSA-N 313.466 5.234 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 776092261 ASGNSUZGKUSYER-ZIAGYGMSSA-N 306.475 5.049 30 20 DKED CC(C)(C)c1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 25438114 AIVADGPPRGPIOJ-UHFFFAOYSA-N 320.436 5.038 30 20 DKED N#Cc1csc(CNc2cccc(Oc3ccccc3)c2)c1 237850353 YSBYKCKPWSMXDF-UHFFFAOYSA-N 306.390 5.024 30 20 DKED CCOc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 340445167 LKROZEBFMSQLCU-UWJYYQICSA-N 322.452 5.171 30 20 DKED Cc1ccc(C[C@@H](C#N)Sc2ccc(F)c(Cl)c2)cc1 480596179 QKVNJNNDUVOLSM-AWEZNQCLSA-N 305.805 5.015 30 20 DKED CCC[C@H](NCc1ccc(C#N)o1)c1ccc(Cl)c(Cl)c1 540600929 DUGTVNGJHDIYCY-INIZCTEOSA-N 323.223 5.089 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1 559859765 OHMVVBXKDGXXSH-BEFAXECRSA-N 312.844 5.426 30 20 DKED Cc1cccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1C 559860431 ULQGMWMWYLLRMD-WIYYLYMNSA-N 306.453 5.389 30 20 DKED Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H](CCCC#N)c1ccccc1 581375554 LXYSNVSCQRQWRA-JRGCBEDISA-N 318.464 5.568 30 20 DKED Cc1ccsc1C(=O)/C=C\c1nc(-c2ccccc2)cs1 733749031 QFPNDDYILBGWDA-FPLPWBNLSA-N 311.431 5.076 30 20 DKED CCCCCCC[C@@H](NCc1cc(C)no1)c1ccccc1 765781697 AXWPHBSYGKCJMI-LJQANCHMSA-N 300.446 5.174 30 20 DKED C#CCCCCC(=O)N1CCCC[C@@H]1c1ccc(C(C)C)cc1 773569156 VBNKEOZIXMAQIG-HXUWFJFHSA-N 311.469 5.057 30 20 DKED C#CCCCCCC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1 780676343 LWPIJNXUJFACBI-FQEVSTJZSA-N 311.469 5.057 30 20 DKED O=C(/C=C\c1ccsc1)c1ccc(N2CCCCCC2)cc1 916132969 WEARJUAJCMEVQN-YHYXMXQVSA-N 311.450 5.025 30 20 DKED C=CCCO[C@H](C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 921145854 IXGGDSQWXSCBJA-OAHLLOKOSA-N 323.396 5.022 30 20 DKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2ccccc2)n1 301947231 XZBGMXZJRFPUDP-LLVKDONJSA-N 322.355 5.134 30 20 DKED CCc1ccc([C@H](CC)N[C@H](CCCC#N)c2ccccc2)cc1 340460923 YPBUBMBBUJDHML-FCHUYYIVSA-N 320.480 5.725 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@@H](CCC#N)c3ccccc3)oc2c1 426014779 DLBKWJCFBKOLQP-APWZRJJASA-N 318.420 5.437 30 20 DKED CC(C)(C#N)CCCCN1[C@H]2C=C(c3ccccc3)C[C@H]1CC2 502800953 CDBACIHFSYYYQI-WOJBJXKFSA-N 308.469 5.027 30 20 DKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1coc2ccccc12 761477935 BXANHXIEZRPBBV-BQYQJAHWSA-N 323.348 5.078 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C/c1coc(-c3ccccc3)n1)C2=O 766695357 KJKHHIPFRGRMFB-JVVDOCDTSA-N 315.372 5.033 30 20 DKED N#CCCCOc1cccc(CNc2ccc3ccccc3c2)c1 155603483 RFZPIMMEABBYQB-UHFFFAOYSA-N 316.404 5.134 30 20 DKED N#Cc1ccc(/C=C\c2ccc(-c3ccc(Cl)cc3)o2)nc1 603893993 OAANYCCFHLZYEC-FPLPWBNLSA-N 306.752 5.037 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2ccc(C(F)(F)F)s2)c1 761480257 QXCVXGKDNNYFSN-UTCJRWHESA-N 314.303 5.111 30 20 DKED C=CC[C@@H](N[C@H]1CCCc2ccc(Cl)cc21)c1ccncc1 762477057 SVPRYXADBZLAKI-MOPGFXCFSA-N 312.844 5.019 30 20 DKED CCCCCCCCCC(=O)N1CC(C)(C)[C@H]1c1ccncc1 817174569 AEDIFHRGJRYFGE-LJQANCHMSA-N 316.489 5.132 30 20 DKED CCCCCCCSc1nnc(COc2cccc(C)c2)o1 915789819 OBUBFQYOFYKYDA-UHFFFAOYSA-N 320.458 5.020 30 20 DKED C=C(C)CN(CC)C(=O)Nc1c(CCC)cccc1C(C)C 189971778 UCRPLUQKEAAVPF-UHFFFAOYSA-N 302.462 5.192 30 20 DKED C=CCCCN(C)C(=O)c1cc(-c2ccccc2)ccc1Cl 524061850 DTKJAEIZTOZEPY-UHFFFAOYSA-N 313.828 5.045 30 20 DKED CCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1F 540594501 KPVJKOLGGFINLI-ORAYPTAESA-N 314.379 5.028 30 20 DKED CC(C)Cc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 560565683 ZBVVKHAWUDAIMD-JOCHJYFZSA-N 320.480 5.410 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(Cl)cc1)c1ccc(C#N)cc1 579552700 WTZVMJIGVXVMNI-RBUKOAKNSA-N 312.844 5.404 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc21 618569974 LWRDLQUOPOLRAP-JHVJFLLYSA-N 304.437 5.093 30 20 DKED CC[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)cc1 619746698 IXRLLXDQJSSJEU-KRWDZBQOSA-N 319.235 5.106 30 20 DKED CC(CCCC(F)(F)F)=NNc1cccc(C(F)(F)F)c1 774312146 YDHKTPXYOVITAD-UHFFFAOYSA-N 312.257 5.226 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797566521 MIWLBQUZJCEUDM-KGLIPLIRSA-N 320.502 5.223 30 20 DKED CCSc1ccc([C@H](C)N[C@H](CC)c2ccc(C#N)cc2)cc1 569432996 ZLIYYZKYDKRNCR-MGPUTAFESA-N 324.493 5.472 30 20 DKED CCc1ccc(CNc2ccccc2SC[C@@H](C)C#N)cc1 600847644 KRVQIXOMQUPEOL-HNNXBMFYSA-N 310.466 5.113 30 20 DKED CC(C)Oc1cccc([C@H](C)Nc2cccc(Cl)c2C#N)c1 603859856 DOCNQEDLYULZRK-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED Cc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)ccc1F 741468705 HEYSSUHOOCPIID-SOFGYWHQSA-N 317.363 5.092 30 20 DKED N#CCC[C@H](NCc1cc2ccccc2s1)c1ccccc1 130558527 HWZNGDHTQJFMHB-SFHVURJKSA-N 306.434 5.036 30 20 DKED N#CCc1ccc(NCc2ccc(-c3ccccc3F)s2)cc1 237888996 ULVCFXPBAGSPQZ-UHFFFAOYSA-N 322.408 5.232 30 20 DKED CCC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccsc1 340447183 PFEJFBYZNMPECX-RTBURBONSA-N 312.482 5.614 30 20 DKED CCC(CC)(NCc1cc(C#N)cs1)c1ccc(Cl)cc1 530885568 IVHVBVTYPVOMIF-UHFFFAOYSA-N 318.873 5.078 30 20 DKED C=CCC[C@@H](NCc1ccco1)c1ccc(C(F)(F)F)cc1 539524117 WTSCGWGEYSPQJY-MRXNPFEDSA-N 309.331 5.096 30 20 DKED C=CCC[C@H](NCc1cc(-c2cccs2)on1)c1ccccc1 540458272 MMPRUDOXZGWRMY-KRWDZBQOSA-N 324.449 5.200 30 20 DKED CCC(CC)[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccs1 574946075 OKRQOBKPQYWBSP-ICSRJNTNSA-N 324.493 5.374 30 20 DKED Cc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 728438365 VLFQTYHVXYUOEZ-CMDGGOBGSA-N 311.431 5.076 30 20 DKED COc1cc(/C=C2/CCCc3ccccc3C2=O)ccc1SC 746340412 IHVRBCHBJITACI-VBKFSLOCSA-N 324.445 5.020 30 20 DKED C[C@@H](SCc1nc(Cl)ccc1Cl)c1cccc(C#N)c1 785536836 JOSIGRRZPNRKGI-SNVBAGLBSA-N 323.248 5.254 30 20 DKED Cc1cc(F)ccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 815635889 LOAVIZUHXKFEIV-OXJNMPFZSA-N 310.416 5.220 30 20 DKED CCCCCCC[C@@H](N[C@H]1CCn2ccnc21)c1ccccc1 834835948 JYYOUKFMTCJHGO-MOPGFXCFSA-N 311.473 5.019 30 20 DKED C(=NOCc1ccccc1)C(c1ccccc1)c1ccccc1 839419953 XVZLJPAOXMDXFJ-UHFFFAOYSA-N 301.389 5.021 30 20 DKED C=CCc1cc(Cl)c2cccnc2c1OCc1ccccc1 91301733 QTWVOAJDZOBLJW-UHFFFAOYSA-N 309.796 5.196 30 20 DKED C[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1cccc(C#N)c1 427871674 IIVXNJPQSBCNHK-RYUDHWBXSA-N 319.235 5.277 30 20 DKED CC(C)(C#N)CCCCNC(C)(C)c1cccc(Cl)c1F 444671073 HYLWSFKEGKFJDL-UHFFFAOYSA-N 310.844 5.024 30 20 DKED C[C@@H](NCCCC(C)(C)C#N)c1ccc(Cl)c2ccccc12 462454068 GICJLLPMCUDYCY-CQSZACIVSA-N 314.860 5.474 30 20 DKED C=C(C)[C@H](NCc1cccc(C(F)F)c1)c1ccc(F)c(F)c1 470762595 VTTMCBGAFLYMII-KRWDZBQOSA-N 323.333 5.309 30 20 DKED CCCC[C@H](CC)CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 609754462 YUWUGXDLZLMKTE-SJORKVTESA-N 314.473 5.074 30 20 DKED Cc1ccc2cc([C@H](C)NCc3ccc(C#N)c(Cl)c3)oc2c1 619755744 RADSUEFFZCLOGS-ZDUSSCGKSA-N 324.811 5.117 30 20 DKED CCCCCCCC(=O)Nc1ccccc1CC(F)(F)F 741988984 MCNUPFVUPQDEAE-UHFFFAOYSA-N 301.352 5.090 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 744016896 VNKJBLJTUKYUQN-NVXWUHKLSA-N 308.425 5.018 30 20 DKED C=CCC[C@H](Nc1ccc(OC(C)C)c(OC)c1)c1ccco1 796942698 HJZWGRHYHJIHCM-INIZCTEOSA-N 315.413 5.195 30 20 DKED C=CC[C@H](N[C@@H](C)c1c(C)oc2ccccc12)c1ccncc1 925074520 ICTOQFCPZSKCHD-KSSFIOAISA-N 306.409 5.104 30 20 DKED C=CCCCC(=O)Nc1ccccc1-c1nc2ccccc2s1 177501561 LDZSABRSHDZFKC-UHFFFAOYSA-N 322.433 5.258 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(-c2cccnc2)cc1 278580456 CQAHDNCHCRBWPY-KRWDZBQOSA-N 321.468 5.119 30 20 DKED Cc1ccc(C[C@H](C#N)Sc2ccc(F)c(Cl)c2)cc1 480596180 QKVNJNNDUVOLSM-CQSZACIVSA-N 305.805 5.015 30 20 DKED C=CCC[C@@H](N[C@H]1CCSc2c(F)cccc21)c1ccco1 513692075 YEMFQHPTJSOZDV-JKSUJKDBSA-N 317.429 5.253 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 537950266 OUMHMEOVEAKKAJ-VGSWGCGISA-N 314.432 5.535 30 20 DKED CC(C)CCOc1ccccc1N[C@@H](C)c1cccc(C#N)c1 600852659 RTUPVRVSSDPKJP-INIZCTEOSA-N 308.425 5.156 30 20 DKED C[C@H](Nc1ccc(OC2CCCC2)c(F)c1)c1ccc(C#N)cc1 743484103 MSKHHBLWSQFMJW-AWEZNQCLSA-N 324.399 5.192 30 20 DKED O=C1/C(=C\c2ncc(-c3ccccc3)s2)CCc2sccc21 770572059 BMIMKVNQOUCANT-RAXLEYEMSA-N 323.442 5.084 30 20 DKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1cc2ccccc2o1 788097089 GYDDKPUBTYMYCF-BQYQJAHWSA-N 321.357 5.045 30 20 DKED C[C@H](N[C@@H](C)c1csc(C(F)(F)F)c1)c1ccc(C#N)cc1 924785618 OTYPECAAZWEMHN-QWRGUYRKSA-N 324.371 5.050 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H]1C[C@H]1c1ccccc1 461754836 QGYCPOOHBWGFLJ-SZMVWBNQSA-N 322.477 5.296 30 20 DKED C[C@H](NCCCC(C)(C)C#N)C(c1ccccc1)c1ccccc1 543487716 RZADDXWLNLLNNG-SFHVURJKSA-N 320.480 5.127 30 20 DKED CCSc1ccccc1[C@H](C)NC1(c2cccc(C#N)c2)CC1 556600710 ISKCBGAZHOQPPG-HNNXBMFYSA-N 322.477 5.010 30 20 DKED C[C@@H](C#N)CSc1ccccc1NC[C@H]1CCCCC1(F)F 594706019 RZQVDCDKQSBLJG-UONOGXRCSA-N 324.440 5.176 30 20 DKED C=CCOc1cccc(CN[C@H](CC)c2ccc(Cl)cc2)c1 642339636 WXZHOCCUMJQVNN-LJQANCHMSA-N 315.844 5.146 30 20 DKED CCCCCC[C@@H](CC)C(=O)[C@H](C#N)c1ccc2ccccc2n1 735203181 CHFJKZNATMAATO-SJLPKXTDSA-N 322.452 5.408 30 20 DKED CCCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nc(C)cs1 744011194 WLPZDUQFQZVCBV-RHSMWYFYSA-N 306.475 5.015 30 20 DKED C#CC[C@@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccccc1 773106711 LQOXUTDVECVTFI-SMDDNHRTSA-N 324.276 5.470 30 20 DKED C#CC[C@@H](N[C@@H]1C[C@H](C)Sc2sccc21)c1ccccc1 773113745 DUMKEDRWFLKBDW-IAOVAPTHSA-N 313.491 5.028 30 20 DKED CC[C@@H](C)c1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1 1776698207 IJIPXTNPQUKLHA-CEFACKQISA-N 322.404 5.103 30 20 DKED CSc1ccccc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 194935192 QWOSDWIHLAGUCN-QAPCUYQASA-N 310.466 5.104 30 20 DKED C[C@H](Nc1ccc(Cl)c(C(F)(F)F)c1)c1cccc(C#N)c1 315684147 SIJLMGLNCZZZKX-JTQLQIEISA-N 324.733 5.404 30 20 DKED Cc1ccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1C(=N)O 329083660 SVHRFVNSIMUMEP-NUEKZKHPSA-N 314.429 5.073 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccccc1 475567828 YVKOEJJPQZSITN-MRXNPFEDSA-N 322.452 5.421 30 20 DKED C=CCCC1(C(=O)Nc2cccc(-c3ccccc3OC)c2)CC1 475908331 JFDCUDRXBHSXMN-UHFFFAOYSA-N 321.420 5.047 30 20 DKED C=CC[C@@H](N[C@@H]1CCSc2cc(C)c(C)cc21)c1ccncc1 779023708 HTFMHFSFBSQCPS-RTBURBONSA-N 324.493 5.142 30 20 DKED Cc1ccc(C=NOCc2csc(C3CCCCC3)n2)cc1 744180598 UIVPVPHBNDQLEY-UHFFFAOYSA-N 314.454 5.050 30 20 DKED CC(C)(C#N)CCCN1CCC[C@@H]1c1ccccc1C(F)(F)F 746666119 ISOWCVQUBNVRKD-MRXNPFEDSA-N 324.390 5.172 30 20 DKED O=C(/C=C\c1ccc(C(F)F)cc1)c1nccc2ccccc12 811698866 MRIPCGBGJSSWOD-YFHOEESVSA-N 309.315 5.069 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1cc(C#N)ccc1F 832836477 POUICWKXVVGIJJ-UHFFFAOYSA-N 324.399 5.026 30 20 DKED Cc1nc(NN=C2CCCC2)c2cc(-c3ccccc3)sc2n1 6685323 OEWCQDFMBYHBRC-UHFFFAOYSA-N 322.437 5.009 30 20 DKED N#CCCC[C@@H](NC1CCC(C(F)(F)F)CC1)c1ccccc1 340451874 PYCYSFJNGNHKKS-OFLPRAFFSA-N 324.390 5.132 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340456198 VVTFPEZXVVODHT-KUHUBIRLSA-N 314.379 5.051 30 20 DKED C=CC[C@H]1N(C(=O)Nc2c(C)cc(C)cc2C)CCCC1(C)C 444818412 OFNMTQYEHYSZHT-QGZVFWFLSA-N 314.473 5.210 30 20 DKED CC(C)C[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 537400344 XCMPREVWTRZBNH-MGPUTAFESA-N 310.416 5.135 30 20 DKED C=CCC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1 539359988 VVESBDFPAFDXSJ-OAQYLSRUSA-N 318.464 5.285 30 20 DKED C=CCCO[C@@H](C)c1nc(-c2ccc(-c3ccccc3)cc2)no1 580969758 FQYVRTKFQPBYFX-HNNXBMFYSA-N 320.392 5.057 30 20 DKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1ccc2ccccc2c1 60132444 GLBICTBVCYDYFZ-WEVVVXLNSA-N 308.764 5.095 30 20 DKED N#CCC[C@@H](Nc1ccnc2ccc(Cl)cc12)c1ccccc1 301759693 AWSIPLVGYFFDED-QGZVFWFLSA-N 321.811 5.345 30 20 DKED COc1ccc(C)cc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 340457861 WLFMPAREOADLEZ-FXAWDEMLSA-N 322.452 5.089 30 20 DKED C=CCC[C@@H](Nc1cccc(-c2nccs2)c1)c1ccco1 428439182 LOMDTKSQTYVPQS-MRXNPFEDSA-N 310.422 5.523 30 20 DKED CC(C)(C#N)CCCCNC1(c2ccc(C(F)(F)F)cc2)CC1 593111767 AJEIASZYNGDVOU-UHFFFAOYSA-N 324.390 5.004 30 20 DKED CC(C)Sc1ccc([C@H](C)N[C@@H](C#N)c2ccccc2)cc1 595415368 PNSDMXQCIQPUOA-KXBFYZLASA-N 310.466 5.103 30 20 DKED N#Cc1cccc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)c1 746346491 PZIUFIPZGLYRON-SEYXRHQNSA-N 309.368 5.121 30 20 DKED C[C@@H](NN=C(CCC(F)(F)F)CCC(F)(F)F)C(C)(C)C 853349968 MTRKAMOZGVHIFK-SECBINFHSA-N 320.321 5.052 30 20 DKED C=CC[C@H](c1ccccc1)c1nc(-c2ccccc2Cl)no1 904570819 UNZVIFYJSNLFRI-CQSZACIVSA-N 310.784 5.098 30 20 DKED CC(C)(CCC#N)CN[C@@H](CC1CC1)c1ccc(Cl)cc1 348215469 NGEQFEJRTSTKSX-KRWDZBQOSA-N 304.865 5.101 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccsc1Cl 446478834 ZGKTWCMETXHVBN-UHFFFAOYSA-N 312.866 5.002 30 20 DKED CC(C)(C)OCCCCSCc1ccccc1C(C)(C)C#N 473778311 KCVXYGNAWBNGBQ-UHFFFAOYSA-N 319.514 5.316 30 20 DKED CCCCCCCC[S@](=O)Cc1ccc(C(F)F)cc1 790139641 UVNUGKXIIUQKIE-FQEVSTJZSA-N 302.430 5.233 30 20 DKED Cc1cc(-c2ccccc2)ccc1NC(=O)C1(C#N)CCCCC1 920026282 ZSKGEGDTATXXBE-UHFFFAOYSA-N 318.420 5.075 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2ccccc2c1 97299550 QCXTXHXEWGYQIA-UHFFFAOYSA-N 316.404 5.060 30 20 DKED CCCCCCCCC(=O)N[C@H](c1ccccc1)c1ccccn1 105745773 LPVJLCFFLTVRLA-OAQYLSRUSA-N 324.468 5.038 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(C)cccc1CC 471133802 NXMMKFIBIVUFOB-UHFFFAOYSA-N 322.452 5.168 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccccc1OC(C)(C)C 524830442 VQHWSSMJNHMXOO-UHFFFAOYSA-N 318.461 5.074 30 20 DKED C[C@H](N[C@H](c1ccccc1F)C1CCCC1)c1ccc(C#N)cc1 537288744 RKPDJLRVRZNQCB-BTYIYWSLSA-N 322.427 5.279 30 20 DKED Cc1ccccc1[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)C(C)C 539608287 CFPFEWJDKBESPN-QRWLVFNGSA-N 310.416 5.054 30 20 DKED N#CCCCOc1cccc(N[C@H](CC2CC2)c2ccccc2)c1 539627957 RJMHGXAMIVPUCY-OAQYLSRUSA-N 320.436 5.322 30 20 DKED C=CCC(C)(C)c1noc(/C=C(\c2ccccc2)C(F)(F)F)n1 551472106 NKKZJROWGDDBFQ-ACCUITESSA-N 322.330 5.026 30 20 DKED C=CCCc1ccccc1NC(=O)C1CC(c2ccc(F)cc2)C1 646165607 ZZRHIZNMQSMUIK-UHFFFAOYSA-N 323.411 5.077 30 20 DKED CCCC[C@H](CC)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 735397898 YTZIBGWRHDLSGV-RDJZCZTQSA-N 308.425 5.018 30 20 DKED Clc1ccc(C=NOCc2csc(C3CCCC3)n2)cc1 746353349 YOVRSOYZDLLWDZ-UHFFFAOYSA-N 320.845 5.005 30 20 DKED C=CCCc1ccccc1NC(=O)C1(c2cccc(F)c2)CCC1 410345596 REBZLLWOQNGSHS-UHFFFAOYSA-N 323.411 5.005 30 20 DKED Cc1c([C@@H](C)NCc2ccc(C#N)cc2Cl)oc2ccccc12 439449622 IQEXFAFXJTUJCY-CYBMUJFWSA-N 324.811 5.117 30 20 DKED CC(C)(C#N)CCCSCc1sccc1Br 464082144 NZCYLHTVLAEGCJ-UHFFFAOYSA-N 318.305 5.074 30 20 DKED CC(C)C[C@@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 520924075 HTDIEEZYBDRLMT-HUUCEWRRSA-N 318.486 5.092 30 20 DKED CCCCC[C@H](C(=O)[C@H](C#N)c1nccc2ccccc12)C(C)C 792089861 AQOXQYTTWUAPHM-PKOBYXMFSA-N 322.452 5.264 30 20 DKED N#CCc1ccc(NCc2ccc(-c3ccc(F)cc3)s2)cc1 237691706 KMQSNIUWHJGSME-UHFFFAOYSA-N 322.408 5.232 30 20 DKED N#CC1CCC(CN[C@H]2CCCc3c2sc2ccccc32)CC1 442848174 AABKGPNOTKJCQK-JMLCCBQJSA-N 324.493 5.198 30 20 DKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H]1CCC[C@@H](C#N)C1 463281507 KXGJURALLNTYJT-QYZOEREBSA-N 324.493 5.012 30 20 DKED N#C[C@H]1CCC[C@@H](Nc2cccc(COC3CCCCC3)c2)C1 463287675 KIKSMALOUIONIE-FUHWJXTLSA-N 312.457 5.030 30 20 DKED CCC(C)(C)OCc1ccccc1NCc1ccc(CC#N)cc1 541800800 OXWUAHNEGCCMLW-UHFFFAOYSA-N 322.452 5.070 30 20 DKED CC[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 734080626 XTVJBMNGFVWDGQ-HOTGVXAUSA-N 324.424 5.001 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 735395740 AXAFSJQVDWMECL-ZIAGYGMSSA-N 314.454 5.079 30 20 DKED COCc1cccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)c1 742429701 VPBYIDUIVVBQMS-YVMONPNESA-N 321.203 5.036 30 20 DKED C/C(C=NOc1ccccc1C(F)(F)F)=C\c1ccccc1 754710934 ZNNSSPWXEPTYJA-CJANTZLASA-N 305.299 5.174 30 20 DKED C=CC[C@@H](N[C@H](C)c1cccc(Cl)c1Cl)c1ccncc1 766017745 CSSYRAOUTICKQG-MLGOLLRUSA-N 321.251 5.356 30 20 DKED N#CC[C@@H](Cc1nc(C2CCCCCCC2)no1)c1ccccc1 809441407 XVOQZBFRZDCKSZ-SFHVURJKSA-N 323.440 5.137 30 20 DKED C=CCC[C@H](N[C@@H]1CCCc2nc(C)sc21)c1ccccc1 90580701 WCPHPRNTFLOWOR-FUHWJXTLSA-N 312.482 5.126 30 20 DKED CC(C)(C)c1ccc(OCc2ccccc2)c(C(C)(C)C=O)c1 91301853 FZTCALRITQDFCG-UHFFFAOYSA-N 310.437 5.040 30 20 DKED CC(C)COc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 325107326 AXCXPRUHPUORAZ-IRXDYDNUSA-N 322.452 5.005 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1 358340375 KUUPEDBUDSFKRD-OALUTQOASA-N 312.844 5.426 30 20 DKED C=C(C)C[C@H](C)C(=O)N(Cc1cccs1)c1ccc(F)cc1 464435789 GOKMEPGWKFZEFV-AWEZNQCLSA-N 317.429 5.023 30 20 DKED C=CCCc1ccccc1NC(=O)N[C@@H](CC)c1cccs1 505034435 DBMXVYNTPSEVGG-HNNXBMFYSA-N 314.454 5.140 30 20 DKED C=CCOc1ccc(CN[C@@H](C)c2oc3ccccc3c2C)cc1 513098205 CMHGVMUXNPZUHI-INIZCTEOSA-N 321.420 5.157 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C2CC2)c1 565166439 WQUHRYRJQHWQSA-UHFFFAOYSA-N 319.448 5.668 30 20 DKED O=C(/C=C/C=C\c1ccccc1)c1cccc(-c2ccncc2)c1 741474244 WLCRQIXGPLWARQ-AGGGZFENSA-N 311.384 5.201 30 20 DKED Cc1ccc2cc(C(=O)/C=C/c3cnc(C(C)C)s3)oc2c1 754824483 JSVBUBCQNZGCEH-VOTSOKGWSA-N 311.406 5.217 30 20 DKED C=C(C)[C@@H](NCc1ccc(Cl)s1)c1ccc(F)c(F)c1 479427522 YJXRIJIRVZYENL-OAHLLOKOSA-N 313.800 5.087 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1ccccc1)C1CC1 481664649 HGMWYHNXXXSQNX-FGZHOGPDSA-N 316.448 5.067 30 20 DKED CSc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1Cl 538636330 RBAVIWXQZAQAFV-LLVKDONJSA-N 302.830 5.107 30 20 DKED C=C[C@H](CC(=O)Nc1cccc(SC)c1C)c1ccccc1 540443180 LXBOQDVUFVTMOA-OAHLLOKOSA-N 311.450 5.015 30 20 DKED CC(C)COc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 610829783 KTFLLMBBRNKARX-IRXDYDNUSA-N 322.452 5.005 30 20 DKED C=CCOc1ccc(CN[C@H](CC(C)C)c2cccs2)cc1 616029123 NVTPAEDIBULVDJ-GOSISDBHSA-N 315.482 5.190 30 20 DKED Cc1ccc2cc([C@H](C)N[C@H](C)c3cccc(C#N)c3)oc2c1 617304718 YFDAHQPXRRDGBZ-CABCVRRESA-N 304.393 5.025 30 20 DKED CCSc1ccc([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618803862 IXGYXCAGWTUHBP-XOBRGWDASA-N 322.477 5.008 30 20 DKED C=CC[C@H](N[C@@H]1CCCc2ccc(C(C)C)cc21)c1ccncc1 761451891 PIHBDLAREIJXBV-FCHUYYIVSA-N 320.480 5.489 30 20 DKED C=CC[C@H](NCc1ccc(C2CCCC2)cc1)c1ccncc1 812756041 HVNNRGCSUTWLLD-NRFANRHFSA-N 306.453 5.146 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)C(C)(C)C 476087982 CYSJGDHCSPZIDO-HNNXBMFYSA-N 301.474 5.549 30 20 DKED C=C(C)[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1ccc(F)c(F)c1 479416424 YMBSLPSSLREDFD-PEELUZDISA-N 317.379 5.088 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc2ccccc2n1)c1ccccc1 537946263 XHWBJDUIJGASRT-DYESRHJHSA-N 316.448 5.593 30 20 DKED CC(C)C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccs1 539608472 MRPBJDJDILUNOJ-GUYCJALGSA-N 316.445 5.197 30 20 DKED C=CCCC[C@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1 540326085 IASCICZOXHQYEJ-ZWKOTPCHSA-N 324.468 5.056 30 20 DKED C=CCC[C@@H](NCc1cccc(-c2cccnc2)c1)c1ccco1 552065490 BYMIXLRKLUDCPP-HXUWFJFHSA-N 318.420 5.139 30 20 DKED C=CCC[C@H](N[C@H]1CCc2sc(Cl)cc21)c1ccco1 573143534 PASCDVQSNJPNEG-STQMWFEESA-N 307.846 5.279 30 20 DKED CC[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 734080628 XTVJBMNGFVWDGQ-JKSUJKDBSA-N 324.424 5.001 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(C)c1C 794994338 GSMICMKLUGPONM-UHFFFAOYSA-N 324.493 5.079 30 20 DKED CCCCCCCC[C@@H](C)C(=O)Nc1cc(C)cc(C(=O)O)c1 1776786149 RZEKIHMMEMECDW-OAHLLOKOSA-N 319.445 5.018 30 20 DKED C[C@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1cccc(C#N)c1 319660967 BTRBIXRWCPGSOZ-IFXJQAMLSA-N 310.416 5.135 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2 476076472 AWZYEKQJLQRVBS-SZMVWBNQSA-N 311.469 5.303 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)CC1CCCC1 476084850 PTEYWQFWJWDCJF-INIZCTEOSA-N 313.485 5.693 30 20 DKED C=CCCC(=O)N[C@@H](c1ccccc1)c1cccc2ccccc12 517667798 GSWPHUOHNZPYOR-QFIPXVFZSA-N 315.416 5.012 30 20 DKED C=CCc1ccccc1OCc1nc(-c2ccsc2)oc1C 524264889 GJGLMZSCAKPJKE-UHFFFAOYSA-N 311.406 5.019 30 20 DKED C[C@@H](SCc1cc(-c2ccccc2)on1)c1ccc(C#N)cc1 609825529 CLJDLOSTSUMKFT-CQSZACIVSA-N 320.417 5.208 30 20 DKED Cc1ccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)cc1 751510345 QUYOVQLRYFHIEX-HJWRWDBZSA-N 311.431 5.076 30 20 DKED Cc1ccc2cc(C(=O)/C=C\c3nccc4ccccc34)oc2c1 754825123 NHEBSYBRVPXRLZ-HJWRWDBZSA-N 313.356 5.186 30 20 DKED CC(C)(C)c1c(CC#N)nc2ccccc2c1-c1ccccc1 60510994 CYFRCBJNHPDCPN-UHFFFAOYSA-N 300.405 5.265 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H](CC)c1ccc(F)cc1 410362908 DJLIEFIYJBHWOE-GOSISDBHSA-N 311.400 5.077 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CCC 475552527 ZPYHFWSYCKYDGJ-OAHLLOKOSA-N 302.462 5.191 30 20 DKED C=CCOc1cccc(CN[C@H](CC(C)C)c2cccs2)c1 616029306 VFCFKJWQOBPVKV-GOSISDBHSA-N 315.482 5.190 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@H]1CCc2cc(C#N)ccc21 618807752 WHLOPGPBXMESGG-KUHUBIRLSA-N 322.477 5.008 30 20 DKED CCc1ccc(CCC=NOc2ccccc2C(F)(F)F)cc1 758128542 HTZVUEUSRHYSRD-UHFFFAOYSA-N 321.342 5.265 30 20 DKED CC(/C=C\C(=O)c1cscn1)=C\c1cccc(C(F)(F)F)c1 806573969 XVGGYFPFYVYDLJ-GNLLZQBYSA-N 323.339 5.004 30 20 DKED CC(C)=CCC[C@H](C)CC(=O)[C@H](C#N)c1nccc2ccccc12 842775388 MWBUGLRGGDSTEH-LPHOPBHVSA-N 320.436 5.184 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1cccc(C#N)c1 181409828 UNDLYTDSDIFNQI-DJJJIMSYSA-N 310.828 5.014 30 20 DKED N#Cc1cccc(CSCc2csc(C3CCCC3)n2)c1 517940624 YXBSHAHYBSOSBN-UHFFFAOYSA-N 314.479 5.106 30 20 DKED C=CC[C@@H](N[C@@H](C)c1oc2ccccc2c1CC)c1ccncc1 776155302 FYWMWUSAFKIAPI-HNAYVOBHSA-N 320.436 5.358 30 20 DKED C#CC[C@H](N[C@@H]1CCSc2cc(C)c(C)cc21)c1ccccc1 779039161 QFCXGFZCGLQSEG-VQTJNVASSA-N 321.489 5.195 30 20 DKED CCCCCCC[C@H](NCc1ccc(C#N)cn1)c1ccccc1 783293698 JRJJIRZBJRTIBH-NRFANRHFSA-N 321.468 5.145 30 20 DKED C[C@@H](SCCC(Cl)(Cl)Cl)c1cccc(C#N)c1 785536971 LYCCJAYUMFEDKH-SECBINFHSA-N 308.661 5.113 30 20 DKED CC(/C=C\C(=O)c1cncs1)=C\c1cccc(C(F)(F)F)c1 806573290 HTEWWQQYGRLQMC-GNLLZQBYSA-N 323.339 5.004 30 20 DKED O=C(/C=C\c1csc(-c2ccsc2)n1)C1CCCCC1 920065733 IMCDDGZLSRCTDF-SREVYHEPSA-N 303.452 5.034 30 20 DKED CC(C)Oc1cccc(/C=C\C(=O)c2ccc(Cl)s2)c1 921262025 NDYZKAMVIPGBAF-SREVYHEPSA-N 306.814 5.085 30 20 DKED CC(C)(C#N)CCCCN1CCCC[C@H]1c1cc2ccccc2[nH]1 444659745 QJNWOKJUQNHNOF-FQEVSTJZSA-N 323.484 5.415 30 20 DKED Cc1ccc(Sc2ccc(NC(=O)CCCC#N)cc2)c(C)c1 463108433 WJVVNPRBXVHNMO-UHFFFAOYSA-N 324.449 5.087 30 20 DKED CC(C)CCCCCC(=O)[C@H](C#N)c1nc(C(C)C)cs1 749041293 OZMKLTWKQPESGC-AWEZNQCLSA-N 306.475 5.049 30 20 DKED N#Cc1ccc(/C=C2/CCc3c(sc4ccccc34)C2=O)s1 763102699 ZWQRPBKGESCKOH-LUAWRHEFSA-N 321.426 5.047 30 20 DKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1cc2ccccc2s1 804441339 KCTVBSNRCDCCEA-QMMMGPOBSA-N 319.842 5.056 30 20 DKED N#Cc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)c1 834784434 WZFIOJOLNKYBSB-MDZDMXLPSA-N 315.397 5.183 30 20 DKED CCCCCCCCCCC(=O)Nc1ccc2oc(O)nc2c1 917083621 XTLSKIVMHCRDQV-UHFFFAOYSA-N 318.417 5.003 30 20 DKED N#CCCC[C@H](NCc1ccc(C(F)F)cc1)c1ccccc1 353914000 JTQJFPXPKQYZQG-SFHVURJKSA-N 314.379 5.149 30 20 DKED CC[C@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 447522961 RNUZBWDZKUECSK-ZHRRBRCNSA-N 314.432 5.513 30 20 DKED CC1(C#N)CCC(N[C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1 449773291 MQNWFXSKBSXQFB-WEOZKBJRSA-N 316.876 5.038 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc2ccccc2c1 512632250 YFQITNTZCNYBPD-LSDHHAIUSA-N 318.395 5.262 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2c(s1)CCCC2 539048177 BOCHFUWWJUYQLX-CRAIPNDOSA-N 324.493 5.323 30 20 DKED CCCc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550834684 BXDZVJCNLVUDDN-XMSQKQJNSA-N 320.480 5.725 30 20 DKED Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H](CCCC#N)c1ccccc1 581375555 LXYSNVSCQRQWRA-QMMLZNLJSA-N 318.464 5.568 30 20 DKED C[C@@H](CC#N)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 597362024 JEHQBCZMZQHCBQ-GJZGRUSLSA-N 324.449 5.028 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC12CCCC2 650153996 BZUCHTBYFFRLMZ-UHFFFAOYSA-N 312.457 5.089 30 20 DKED Cc1cc(N[C@@H](C)c2ccc(OCC#N)cc2)cc(C)c1Cl 799729748 QLACQEVBFAAPBP-AWEZNQCLSA-N 314.816 5.032 30 20 DKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1nc2ccccc2s1 805844166 GFWSACIEYQZGFC-CYBMUJFWSA-N 314.454 5.079 30 20 DKED CCCCCCCCCC[C@@H](C)Nc1nc(C)ccc1C(=O)O 1776785310 SUSAEBYIIXODEV-OAHLLOKOSA-N 320.477 5.419 30 20 DKED C[C@@H](c1ccc2ccccc2c1)N(Cc1ccc(C#N)o1)C1CC1 511776490 LDJAOMHIPNMHGG-HNNXBMFYSA-N 316.404 5.030 30 20 DKED CC(C)(CCC#N)CNc1cccc(COC2CCCCC2)c1 532728278 QOMIMPUHHHBZHD-UHFFFAOYSA-N 314.473 5.278 30 20 DKED N#CCC[C@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccccc1 539048286 DETVGWGDGWHPDB-VQTJNVASSA-N 324.855 5.352 30 20 DKED C=C(C)[C@H](NCc1sccc1Cl)c1ccc(F)c(F)c1 584279556 PCAPLQUYXJXULU-HNNXBMFYSA-N 313.800 5.087 30 20 DKED Cc1cc(/C=C/C(=O)c2ccccc2)ccc1Oc1cccnc1 732713617 IFMUAKWFBHDXDD-PKNBQFBNSA-N 315.372 5.078 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 766019294 LKNXUZSFCJAKQJ-SJKOYZFVSA-N 321.251 5.356 30 20 DKED FC(F)C1CCC(=NNc2nc(-c3ccccc3)cs2)CC1 799473665 LYVLBZINWMABCV-UHFFFAOYSA-N 321.396 5.033 30 20 DKED CCCCCCCCCC(=O)N1CC(C)(C)[C@@H]1c1cccnc1 814135444 XJIOPMZVGYTPEV-IBGZPJMESA-N 316.489 5.132 30 20 DKED Cc1cc(CS[C@@H](C)c2nc3ccccc3o2)ccc1C#N 485596963 YWACRDKEWJWOGS-ZDUSSCGKSA-N 308.406 5.002 30 20 DKED CCCCCCCC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 732029523 KEBHKMOFELEPQV-MRXNPFEDSA-N 307.865 5.016 30 20 DKED C=CC[C@H](C)NC(=S)Nc1c(C(C)C)cccc1C(C)C 734988062 VPDZUJHQEPIRIN-AWEZNQCLSA-N 304.503 5.184 30 20 DKED FC(F)(F)c1ccccc1C=NNc1cccc2ccccc12 747060502 UCMAMGMABKQTSS-UHFFFAOYSA-N 314.310 5.305 30 20 DKED C[C@H](CC=NOc1ccccc1C(F)(F)F)c1ccccc1 755815292 GPKUWTKBOLJUGF-CYBMUJFWSA-N 307.315 5.264 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1nccc2ccccc12 811698861 MRIPCGBGJSSWOD-JXMROGBWSA-N 309.315 5.069 30 20 DKED C=CC[C@@H](c1ccccc1)c1nc(-c2ccccc2Cl)no1 904570817 UNZVIFYJSNLFRI-AWEZNQCLSA-N 310.784 5.098 30 20 DKED C[C@H](N[C@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 192755328 PGBIZNCUVLBFRX-JKSUJKDBSA-N 300.405 5.123 30 20 DKED CSc1ccccc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 340447322 PQZJLDPRLAITFA-QFBILLFUSA-N 324.493 5.494 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCC1(C)C 475568663 DVHAFCKLGYFGQG-QGZVFWFLSA-N 314.473 5.239 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@H](C)C(C)C 475584767 ZUISTXFWNKTJNK-MRXNPFEDSA-N 316.489 5.437 30 20 DKED Cc1ccccc1[C@@H](N[C@H](C)c1ccc(C#N)cc1)C(C)(C)C 539494777 PCOKRCRCGKKAIL-OXQOHEQNSA-N 306.453 5.305 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1cc2c(ccc3ccccc32)o1 554367392 WYXNUSIETRNPQT-HNNXBMFYSA-N 320.436 5.567 30 20 DKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1F 613114008 QTHUJJWOQKDYNX-SJKOYZFVSA-N 316.807 5.153 30 20 DKED N#C[C@@H](Cc1ccccc1)SCc1ccc(C(F)(F)F)cc1 619460486 KYSXDFAPTZOKMV-MRXNPFEDSA-N 321.367 5.073 30 20 DKED CCCCCCCCCCC(=O)N1CCC(C(F)(F)F)CC1 742857838 IXTGAAOHACRUIX-UHFFFAOYSA-N 321.427 5.318 30 20 DKED N#CCCCCC(=O)Nc1ccccc1SCc1ccccc1 846784741 UGLZGJQWCHUBLT-UHFFFAOYSA-N 324.449 5.001 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1cccc(OC)c1 918722299 CEDHQBVKAQHQQS-UHFFFAOYSA-N 322.518 5.074 30 20 DKED CCCCCCCCCC=NNc1ccc(Cl)c(C(=O)O)c1 1776033625 KFULRAVKKWOWSW-UHFFFAOYSA-N 324.852 5.577 30 20 DKED C=CCCC(=O)N(c1ccc(Nc2ccccc2)cc1)C(C)C 60365047 JPPPVTMJXSUZJW-UHFFFAOYSA-N 308.425 5.138 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H](C)SC 356222775 SNHQGZIBQDVNGS-CQSZACIVSA-N 305.487 5.009 30 20 DKED C=C(C)[C@H](NCc1ccsc1Cl)c1ccc(F)c(F)c1 480251646 JITFQAFRBAAOCU-AWEZNQCLSA-N 313.800 5.087 30 20 DKED CSc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 516987451 RRJGVQFIPFBNSC-VLIAUNLRSA-N 322.477 5.008 30 20 DKED C[C@@H](NCCCCC#N)c1ccc(-c2ccc(Cl)cc2)s1 531960200 KJAUBKZJOBJWPA-CYBMUJFWSA-N 318.873 5.413 30 20 DKED C[C@@H](N[C@H](c1ccccc1F)C1CCCC1)c1ccc(C#N)cc1 537289232 RKPDJLRVRZNQCB-VFNWGFHPSA-N 322.427 5.279 30 20 DKED C[C@@H](NCCC(C)(C)C#N)c1ccc(Cl)c2ccccc12 545902420 BNBRLINGFMEKGE-CYBMUJFWSA-N 300.833 5.084 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1nc(C)sc1C)c1ccc(F)c(F)c1 681401414 RURMOIWJIXQQQD-MGPLVRAMSA-N 322.424 5.006 30 20 DKED C=CC[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 766022027 VUCHPARTRIZNHF-DYVFJYSZSA-N 320.358 5.068 30 20 DKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1cccc2ccccc12 779713413 SQQRCZIYMFXUFB-HZPDHXFCSA-N 316.404 5.304 30 20 DKED COc1cccc2cc([C@@H](C)Nc3ccc(CCC#N)cc3)oc12 903297677 IYKZBYTWLPFTAL-CQSZACIVSA-N 320.392 5.071 30 20 DKED CC(C)=CCC/C(C)=C\C=NNc1ncccc1C(F)(F)F 915050781 CDGZJNXDBWWYPR-LYBHXDAOSA-N 311.351 5.191 30 20 DKED Clc1cccnc1NN=Cc1sc2ccccc2c1Cl 917546935 VXRBWYIFBOCWIP-UHFFFAOYSA-N 322.220 5.049 30 20 DKED N#CCCSc1nc(-c2ccccc2)c(-c2ccccc2)o1 4413845 OWGXEDGDZFDVML-UHFFFAOYSA-N 306.390 5.014 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1Cl 90665436 XHURBAOTQHWREO-FZKQIMNGSA-N 316.807 5.175 30 20 DKED CC(C)C[C@@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462726501 IYXKZBCCUZGIRT-LJQANCHMSA-N 312.844 5.089 30 20 DKED N#Cc1ccc(SCc2csc(Nc3ccccc3)n2)cc1 509627199 XOQXPUWRIMTLRO-UHFFFAOYSA-N 323.446 5.051 30 20 DKED CC(C)[C@H]1C[C@@H](NC2(c3cccc(C#N)c3)CC2)c2ccccc21 576486430 NVCCATHOAFVHEY-NHCUHLMSSA-N 316.448 5.022 30 20 DKED C=CCCCCSCC(=O)Nc1c(Cl)cccc1Cl 582291204 JPIPWGDYHULURT-UHFFFAOYSA-N 318.269 5.021 30 20 DKED CC(C)c1ccc(CSCc2ccc(OCC#N)cc2)cc1 731158443 MPTPQWBVDANOOX-UHFFFAOYSA-N 311.450 5.146 30 20 DKED c1ccc([C@H]2CCCC2=NNc2nccc3sccc23)cc1 732528752 XDBPKLLDKACLKY-CQSZACIVSA-N 307.422 5.032 30 20 DKED Cc1c([C@@H](C)N[C@H](CCC#N)c2ccccc2)oc2ccccc12 90665257 GTIAEBHWVBXECV-VQIMIIECSA-N 318.420 5.437 30 20 DKED N#CCCCCSCc1ccc(Br)c(Cl)c1 468647867 LUOPLWXVGZPUDD-UHFFFAOYSA-N 318.667 5.030 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCC(C)(C)C1 476090475 MCDNYJQXPOUNAY-KRWDZBQOSA-N 313.485 5.693 30 20 DKED N#Cc1ccccc1-c1ccc(CSC[C@@H]2CCCCO2)cc1 517284058 DSTDJJFCONAPHV-IBGZPJMESA-N 323.461 5.028 30 20 DKED CC(C)(C#N)CCN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 537362545 GOJGBJNMLVYAJH-HNNXBMFYSA-N 311.256 5.070 30 20 DKED C=C(CC)CSCc1csc(-c2ccccc2OC)n1 539095312 WPAACGFHSQTXHK-UHFFFAOYSA-N 305.468 5.018 30 20 DKED CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(CC#N)cc2)cc1 609973505 TYEYSMDTALUSJA-MRXNPFEDSA-N 320.436 5.008 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(C(C)C)cs1 747198187 UKPFVNYMBQOOLI-KGLIPLIRSA-N 306.475 5.049 30 20 DKED Clc1scc(C=NNc2cccc3ncccc23)c1Cl 761781359 FNZJSHFCBUZQNI-UHFFFAOYSA-N 322.220 5.049 30 20 DKED N#Cc1c(Cl)nsc1SCc1cccc2ccccc12 771175570 COTMXZRGRZECHM-UHFFFAOYSA-N 316.838 5.114 30 20 DKED C=CCC[C@@H](Nc1ccc(OC(C)C)c(OC)c1)c1ccco1 796942699 HJZWGRHYHJIHCM-MRXNPFEDSA-N 315.413 5.195 30 20 DKED C[C@H](Nc1ccc(COC2CCCC2)cc1)c1cccc(C#N)c1 182224915 LZWRTARMHZJAGC-INIZCTEOSA-N 320.436 5.191 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CC(C)(C)C 463732493 XWMFEWQZLFYDHF-UHFFFAOYSA-N 316.489 5.438 30 20 DKED CSc1ccc(Cl)cc1N[C@@H](C)c1ccc(C#N)cc1 537532810 ZMWMTZHIDOFIIP-NSHDSACASA-N 302.830 5.107 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1 538508363 JUWQEYZAEIPHGO-SGTLLEGYSA-N 316.807 5.153 30 20 DKED Cc1cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc(C)c1F 572189480 UMMXCZHHOGRDAD-PXNSSMCTSA-N 324.443 5.528 30 20 DKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1ccc(Cl)s1 761474707 MPVNLEYGTNBAKR-ZZXKWVIFSA-N 323.801 5.046 30 20 DKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2s1 776075432 XQFBVRPMZHEORS-UONOGXRCSA-N 314.454 5.079 30 20 DKED CC(C)(C#N)c1ccc(CN[C@H](c2ccccc2)C2CCC2)cc1 614174362 YRHKOVJWJDASEW-OAQYLSRUSA-N 318.464 5.119 30 20 DKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccccc2)s1 742432661 ZGYXMPXMFAGUCL-FPLPWBNLSA-N 311.431 5.076 30 20 DKED CCCC1CCC(C=NNc2ccc(Cl)c(C(=O)O)c2)CC1 1776033660 NMCCFHHAIYVKPD-UHFFFAOYSA-N 322.836 5.042 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc2ccoc2c1 470246724 JNSFMKBNVOQOKM-UHFFFAOYSA-N 320.392 5.043 30 20 DKED C[C@H](c1ccc(Cl)cc1)N(CCCC(C)(C)C#N)C1CC1 472425403 NAXYYVMSAUWMJP-CQSZACIVSA-N 304.865 5.195 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](C)c1ccc(F)c2ccccc12 588975879 LLEVHDSXSXVJJL-OAHLLOKOSA-N 318.395 5.010 30 20 DKED CC(=NNc1ccccc1)c1csc(-c2csc(C)n2)c1 729140319 BMAXDLFOAFPFGM-UHFFFAOYSA-N 313.451 5.016 30 20 DKED FC(F)(F)[C@H]1CCC[C@H](C=NNc2cccc3ncccc23)C1 853290307 VTYRRZSTSLZKIL-STQMWFEESA-N 321.346 5.001 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCCCC[C@H]1/C=C\c1cccs1 466310502 YDXCVSGGMDSDBR-BUINCNPSSA-N 317.498 5.135 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1NCc1ccccc1C 468331391 UQASKDSQZFCTRL-KRWDZBQOSA-N 322.452 5.148 30 20 DKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1 478900968 QICBDFVLWTVGCZ-UHFFFAOYSA-N 318.420 5.008 30 20 DKED C=C(C)[C@H](N[C@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 481585073 HPQYOLIKUNWMPJ-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED CC(CCCC(F)(F)F)=NNc1nc2ccccc2cc1C 774397966 BDKPZMNULKLWGG-UHFFFAOYSA-N 309.335 5.064 30 20 DKED CC(C)=CCC/C(C)=C\C=NNc1ccc(C(F)(F)F)cn1 915917956 WDXLKVQUPMSHBB-NCHMFJOZSA-N 311.351 5.191 30 20 DKED CC[C@H](C#N)Sc1nc2c(Cl)c(Cl)cc(Cl)c2o1 440580568 BPMRVSHQISMNQV-RXMQYKEDSA-N 321.616 5.182 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)s1 475041244 PYBQKPAMERXCNF-NSHDSACASA-N 322.886 5.408 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1c(CCC)cccc1C(C)C 489087596 JMLODCCJJQWWCO-QGZVFWFLSA-N 314.473 5.335 30 20 DKED CC(C)(C)C[C@@H](NCc1ccc(C#N)s1)c1ccc(F)cc1 540589205 QKIJXCABCSGLAE-QGZVFWFLSA-N 316.445 5.026 30 20 DKED CC(C)c1cccc(C(=O)Nc2ccccc2SCCC#N)c1 597176676 JGFSDZPGDJXXBE-UHFFFAOYSA-N 324.449 5.068 30 20 DKED C[C@@H](Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 600850180 QOYNMBDGNDBIBF-CQSZACIVSA-N 304.418 5.460 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1C1CCCC1 649956436 SCACAJJVPBUJSC-OALUTQOASA-N 311.469 5.303 30 20 DKED Cc1oc2ccccc2c1C=NOc1ccccc1C(F)(F)F 758120475 RJJSYXWNVADZKW-UHFFFAOYSA-N 319.282 5.173 30 20 DKED C=CCC[C@@H](NC(=S)Nc1cccc(C)c1C)c1ccccc1 771851074 PXRQMJNGNDAUJU-LJQANCHMSA-N 324.493 5.297 30 20 DKED C#CC[C@H](N[C@H](C)c1oc2ccccc2c1C)c1ccccc1 773115128 LRLTXZHZBPCVHO-APWZRJJASA-N 303.405 5.156 30 20 DKED CC(C)(C#N)CCCNc1cccc(Oc2ccc(C#N)cc2)c1 153889208 ZCKTWZNRNHJQLS-UHFFFAOYSA-N 319.408 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C)c1F 189872422 UTZCIDNFYLCIHX-UHFFFAOYSA-N 311.400 5.238 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(CC#N)cc1 270260630 IDUVIMYNTUNHKS-UHFFFAOYSA-N 320.436 5.252 30 20 DKED C[C@H](Nc1ccc(C(C)(C)C)cc1)c1ccc(OCC#N)cc1 319933919 ROHOHZRQRCIXGM-HNNXBMFYSA-N 308.425 5.060 30 20 DKED CCC(CC)[C@H](NCc1cccc(F)c1C#N)c1cccs1 428321971 RVEUFJZRUBHJAY-SFHVURJKSA-N 316.445 5.026 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccc(Cl)c1F 461089973 RYIZLNIWXIVLOW-YVEFUNNKSA-N 316.807 5.153 30 20 DKED CO[C@@H](C)c1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1 482003369 UAPUUZUYXLNASP-BTYIYWSLSA-N 320.436 5.145 30 20 DKED CCSCc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1 512277839 IAVHUOJFANDCMG-ZDUSSCGKSA-N 314.429 5.124 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)[C@@H](C)c1ccccc1 559863340 RTUVWVCIGCSIOO-LQWHRVPQSA-N 306.453 5.203 30 20 DKED CCCCCCCCCC(=O)Nc1cc(C)ccc1NC(C)=O 727715869 MXZWXVBMNQKZJU-UHFFFAOYSA-N 318.461 5.033 30 20 DKED Cc1ccsc1C(=O)/C=C/c1csc(-c2ccsc2)n1 733749626 QOMWDKIEYNOEHE-NSCUHMNNSA-N 317.460 5.138 30 20 DKED C[C@H](c1cccs1)N(CCC(C)(C)C#N)Cc1ccccc1 539588551 QRXNYGXROYNUNB-MRXNPFEDSA-N 312.482 5.251 30 20 DKED N#Cc1c(Cl)cccc1SCc1nc2ccccc2s1 541173966 VFPAQUOGPSMUTL-UHFFFAOYSA-N 316.838 5.114 30 20 DKED C=CCC[C@H](Nc1cccc(COCC2CC2)c1)c1ccco1 552275185 NUSLZVQVBYITNF-IBGZPJMESA-N 311.425 5.326 30 20 DKED CC[C@@H](CNc1ccccc1SC[C@H](C)C#N)CC(F)F 594704914 HKIOQOQTYSVAME-CHWSQXEVSA-N 312.429 5.032 30 20 DKED Cc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)ccc1F 745990102 JXLWMPNUJILCJF-YCRREMRBSA-N 317.363 5.092 30 20 DKED CCCCCCCC[S@@](=O)Cc1csc(C(C)(C)C)n1 790139738 MMMVZYZZIJMENO-HXUWFJFHSA-N 315.548 5.050 30 20 DKED CCC(C)(C)C1CCC(=NNc2cccc(C(=O)O)c2C)CC1 1776086239 IZPRUJSXPRVYFZ-UHFFFAOYSA-N 316.445 5.088 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(OC)c1 189909923 GSQLEBXWNIDMNL-UHFFFAOYSA-N 323.436 5.108 30 20 DKED CC[C@H](N[C@H](c1ccc(C)cc1)C1CC1)c1ccc(C#N)cc1 447547862 DUIJIQROAOQQJB-LEWJYISDSA-N 304.437 5.059 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCCC1(C)C 447591117 BUAUXVGAKGBPQC-SFHVURJKSA-N 313.485 5.693 30 20 DKED C=CCCCC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 479602698 YCPJDDRARSALRX-KRWDZBQOSA-N 305.849 5.140 30 20 DKED C[C@H](c1ccco1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 553801861 RSQMGYKDXYOTOU-MRXNPFEDSA-N 316.404 5.011 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1Cl 573858323 FTFZFPQPRCTOEM-HNAYVOBHSA-N 312.844 5.426 30 20 DKED CSc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1Cl 600851337 NORPGRXWJVAWTA-LLVKDONJSA-N 302.830 5.107 30 20 DKED C=CCCCCCN(C)C(=S)Nc1ccc(C(C)C)cc1 739457872 MOWVWPMUYQVRQN-UHFFFAOYSA-N 304.503 5.185 30 20 DKED CC(C)(C#N)CCCOc1ccc(NC2CCCCC2)cc1 771183753 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20 DKED C(=NN(c1ccccc1)c1ccccc1)c1nccc2ccccc12 740760323 RFVYCRIPIRLTDY-UHFFFAOYSA-N 323.399 5.407 30 20 DKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 744016898 VNKJBLJTUKYUQN-RDJZCZTQSA-N 308.425 5.018 30 20 DKED CCCCCCCC(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 746340322 FSCYFCRIFFQIJJ-QGZVFWFLSA-N 324.468 5.286 30 20 DKED CCSc1ccc(C(=O)/C=C\c2cncc3ccccc23)cc1 755606231 BSVZZMJUCLRESB-XFXZXTDPSA-N 319.429 5.243 30 20 DKED C#CCCCN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 766917947 IUPAOWKGFUPQRT-GOSISDBHSA-N 322.452 5.015 30 20 DKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1776697248 CHNUHOLBGCNXSZ-WEKMIXOTSA-N 322.404 5.103 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)C[C@@H]1C 417046385 SRRXTLPPMOUFEV-HNNXBMFYSA-N 314.473 5.191 30 20 DKED Cc1nc(-c2ccc([C@@H](C)Nc3ccc(C#N)cc3)cc2)cs1 507197881 XSMWGRPYJJDOBX-CYBMUJFWSA-N 319.433 5.163 30 20 DKED C[C@H](N[C@@H](C)c1cc2cc(Cl)ccc2o1)c1ccc(C#N)cc1 540596825 JFWHSXLOZHVJSF-STQMWFEESA-N 324.811 5.370 30 20 DKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1-c1cccs1 665405829 KYTSSWBNRFANAX-GASCZTMLSA-N 324.449 5.130 30 20 DKED CO[C@@H](C)c1cccc(N=Cc2c(O)ccc3ccccc23)c1 726890395 KUQFZXBTSPBZMK-AWEZNQCLSA-N 305.377 5.003 30 20 DKED CCCCCCCC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 742131705 MSIPOHFGQODACL-CRAIPNDOSA-N 305.437 5.096 30 20 DKED C[C@@H]1/C(=C/c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 809156333 LCPLSGZHVAODIW-GPILYODUSA-N 323.442 5.255 30 20 DKED CC[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 37748390 TVMZCJCSQYNMRR-KRWDZBQOSA-N 319.235 5.106 30 20 DKED N#CCc1ccc(NCc2ccc(-c3ccccc3)s2)cc1 237835224 YFZVVFRUHARMLD-UHFFFAOYSA-N 304.418 5.093 30 20 DKED C=CCC(CC=C)C(=O)Nc1cccc(COC(C)(C)C)c1C 467356126 RGVBRAINUMHVPJ-UHFFFAOYSA-N 315.457 5.017 30 20 DKED CC(C)(C#N)CCCSCc1ccc(C(F)(F)F)cc1 475879527 IOPHMAHOEPIDRG-UHFFFAOYSA-N 301.377 5.269 30 20 DKED CC(C)(C#N)CCCSCc1ccc(Br)s1 480382652 KFPOQVWQGRQALH-UHFFFAOYSA-N 318.305 5.074 30 20 DKED C=CCC[C@H](NCc1ccc(Cl)cc1C#N)c1ccccc1 480880358 VLKUBGYZWDNYGV-IBGZPJMESA-N 310.828 5.009 30 20 DKED CCC(CC)[C@@H](NCc1ccc(C#N)c(F)c1)c1cccs1 484064935 KKCRMPVDCJNOSN-GOSISDBHSA-N 316.445 5.026 30 20 DKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(OC(C)(C)C)cc1 613242443 DOBZGGCPVDCSFR-HOTGVXAUSA-N 322.452 5.147 30 20 DKED C[C@@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1F 781421936 IXZZSYNOTFIYLE-CHWSQXEVSA-N 324.424 5.324 30 20 DKED CC(C)(CCC#N)COC(=O)c1sc2ccccc2c1Cl 798877640 VJOHRHSKVHRYDN-UHFFFAOYSA-N 321.829 5.041 30 20 DKED Cc1nc(-c2cccc(N[C@H](C)c3cccc(C#N)c3)c2)oc1C 183014427 LABGBMLBZAXITP-CQSZACIVSA-N 317.392 5.003 30 20 DKED C[C@@H](SCc1cc(-c2ccccc2)no1)c1cccc(C#N)c1 443150110 ZBEGTKUDMZUJIX-CQSZACIVSA-N 320.417 5.208 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 480669782 WCKXPSWRNHCTRV-BBATYDOGSA-N 323.333 5.211 30 20 DKED C=CCOc1ccc(CN[C@H](CC)c2ccc(Cl)s2)cc1 512219757 RUAWPWMJCGXSNP-OAHLLOKOSA-N 321.873 5.207 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)s1 531696081 HJPUMEUUGZNTRU-FZMZJTMJSA-N 304.846 5.075 30 20 DKED CC(C)[C@H]1C[C@H](NC2(c3cccc(C#N)c3)CC2)c2ccccc21 576486431 NVCCATHOAFVHEY-RTWAWAEBSA-N 316.448 5.022 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1 609825623 IYCFESUOUKUAKI-OLZOCXBDSA-N 312.394 5.022 30 20 DKED CCSc1ccccc1[C@H](C)N[C@H](C)c1cccc(C#N)c1 610830041 ZBLADQATMRSWBE-CABCVRRESA-N 310.466 5.082 30 20 DKED Fc1ccc2oc(C=NOc3ccccc3C(F)(F)F)cc2c1 754708973 GPUUDVGMSKLWAE-UHFFFAOYSA-N 323.245 5.004 30 20 DKED C#CC[C@H](N[C@@H](C)c1cc(Cl)sc1Cl)c1ccccc1 773106703 LQOXUTDVECVTFI-FZMZJTMJSA-N 324.276 5.470 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1F 108407646 VEZOSUIYWJIDGL-UONOGXRCSA-N 314.429 5.251 30 20 DKED C[C@H](N[C@H](c1ccc(F)cc1)C1CCCC1)c1cccc(C#N)c1 537296542 CUYWQDRCQQHZPV-BTYIYWSLSA-N 322.427 5.279 30 20 DKED CC(C)(C)C[C@H](NCc1ccc(C#N)s1)c1ccc(F)cc1 540589204 QKIJXCABCSGLAE-KRWDZBQOSA-N 316.445 5.026 30 20 DKED CC(C)c1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550829095 AVJXVFRLACUPLI-PGRDOPGGSA-N 320.480 5.896 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OC)c1C 613900157 AIJQUMKIDXBDSQ-UHFFFAOYSA-N 323.436 5.108 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccncc1 682803661 KJTNANUKCSBXIO-INIZCTEOSA-N 322.452 5.066 30 20 DKED CCCCCCCCC(=O)N(C)[C@H](C)c1sc(CC)nc1C 741578967 QJAMEOSBPLKKOC-OAHLLOKOSA-N 324.534 5.284 30 20 DKED Oc1c(Cl)cc(Cl)cc1C=Nc1cccc(C(F)F)c1 750950242 QVRWWUUQGZWJRM-UHFFFAOYSA-N 316.134 5.387 30 20 DKED CC1(C)CCC[C@H](CC(=O)[C@@H](C#N)c2nccc3ccccc23)C1 792103656 LOCSFPCPUZLFQJ-CRAIPNDOSA-N 320.436 5.018 30 20 DKED CN(CCCC(C)(C)C#N)Cc1ccccc1-c1ccccc1 472248617 FBEZZXDEGXHSEX-UHFFFAOYSA-N 306.453 5.115 30 20 DKED N#C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)C1CCCCC1 522629550 SQMPSEVMIXCFAZ-RBUKOAKNSA-N 324.493 5.094 30 20 DKED Cc1ccccc1[C@@H](N[C@@H](C)c1ccc(C#N)cc1)C(C)(C)C 539494776 PCOKRCRCGKKAIL-OXJNMPFZSA-N 306.453 5.305 30 20 DKED CCCCCCCCC(=O)[C@H](C#N)c1nc(C(C)C)cs1 747197967 PZNYHLICQXCURK-AWEZNQCLSA-N 306.475 5.193 30 20 DKED CC[C@H](C)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 795206041 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C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CCCC(C)(C)C#N 475729070 MKMCXHNROJCKMK-LSDHHAIUSA-N 306.881 5.094 30 20 DKED Cc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)c1 521280925 HDSWHWTYOACEMF-WIYYLYMNSA-N 306.453 5.389 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1 537297613 YXZPRVQEXHBYIE-KKSFZXQISA-N 304.437 5.140 30 20 DKED C[C@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(C#N)c(F)c1 539604167 IHNCVYLCXOSKFA-GJZGRUSLSA-N 318.395 5.262 30 20 DKED C=C[C@H](CC(=O)N(C1CC1)[C@@H](C)c1ccccc1)c1ccccc1 559681236 LJEMHHGFMSQCRO-ZWKOTPCHSA-N 319.448 5.099 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1cc(Cl)sc1Cl 562039987 UPSFPIVFQWIZQY-SECBINFHSA-N 305.274 5.035 30 20 DKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](CC1CCC1)c1ccccc1)CC2 564433758 VYGYIXOAIDJVMT-VXKWHMMOSA-N 316.448 5.067 30 20 DKED CCCCCCCC(=O)c1ccc(OCc2cc(C)on2)cc1 727390881 ZYEJMTJWBUKQRL-UHFFFAOYSA-N 315.413 5.105 30 20 DKED O=C(/C=C/c1csc(Cl)c1Cl)c1ccccc1F 761475299 PCIUYOFDSBWVJZ-AATRIKPKSA-N 301.169 5.090 30 20 DKED C=CCC[C@H](N[C@H](C)c1sc(C)nc1C)c1ccccc1 181507410 KSUNFAOIDKYXIV-PBHICJAKSA-N 300.471 5.118 30 20 DKED Cc1cccc2c1CC[C@@H]2N[C@@H](CCCC#N)c1ccccc1 340453971 SMVILZRNSQZBDD-SFTDATJTSA-N 304.437 5.007 30 20 DKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C2CC2)cc1 419334199 GOPYZFVBXXXKQI-MRXNPFEDSA-N 318.464 5.216 30 20 DKED C=CCC[C@H](NCc1ccc(C#N)cc1Cl)c1ccccc1 439434838 UABDMTCQCWMTFR-IBGZPJMESA-N 310.828 5.009 30 20 DKED C=CCC[C@H](N[C@@H](C)c1sccc1OC)c1ccccc1 471578776 RUBHDBOKZZMIFH-HOCLYGCPSA-N 301.455 5.115 30 20 DKED CC(C)[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)cc1 574611241 HGMWFEHPFHQUCA-WOJBJXKFSA-N 324.855 5.186 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(OC(C)C)cc1)c1ccc(C#N)cc1 584699845 MKUBFCBPGPNBHI-IIBYNOLFSA-N 322.452 5.147 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2ccccc2)o1 610830509 YDTFRVXEGIFVME-CVEARBPZSA-N 316.404 5.230 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1scnc1C1CC1 782098136 QMUXYGYUBZBVGK-UHFFFAOYSA-N 319.433 5.193 30 20 DKED C=C(C)[C@@H](N[C@H](CC)c1cccs1)c1ccc(F)c(F)c1 480698731 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Cc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)s1 744868665 GGPCKOVVMSVXRU-PLNGDYQASA-N 303.235 5.321 30 20 DKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747194167 VQZAUNNWWZKZSP-UONOGXRCSA-N 306.475 5.049 30 20 DKED C#CC[C@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccccc1 773106708 LQOXUTDVECVTFI-RISCZKNCSA-N 324.276 5.470 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccccc1CC 794996857 WOQZBUZCDZGAJL-UHFFFAOYSA-N 324.493 5.024 30 20 DKED C=CCC[C@H](Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccco1 796961013 HMNAOESLPBDCPH-VDGAXYAQSA-N 322.452 5.388 30 20 DKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1csc2ccccc12 810216963 UCJZVAHJILIJCX-DJJJIMSYSA-N 318.445 5.111 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(F)cc1 887738700 FYTNCILURIZYCP-GOSISDBHSA-N 305.437 5.240 30 20 DKED N#CCCCOc1cccc(/C=C/c2nc3ccccc3s2)c1 110424763 DOAIBQPLOCZGEL-ZHACJKMWSA-N 320.417 5.149 30 20 DKED CCCCCCCC(=O)N1CCCCC[C@H]1c1ccc(C)o1 303749204 LBKMMQHWMMFMHB-KRWDZBQOSA-N 305.462 5.392 30 20 DKED C[C@H](Nc1ccc2oc3ccccc3c2c1)c1ccc(C#N)cc1 324243184 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Cc1nc(S[C@H](C)c2ccc(C#N)cc2)[nH]c1-c1ccccc1 488261121 FSXSDUYZFSEVNQ-CQSZACIVSA-N 319.433 5.110 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)cc1 512658967 BGHOUUJIYXBSFG-SGTLLEGYSA-N 316.807 5.153 30 20 DKED CCCC[C@H](CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 521734337 MFNSGKGVMQUXOA-CABCVRRESA-N 318.486 5.093 30 20 DKED C=CCC[C@H](NCc1csc(C(F)(F)F)c1)c1ccco1 624261064 GYTMUJBNBXVXFV-LBPRGKRZSA-N 315.360 5.157 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cccs3)s2)cc1 734303741 YEMFHECUCGZUIL-CMDGGOBGSA-N 311.431 5.076 30 20 DKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]1c1cc(C)no1 822163270 GULKDIOIZLHNOJ-RDJZCZTQSA-N 320.477 5.033 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@@H]1CCCC(C)(C)C1 330180352 NHSACXMXSVLJCR-OAHLLOKOSA-N 311.429 5.190 30 20 DKED C[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)c1cccc(C#N)c1 538528557 NQDUVXPJPWCUNT-ZDUSSCGKSA-N 319.408 5.170 30 20 DKED Cc1cc2c(cc1C)[C@H](N[C@H](C)c1cccc(C#N)c1)CCS2 614633866 JECXHNGSPQVNFI-DNVCBOLYSA-N 322.477 5.063 30 20 DKED CC(C)(C)Sc1ccc(NCc2cc(C#N)cs2)cc1 770560067 WGANQVFGTOKIPR-UHFFFAOYSA-N 302.468 5.122 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1cc(C)ccc1C 799900056 FRUGLKFSYMCQJH-UHFFFAOYSA-N 310.466 5.231 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1csc(C(F)(F)F)c1 925186371 WLMBTFDIUVQRSJ-MNOVXSKESA-N 324.371 5.050 30 20 DKED OC(CC1CC1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 328938423 RNKUWEVYSJWNSJ-UHFFFAOYSA-N 318.392 5.382 30 20 DKED CCCc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 537951265 GXSNQNHASCLMFK-UTKZUKDTSA-N 306.453 5.335 30 20 DKED CC1(C#N)CCC(Nc2ccc(-c3cnc(C4CC4)o3)cc2)CC1 560098686 TWLPQJXCIKAZPA-UHFFFAOYSA-N 321.424 5.103 30 20 DKED CCSc1ccc(Cl)cc1N[C@H](C)c1cccc(C#N)c1 600847976 FHFUZWAEESEWEX-GFCCVEGCSA-N 316.857 5.497 30 20 DKED CCCCCCCC[C@H](C)C(=O)Nc1c(C)noc1C1CC1 832017502 LONVOZOCKMAODV-ZDUSSCGKSA-N 306.450 5.186 30 20 DKED CC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc(C)ccc1C 858377050 UVLGZZFICQLNLB-DYESRHJHSA-N 322.452 5.008 30 20 DKED CC(C)=CCC/C(C)=C/C=NNc1ncccc1C(F)(F)F 915050780 CDGZJNXDBWWYPR-BDJZURQXSA-N 311.351 5.191 30 20 DKED CC(C)[C@@H]1CCCCCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776034107 OCCQSOFLBMEZCN-ZDUSSCGKSA-N 322.836 5.042 30 20 DKED Cc1c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)oc2ccccc12 90665255 GTIAEBHWVBXECV-APWZRJJASA-N 318.420 5.437 30 20 DKED N#CCCSc1ccccc1NCc1cccc(F)c1Cl 92941106 GGZPLFYWYYBKNX-UHFFFAOYSA-N 320.820 5.097 30 20 DKED Cc1c([C@H](C)N[C@H](C)c2cccc(C#N)c2)oc2ccccc12 178176819 JQDTVNLYJCSVIM-CABCVRRESA-N 304.393 5.025 30 20 DKED C=C(C)[C@H](N[C@@H](CC)c1ccccc1O)c1ccc(F)c(F)c1 186446385 XWEJQKNIZUWXII-HKUYNNGSSA-N 317.379 5.029 30 20 DKED CCc1c([C@H](C)N[C@H](C)c2ccc(C#N)cc2)oc2ccccc12 325107853 BKPVXKFHXUYLSQ-CABCVRRESA-N 318.420 5.279 30 20 DKED CCC[C@](C)(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 483467266 BILSGJTZOBQQNQ-KDOFPFPSSA-N 318.486 5.093 30 20 DKED CC(C)(C)[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1 563330078 JQACLYQMAXVVNU-UXHICEINSA-N 322.427 5.062 30 20 DKED CCc1c([C@H](C)N[C@H](C)c2cccc(C#N)c2)oc2ccccc12 611438281 CQOFIUSBGBTHGB-CABCVRRESA-N 318.420 5.279 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccccc1OC 727806707 AGMIPWAYTSWRNQ-GOSISDBHSA-N 317.473 5.109 30 20 DKED CC(C)n1cc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cn1 732714311 PPMWSCPFIXIKTE-QXMHVHEDSA-N 316.404 5.027 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)CC2CCC(C)(C)CC2)n1 752511508 CWGBJUDUEKAMPR-AWEZNQCLSA-N 318.486 5.049 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(OCCCC)cc1)c1ccncc1 793539197 FBBCHPWCQJVECW-LAUBAEHRSA-N 324.468 5.229 30 20 DKED CC(C)n1nccc1/C=C/C(=O)c1ccc(-c2cccs2)cc1 794937555 KFIXLHKYUDWTND-MDZDMXLPSA-N 322.433 5.089 30 20 DKED C[C@@H](Nc1ccc(SC(C)(C)C)cc1)c1cc(C#N)ccn1 902937325 JGFBYFOKRXQAHP-CYBMUJFWSA-N 311.454 5.017 30 20 DKED CCC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC)cc1 90665391 PDLHHQYJNHGLEB-LEWJYISDSA-N 322.452 5.171 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C#N)cc1 340450968 YPZIBSMIDPIIAT-NHCUHLMSSA-N 317.436 5.034 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H](C)c1ccc(Cl)s1 410355715 VAHLFLQVIPFFNR-GFCCVEGCSA-N 319.857 5.262 30 20 DKED C=CC[C@H](C(=O)Nc1cccc(SC)c1C)c1ccccc1 489652767 JJQKEDADLXADDG-INIZCTEOSA-N 311.450 5.015 30 20 DKED C[C@H](N[C@H](c1ccccc1F)C1CCCC1)c1cccc(C#N)c1 540591025 DDPWIPWTEIBDAZ-BTYIYWSLSA-N 322.427 5.279 30 20 DKED N#CCCCCN[C@@H]1CCCCC[C@@H]1c1ccc(Cl)cc1 581419988 LNMZLTQZJDAUCS-QZTJIDSGSA-N 304.865 5.040 30 20 DKED Cc1ccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2F)s1 733206514 MKGZJYVETDGCPE-UTCJRWHESA-N 314.303 5.111 30 20 DKED COCc1cccc(/C=C/C(=O)c2cccc(Cl)c2Cl)c1 742435340 VYGSAFVCEMCXGQ-CMDGGOBGSA-N 321.203 5.036 30 20 DKED O=C(/C=C/c1cncc2ccccc12)c1cc2ccccc2s1 780189415 ZQCAUDNTCKVGEQ-MDZDMXLPSA-N 315.397 5.346 30 20 DKED N#CCCCCCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 807922547 UAZSRLNTCUAQHA-UHFFFAOYSA-N 320.396 5.515 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1C=C 489087530 IWNOZFXXBPCZMR-QGZVFWFLSA-N 312.457 5.111 30 20 DKED N#Cc1ccc(S[C@H](Cc2ccccc2)c2ccccc2)nc1 496591504 JDXGZXCISKVKJY-LJQANCHMSA-N 316.429 5.029 30 20 DKED C[C@@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1F 512280240 OGGNMBTUNHANCK-QVKFZJNVSA-N 322.427 5.279 30 20 DKED C=CCOc1cccc(CN[C@@H](C)c2cccc3ccccc23)c1 521823122 INHOUNFLNQUKNY-KRWDZBQOSA-N 317.432 5.255 30 20 DKED C=CCCC[C@@H](C)Sc1nnc(-c2c[nH]c3ccccc23)o1 537072035 PQMRMVIKSQZLOD-GFCCVEGCSA-N 313.426 5.055 30 20 DKED C=CCC[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1 611394431 JAFRVYRWEUUUAB-FGZHOGPDSA-N 316.448 5.233 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 766018913 JQHFVCSFGAQQNM-YVEFUNNKSA-N 321.251 5.356 30 20 DKED C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1cccc(C#N)c1 603497574 BMRPIUILUSMOFE-GFCCVEGCSA-N 319.235 5.058 30 20 DKED O=C(/C=C/c1ccc(F)cc1)c1ccc(SC(F)F)cc1 734981354 QFPMDHPDLGEPHR-XCVCLJGOSA-N 308.324 5.037 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(C(C)(C)C)cc1)c1ccncc1 746048115 WBCBNZPANKAGPT-OXJNMPFZSA-N 308.469 5.347 30 20 DKED CCC(=CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)CC 759538888 NBMPZMQRGULYBQ-INIZCTEOSA-N 324.449 5.041 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1ccccc1SC(C)(C)C 815626953 PJZJHJYYCJSRFY-OAHLLOKOSA-N 318.530 5.558 30 20 DKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(F)ccc1F 90665046 WYROQJWSMBVVCE-MOPGFXCFSA-N 314.379 5.051 30 20 DKED CC(C)(C#N)CCCCSCC1CCC(C(F)(F)F)CC1 435896342 DJMYJEYHLRILCD-UHFFFAOYSA-N 321.452 5.808 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCCCc1ccccc1 484765647 FTXWICXDVICFBA-MRXNPFEDSA-N 310.466 5.126 30 20 DKED CCCC[C@H](CC)CC(=O)Nc1ccc(C(C)(C)C#N)cc1 522666944 HZTFPKDTPSOUSW-HNNXBMFYSA-N 300.446 5.033 30 20 DKED C=CCC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1 539359985 VVESBDFPAFDXSJ-NRFANRHFSA-N 318.464 5.285 30 20 DKED O=C1/C(=C/c2cnc(C3CCC3)s2)[C@H]2CCCc3cccc1c32 763288676 IPPCUHTWRHTZMV-ZXMBATIKSA-N 321.445 5.110 30 20 DKED C#CCCCCC(=O)Nc1ccc(SC(C)(C)C)cc1C 773296645 GDFQJTKRZRXSEQ-UHFFFAOYSA-N 303.471 5.018 30 20 DKED CC(C)(C)c1cnc(/C=C/C(=O)c2csc(Cl)c2)s1 790608193 DQVLNZVNYPNDMS-SNAWJCMRSA-N 311.859 5.052 30 20 DKED CC[C@@H](CCC(F)(F)F)N[C@@H](CCCC#N)c1ccccc1 872072733 JDUCEPINLYDXGX-HOTGVXAUSA-N 312.379 5.132 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccccc1F 918723856 YZRPAFWLPNSZAF-UHFFFAOYSA-N 310.482 5.205 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccc2[nH]1 189908862 NQKKRNNAKSUZJL-UHFFFAOYSA-N 318.420 5.272 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2CC2)cn1 356159969 AZYWQLOCXBFWFL-UHFFFAOYSA-N 320.436 5.063 30 20 DKED C=CCCc1ccccc1NC(=O)c1cccc(Cl)c1Cl 410354348 PMXOVHRDSIOGAV-UHFFFAOYSA-N 320.219 5.364 30 20 DKED CC(C)c1cnc(SCCCCC(C)(C)C#N)n1C(C)C 436208718 KNVJFAIORICXFS-UHFFFAOYSA-N 307.507 5.400 30 20 DKED C=CCCc1ccccc1NC(=O)c1oc2c(F)cccc2c1C 669675483 RLMDRJRUAYWJLI-UHFFFAOYSA-N 323.367 5.251 30 20 DKED Cc1ncsc1/C=C\C(=O)c1ccc(Oc2ccccc2)cc1 742429457 RBJKISNGLWBWLK-QXMHVHEDSA-N 321.401 5.140 30 20 DKED C=CC[C@@H](N[C@H](CC)c1sccc1Cl)c1ccncc1 883190255 YOHYFMZZONDGCD-HUUCEWRRSA-N 306.862 5.155 30 20 DKED CCCCCCCCCCCN(C)Cc1ccccc1C(=O)O 1776784579 KDEMDTPBPVWHAA-UHFFFAOYSA-N 319.489 5.347 30 20 DKED C[C@H](Sc1nc(-c2ccccc2)co1)c1ccc(C#N)cc1 436257601 GDYTZEIFBVLODR-ZDUSSCGKSA-N 306.390 5.067 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(C)c1 475569681 HEMFDZPBVBBUOM-UHFFFAOYSA-N 322.452 5.169 30 20 DKED CC(C)(C)C[C@H](NC(=O)CCCCC#N)c1ccc(Cl)cc1 593984016 OJDMHWSIZOFVPE-INIZCTEOSA-N 320.864 5.017 30 20 DKED Cc1cc(/C=C\C(=O)c2ccsc2)ccc1Oc1cccnc1 732714133 MWCJFUBIOLOONQ-XQRVVYSFSA-N 321.401 5.140 30 20 DKED CCCCCCCC(=O)Oc1ccccc1Oc1ccccn1 748677893 QUIOIJIECAGNGX-UHFFFAOYSA-N 313.397 5.140 30 20 DKED C[C@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)cc1F 781422467 PVLOGCSQEIAMKV-JTQLQIEISA-N 322.355 5.185 30 20 DKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1nccc2ccccc12 792106444 QRUPHTHWHTWYPZ-YJBOKZPZSA-N 308.425 5.018 30 20 DKED O=C(/C=C/c1csc2ccccc12)c1ccc(F)c(F)c1 810228473 VPVZJMMGBMKESL-SOFGYWHQSA-N 300.329 5.076 30 20 DKED C=CCN(CC=C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 915304399 SCIFVMRYJPTCAV-UHFFFAOYSA-N 320.396 5.308 30 20 DKED Cc1ccc(C)c(CNc2ccccc2SC[C@@H](C)C#N)c1 519424161 UGFLZVIJVWXQRI-HNNXBMFYSA-N 310.466 5.167 30 20 DKED CC1(C)CC[C@@H]2C[C@H](NCc3ccc(C#N)s3)c3cccc1c32 538493301 ZQTVIIHLMKYAFB-ACJLOTCBSA-N 322.477 5.009 30 20 DKED Cc1csc(-c2cccc(N[C@H](C)c3cccc(C#N)c3)c2)n1 540833681 QRDMUVZEYQMGBZ-CQSZACIVSA-N 319.433 5.163 30 20 DKED C/C(=C/c1ccccc1)CN[C@@H](CCCC#N)c1ccccc1 577166469 DFQDYQNKLNOFHQ-RGJVZEKDSA-N 304.437 5.115 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cnc(C2CCC2)s1 760261534 DMJXWPAFWHVCBR-MDZDMXLPSA-N 322.433 5.096 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2s1 776075434 XQFBVRPMZHEORS-ZIAGYGMSSA-N 314.454 5.079 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1ccc(C#N)cc1 301093158 MGWQHRLAGFVJIG-CYBMUJFWSA-N 319.433 5.163 30 20 DKED C=CCC[C@H](N[C@@H](c1ccccc1)c1nccs1)c1ccco1 368608194 MDRGOQXSLHOXIJ-WMZOPIPTSA-N 324.449 5.123 30 20 DKED C[C@@H](S[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1 437279676 YBUSSMARMSQEIC-CHWSQXEVSA-N 312.394 5.022 30 20 DKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CCCC#N)cc1 462205120 XRBMYHNSFSVAGX-OAHLLOKOSA-N 324.449 5.172 30 20 DKED C[C@H](C#N)CSc1ccccc1NC[C@H]1CCCCC1(F)F 594706020 RZQVDCDKQSBLJG-ZIAGYGMSSA-N 324.440 5.176 30 20 DKED CCCCCCCCC(=O)N(C)[C@@H](C)c1sc(C)nc1C 730201925 GACXSCBPSCFRHA-AWEZNQCLSA-N 310.507 5.030 30 20 DKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cccc(F)c1 170991713 WPGYPAYRDAUYPB-KGLIPLIRSA-N 314.429 5.251 30 20 DKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)C[C@H]1CCCCC1(C)C 329181252 DSKQMFJEYOZONG-CKEIUWERSA-N 322.493 5.083 30 20 DKED N#CCCC[C@@H](N[C@H]1CCCc2ccccc21)c1ccccc1 340454894 SUKSMEPDDULGPV-RTWAWAEBSA-N 304.437 5.089 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747197642 LBHNWSLYHDRYKP-ZIAGYGMSSA-N 306.475 5.049 30 20 DKED CCCCCCCCN1CCCC[C@H]1c1nnc(C2CCC2)o1 805780662 JQNDZHZKYZTEPW-KRWDZBQOSA-N 319.493 5.225 30 20 DKED C=C(C)COc1cc(CNc2ccc3occc3c2)ccc1OC 864017407 JQJIQZVEWUBZTH-UHFFFAOYSA-N 323.392 5.008 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 174055511 KWDZEALXTOCBKP-LSDHHAIUSA-N 310.466 5.082 30 20 DKED N#CCCCOc1cccc(/C=C\c2nc3ccccc3s2)c1 207618501 DOAIBQPLOCZGEL-KHPPLWFESA-N 320.417 5.149 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1F 340444136 CEEFCABVPICULY-UXHICEINSA-N 310.416 5.302 30 20 DKED C[C@H](NCC1CCC(C#N)CC1)c1ccc(-c2cccs2)cc1 442849808 CPSAUEJBKSJHCG-GTPINHCMSA-N 324.493 5.396 30 20 DKED CC[C@@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1ccc(C#N)cc1 447596097 PNMQBKOPFOGSKK-SCLBCKFNSA-N 322.383 5.245 30 20 DKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1cc2c(ccc3ccccc32)o1 453287496 GDRPZYXOXMMEBY-ZOBUZTSGSA-N 318.420 5.319 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccccc1 559863023 NCWXECGQORJKSF-AGOPTVSRSA-N 318.464 5.203 30 20 DKED C[C@H](NCCCCC#N)c1ccc(O[C@@H](C)c2ccccc2)cc1 595009866 DRKWLKHBCIQAHU-ROUUACIJSA-N 322.452 5.171 30 20 DKED CC(C)c1nc(CS[C@@H](C)c2ccc(C#N)cc2)cs1 609825396 VDKSHKBESLYLTR-LBPRGKRZSA-N 302.468 5.133 30 20 DKED N#Cc1cc(N[C@@H](CC2CC2)c2ccccc2)nc2ccccc12 610280965 NGAWVMDUGSPSMF-FQEVSTJZSA-N 313.404 5.060 30 20 DKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2)o1)c1cccc(C#N)c1 610830510 YDTFRVXEGIFVME-HOTGVXAUSA-N 316.404 5.230 30 20 DKED C=CC[C@H](C)C(C)=NNc1nc(Cl)c(Cl)cc1Cl 727776816 HQEDBSRSVYDESU-ZETCQYMHSA-N 306.624 5.042 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(CCCC)cc1)c1ccncc1 766018060 FRDBZSGMHCWNQI-LAUBAEHRSA-N 308.469 5.392 30 20 DKED C=C[C@@H](CC(=O)Nc1c(Cl)ccc(F)c1C)c1ccccc1 448512135 XQXWLBDTEWZDAO-ZDUSSCGKSA-N 317.791 5.086 30 20 DKED CC(C)(C)C[C@@H](NCc1ccc(CC#N)cc1)c1ccccc1 542255063 AVZYUVXWIXNUME-HXUWFJFHSA-N 306.453 5.020 30 20 DKED C[C@@H](NCc1cc(-c2ccccc2)cs1)c1cccc(C#N)c1 610345031 QJFUKTWMCTZURU-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C[C@H]1C/C(=C\c2coc(-c3ccccc3)n2)C(=O)c2ccccc21 751535822 NDICUWVFSVHTFX-AOHITCTBSA-N 315.372 5.115 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@@H](CCCC#N)c1ccccc1)CC2 340451837 PDRRLQXBDJUIHP-SFTDATJTSA-N 304.437 5.007 30 20 DKED C[C@@H](SCc1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 443146508 PUDHGANYPIATRA-CQSZACIVSA-N 320.417 5.208 30 20 DKED C[C@H](Nc1ccc2nc(C3CC3)sc2c1)c1cccc(C#N)c1 537534476 WKZYQLBIWQOFMF-LBPRGKRZSA-N 319.433 5.218 30 20 DKED C=CCC[C@H](NCc1ccccc1OC(F)F)c1ccccc1 540456168 GFUBWWIAHQJPLR-KRWDZBQOSA-N 317.379 5.085 30 20 DKED CC(C)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 556908806 WDLZUWKEZAFZTD-NRFANRHFSA-N 306.453 5.335 30 20 DKED CC(=NNc1ccc(C)cn1)C(c1ccccc1)c1ccccc1 727262879 BLYOMBKCXSSNSV-UHFFFAOYSA-N 315.420 5.010 30 20 DKED C[C@@H](CC=NOc1ccccc1C(F)(F)F)c1ccccc1 755815294 GPKUWTKBOLJUGF-ZDUSSCGKSA-N 307.315 5.264 30 20 DKED C=C(C)CN(CC)C(=S)Nc1c(C(C)C)cccc1C(C)C 915995743 RDFNOFVQRKDTQK-UHFFFAOYSA-N 318.530 5.528 30 20 DKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 303745931 FXZSJXDTGRWPBH-INIZCTEOSA-N 314.388 5.524 30 20 DKED Cc1noc(C)c1[C@H](C)C/C(O)=N/[C@@H]1CCCCC12CCCC2 329599081 DIXRFZKVSJALSJ-CZUORRHYSA-N 318.461 5.245 30 20 DKED Cc1cccc2c1CC[C@@H]2N[C@H](CCCC#N)c1ccccc1 340453970 SMVILZRNSQZBDD-RTWAWAEBSA-N 304.437 5.007 30 20 DKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(C#N)cc1 539496810 MESCNTHNZCZESR-JLTOFOAXSA-N 324.855 5.404 30 20 DKED CCC(CC)[C@H](NCc1ccc(F)cc1C#N)c1cccs1 540381761 XYROUSUZZAEXFD-SFHVURJKSA-N 316.445 5.026 30 20 DKED C/C(=C/c1ccccc1C(F)(F)F)CNCC(C)(C)CCC#N 562894685 RNHPYUPGZAFEPE-KAMYIIQDSA-N 324.390 5.028 30 20 DKED Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H](CCCC#N)c1ccccc1 581375556 LXYSNVSCQRQWRA-UIFIKXQLSA-N 318.464 5.568 30 20 DKED CC(C)(c1ccc(NC2CCC(C#N)CC2)cc1)C(F)(F)F 602636486 INYXKCMYXUVELV-UHFFFAOYSA-N 310.363 5.021 30 20 DKED CCC/C(C)=C\C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 729375566 LCJOMDKBCNQURZ-QINSGFPZSA-N 320.392 5.035 30 20 DKED O=C(/C=C/c1ccccc1Cl)c1cccc(-c2ccncc2)c1 741472472 JSPGHLNAJWBRIN-CMDGGOBGSA-N 319.791 5.298 30 20 DKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H]2CCCC(C)(C)C2)n1 756573246 WYXSYHDCHSAOFB-KBPBESRZSA-N 318.486 5.049 30 20 DKED Cc1cc2cc(C(=O)/C=C/c3nc(Cl)cs3)oc2cc1C 759086120 ZKOYBQLPOPWWDZ-ONEGZZNKSA-N 317.797 5.056 30 20 DKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cncs2)c1 787172285 VGMKNPCNGXEGBX-MDZDMXLPSA-N 305.402 5.015 30 20 DKED C=CCC[C@@H](NCc1ccc2nc(C)ccc2c1)c1ccccc1 437773777 JZKHPLFSPITMBB-OAQYLSRUSA-N 316.448 5.340 30 20 DKED N#CCCSc1ccccc1NCc1cccc(C(F)F)c1 480140243 FZTDXRCNUZWXBR-UHFFFAOYSA-N 318.392 5.242 30 20 DKED Cc1cc(C)c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1C 540151857 BJGWRPMIILPTAS-NQIIRXRSSA-N 306.453 5.308 30 20 DKED C/C(=C\c1ccccc1)CN[C@@H](CCCC#N)c1ccccc1 577166464 DFQDYQNKLNOFHQ-LAYTVVDLSA-N 304.437 5.115 30 20 DKED CCCn1c(SCCC(C)(C)C#N)nc2cc(Cl)ccc21 610166811 LNNPJIUORXFVNN-UHFFFAOYSA-N 321.877 5.132 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(C)C)n1 476091224 QKDDHEGLXLETJE-UHFFFAOYSA-N 322.452 5.309 30 20 DKED C=CCCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485712068 XPYMUFXEQFFRIT-UHFFFAOYSA-N 303.764 5.051 30 20 DKED CCC[C@@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1C#N 499780164 JUVODAGDYLDHMU-CYBMUJFWSA-N 312.438 5.052 30 20 DKED C[C@H](N[C@@H](C)c1ccc(F)c2ccccc12)c1cccc(C#N)c1 551039153 MHCWFIYUOLWUQF-GJZGRUSLSA-N 318.395 5.262 30 20 DKED C[C@@H](Nc1cccc2c1ccn2C(F)F)c1cccc(C#N)c1 600857488 OSCORWKQGSDGPY-GFCCVEGCSA-N 311.335 5.081 30 20 DKED C=CCCCCC[C@H](C)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 793556272 WPUNMWSCXMUIJH-DBVUQKKJSA-N 319.464 5.160 30 20 DKED CC(/C=C\C(=O)c1cncs1)=C/c1cccc(C(F)(F)F)c1 806573289 HTEWWQQYGRLQMC-FUVGTJSASA-N 323.339 5.004 30 20 DKED Cc1cc(F)ccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 815635891 LOAVIZUHXKFEIV-UZLBHIALSA-N 310.416 5.220 30 20 DKED C[C@H](c1ccc(Cl)cc1)[S@](=O)CCCCC1(C#N)CCC1 899276068 HYBNHWNWZOKJHL-SPLOXXLWSA-N 323.889 5.014 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329550546 CQVQYPNTYWJJIB-HRCADAONSA-N 323.440 5.271 30 20 DKED N#Cc1cccc(CN[C@@H]2CCc3ccc(-c4ccccc4)cc32)c1 495151837 AASJSOQGKVRZDH-HSZRJFAPSA-N 324.427 5.002 30 20 DKED C=CCC[C@@H](Nc1cccc(COCc2ccco2)c1)C1CC1 561801232 ZDRJPLYSHWUXIZ-HXUWFJFHSA-N 311.425 5.153 30 20 DKED CC(C)Sc1ccc([C@H](C)N[C@H](C#N)c2ccccc2)cc1 595415367 PNSDMXQCIQPUOA-HNAYVOBHSA-N 310.466 5.103 30 20 DKED O=C(/C=C\c1cccc(O)c1)c1ccc(-c2ccccc2)s1 747188012 DPHWVNVTXKPFAK-KTKRTIGZSA-N 306.386 5.017 30 20 DKED Cc1cccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)c1 751514130 WPUHULHMOOOHOP-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C[C@H]1C[C@H](Nc2ccc(CCC#N)cc2)c2ccsc2S1 903298592 XQVAZRIUFXXDAP-LRDDRELGSA-N 314.479 5.242 30 20 DKED CC(O)=Nc1cccc(/C(O)=N/[C@H]2CCCCC23CCCC3)c1 329732984 JGVTURRTHXOFQR-KRWDZBQOSA-N 314.429 5.102 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1cccc(COc2ccccc2)c1C 466425935 NUGXLMIHUWMELN-MRXNPFEDSA-N 323.436 5.115 30 20 DKED CSc1ccc2c(c1)[C@H](N[C@H](C)c1cccc(C#N)c1)CCC2 592387614 YFNXJRRVYLEOSS-JLTOFOAXSA-N 322.477 5.008 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(CF)cc1 777542666 WPFLEIWOIWYQPS-CQSZACIVSA-N 314.429 5.162 30 20 DKED CC(C)(C)c1cnc(/C=C\C(=O)c2ccc(Cl)s2)s1 790599075 RXKNHKMLDFFRLL-DAXSKMNVSA-N 311.859 5.052 30 20 DKED CCCCCCCCCCCN(C)[C@H]1CC[C@@H](CC(=O)O)C1 1776784557 FTHGKOCIUUYPQZ-MSOLQXFVSA-N 311.510 5.092 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(SC)o1 189871240 PVLSUXBRLNSEBF-UHFFFAOYSA-N 315.438 5.106 30 20 DKED N#CCCC[C@H](NCc1ccc(F)cc1Cl)c1ccccc1 353916899 RRAPUOZMVKLRSF-SFHVURJKSA-N 316.807 5.004 30 20 DKED CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C)(C#N)CC1 445415966 GIEJTTOYLFLTGL-HNNXBMFYSA-N 311.256 5.070 30 20 DKED Cc1ccccc1[C@H](N[C@@H](C)c1ccc(C#N)cc1F)C(C)C 512659996 KYBUEMIVEZVJFT-MGPUTAFESA-N 310.416 5.054 30 20 DKED CC(C)Cc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 560565690 ZBVVKHAWUDAIMD-QFIPXVFZSA-N 320.480 5.410 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1cccc(CC)c1 799901323 YTXWKOKGBPCPOO-UHFFFAOYSA-N 310.466 5.177 30 20 DKED C[C@@H](Nc1cccc(CCC(F)(F)F)c1)c1ccc(C#N)cc1 132900605 ZJYKMUMMRANHCR-CYBMUJFWSA-N 318.342 5.226 30 20 DKED CC[C@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1 447512023 WPTJPMFVYIUGIB-VQTJNVASSA-N 324.855 5.404 30 20 DKED CCCCCCCCC(=O)Nc1ccccc1-c1ncc(C)[nH]1 769322726 PNPCWZBMIYHOEM-UHFFFAOYSA-N 313.445 5.074 30 20 DKED C=CC[C@H](CC)N[C@@H](C)c1ccc(SC(F)F)c(OC)c1 798937428 QRHCNBKUWLOFJX-AAEUAGOBSA-N 315.429 5.015 30 20 DKED CCCCCCCCSc1nnc(-c2ccccc2OC)o1 915792126 NSRIKHAMENVSDA-UHFFFAOYSA-N 320.458 5.198 30 20 DKED CCC[C@@H](C)CCCC(C)=NNc1cccc(C(=O)O)c1C 1776088689 CHSKYVJWIMWEFI-CYBMUJFWSA-N 304.434 5.088 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)c(F)c1 538508457 MYSWSPVAQLPXRJ-LIRRHRJNSA-N 310.416 5.135 30 20 DKED N#CCCCCN[C@H](c1ccccc1)[C@H]1CCCc2ccccc21 539331357 JDHSCSYRKMWTCP-FCHUYYIVSA-N 318.464 5.131 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(F)c2ccccc12 551007059 CRPVYCZTKWRYNZ-CABCVRRESA-N 318.395 5.262 30 20 DKED C=CC[C@H](N[C@H](C)c1cc2ccc(C)cc2o1)c1ccncc1 756036118 NZWZZVLJKDYEJB-QAPCUYQASA-N 306.409 5.104 30 20 DKED C=CCCN(C)C(=S)Nc1c(C(C)C)cccc1C(C)C 786081988 DLJZDXPJSTXQRH-UHFFFAOYSA-N 304.503 5.138 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=CC12CCCC2 1548605885 CPLHTCPEASFNMB-UHFFFAOYSA-N 324.468 5.255 30 20 DKED C[C@@H](c1nc2ccccc2s1)N(C)CCCCC(C)(C)C#N 277787314 SFWZNOHUXLDOMH-AWEZNQCLSA-N 315.486 5.009 30 20 DKED C[C@H](Sc1ncc(-c2ccc(F)cc2)o1)c1ccc(C#N)cc1 303716452 QVCFGTCGHHVGAO-LBPRGKRZSA-N 324.380 5.206 30 20 DKED N#CCCC[C@@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 353917241 UKYPBWOQKKOSDL-LJQANCHMSA-N 322.383 5.097 30 20 DKED C[C@H](Sc1ccccc1Br)c1ccc(C#N)cc1 522823248 VRVVEECCMQNIHA-NSHDSACASA-N 318.239 5.174 30 20 DKED CC[C@H](C)Oc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1 559878796 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5.015 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C2CC2)c1 340445486 DUDDDBYHASELKJ-VGOFRKELSA-N 318.464 5.650 30 20 DKED Cc1ccccc1Oc1ccccc1CNCC(C)(C)CCC#N 462750375 ZJARUIJHGHFOPW-UHFFFAOYSA-N 322.452 5.207 30 20 DKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccco1 541176029 OTBOZNDPBIFHNC-CVEARBPZSA-N 316.404 5.230 30 20 DKED C[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1cccc(C#N)c1 551039154 MHCWFIYUOLWUQF-HUUCEWRRSA-N 318.395 5.262 30 20 DKED CC[C@@H](C)Oc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1 559878799 SUCWXNKDRLIOTC-KGLIPLIRSA-N 312.388 5.048 30 20 DKED CCCCC[C@@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)C(C)C 756300941 SWHNWEPZYJUSQR-CABCVRRESA-N 320.502 5.295 30 20 DKED CCCCCCCN[C@H](C)c1sc(-c2cccnc2)nc1C 776747543 ZODWZCWMIIPWAO-CQSZACIVSA-N 317.502 5.135 30 20 DKED Cc1nc(C)c(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)o1 821027105 DFIPIERBQJWDEE-OUKQBFOZSA-N 309.409 5.235 30 20 DKED O=C(/C=C\c1ccnc2ccccc12)c1ccc2ccccc2c1 210446682 NNJSEFAIWNMCSV-QXMHVHEDSA-N 309.368 5.284 30 20 DKED Cc1cc2c(cc1C)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)CCS2 427589576 RSBMZJVLZOPDHE-KXBFYZLASA-N 322.477 5.063 30 20 DKED Cc1ccc(CNc2ccccc2SC[C@@H](C)C#N)cc1C 432330200 YNUAHFYTGZNOMC-AWEZNQCLSA-N 310.466 5.167 30 20 DKED Cc1cc(CN[C@H](C)c2cccc(Cl)c2Cl)ccc1C#N 488105563 CVQZRTMDISYSRT-GFCCVEGCSA-N 319.235 5.024 30 20 DKED C[C@H](Nc1ccccc1CCC(F)(F)F)c1cccc(C#N)c1 611475539 QSTXOSTUDDZUDB-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED CC(C)(C#N)[C@H]1CCCC1=NNc1ccc(Cl)c(Cl)c1 814796851 SOJHWAKQBAYFIV-NSHDSACASA-N 310.228 5.111 30 20 DKED CC(C)=CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nccc2ccccc12 842775390 MWBUGLRGGDSTEH-VQIMIIECSA-N 320.436 5.184 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CC[C@H](C)C1 429624106 SOLCVZMESIANGR-DOTOQJQBSA-N 314.473 5.191 30 20 DKED CCC[C@@H](Nc1ncccc1C#N)c1ccc(Cl)c(Cl)c1 462870185 YZWIVRXOWJNTBR-OAHLLOKOSA-N 320.223 5.213 30 20 DKED C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1ccc(C#N)cc1 514529478 FVGINRJJTYEPHC-GFCCVEGCSA-N 319.235 5.058 30 20 DKED CCCC[C@H](CC)CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 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CCCCCCCCC(=O)[C@H](C#N)c1nccc2ccccc12 792096739 QMEXLFHYLZOAEK-SFHVURJKSA-N 308.425 5.162 30 20 DKED C[C@H](Nc1cccc(CCC(F)(F)F)c1)c1ccc(C#N)cc1 132900383 ZJYKMUMMRANHCR-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)o1 189903902 OUSXLGAUMKMNNP-UHFFFAOYSA-N 303.789 5.037 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc2ccccc12 189906642 PDGJKKQHFXQKID-UHFFFAOYSA-N 319.404 5.537 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H](C)C1 191464895 DRACEWMBUGYDGS-HOTGVXAUSA-N 314.473 5.048 30 20 DKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(-c2ccccc2)s1 442868745 RIOCXVAXIMHMNG-KLAILNCOSA-N 324.493 5.396 30 20 DKED C=C[C@H](CC(=O)Nc1c(Cl)ccc(F)c1C)c1ccccc1 448512129 XQXWLBDTEWZDAO-CYBMUJFWSA-N 317.791 5.086 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)cccc1F 476124688 WKYJSLBDQNTYDT-UHFFFAOYSA-N 315.363 5.069 30 20 DKED N#Cc1ccccc1CNc1cccc(COC2CCCCC2)c1 520029786 ZMFXZUNJAWTYSK-UHFFFAOYSA-N 320.436 5.020 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C1CCCC1)c1cccc(C#N)c1 539500197 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5.208 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2cccc(-c3ccccn3)c2)c1 763292017 GIPYBFLZQLTKMI-LUAWRHEFSA-N 317.363 5.092 30 20 DKED C[C@@H](Nc1ccc(OC2CCCC2)cc1)c1ccc(C#N)cc1 97393647 BYBLCGXPLYVUCC-OAHLLOKOSA-N 306.409 5.053 30 20 DKED CN(Cc1ccccc1NCC(C)(C)CCC#N)c1ccccc1 435054974 GQFWZMYLAKDUPV-UHFFFAOYSA-N 321.468 5.065 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccc(OC(C)(C)C)cc1 438372055 LKRKFGCCTJXFLF-UHFFFAOYSA-N 318.461 5.074 30 20 DKED Cc1c([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)oc2ccccc12 477865808 XGTQGANEPXBGPX-ZIAGYGMSSA-N 322.383 5.164 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1ccccc1)C1CC1 481664647 HGMWYHNXXXSQNX-FCHUYYIVSA-N 316.448 5.067 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc2ccccc12 539052180 FSTAOZMUOSWBRJ-HTAPYJJXSA-N 314.432 5.535 30 20 DKED C=CCC[C@H](N[C@H](C)c1cc2cnccc2o1)c1ccccc1 657930274 MIKXLGBIHAFPFT-QAPCUYQASA-N 306.409 5.186 30 20 DKED C=CC[C@H](N[C@H](CCC)c1ccc(Cl)cc1)c1ccncc1 766021867 VFXPTDFHQOZHLT-MOPGFXCFSA-N 314.860 5.483 30 20 DKED Cc1nc(-c2cccc(N[C@@H](C)c3ccc(C#N)cc3)c2)cs1 192779993 XOLACMLPKQIBFO-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED C[C@H](N[C@@H](C)c1cccc2ccccc12)c1cccc(C#N)c1 192943632 BXTLHJWEYUGYIJ-HOTGVXAUSA-N 300.405 5.123 30 20 DKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 303752286 IGQDHMGJMDWUHD-INIZCTEOSA-N 314.388 5.524 30 20 DKED N#CCCC[C@@H](NCc1cc(F)cc(Cl)c1)c1ccccc1 353911809 CWWXFDWRCTYBDQ-GOSISDBHSA-N 316.807 5.004 30 20 DKED N#CC1(CCOc2ccccc2-c2nccs2)CCCCC1 418941154 URYZSZOUOVUIKC-UHFFFAOYSA-N 312.438 5.053 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccncc1Cl)c1ccccc1 421831315 DSGGGRZEOMSRCU-RDTXWAMCSA-N 300.833 5.093 30 20 DKED CC[C@@H](N[C@H](c1ccc(C)cc1)C1CC1)c1ccc(C#N)cc1 447547863 DUIJIQROAOQQJB-NHCUHLMSSA-N 304.437 5.059 30 20 DKED C[C@H](NCc1ccccc1C#N)c1ccc(Cl)c2ccccc12 462466524 WHXVYMUEEZQGTL-AWEZNQCLSA-N 320.823 5.216 30 20 DKED CC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1cccs1 481667673 HCQFXYGITFCIGC-ZWKOTPCHSA-N 310.466 5.128 30 20 DKED C/C=C/c1ccc(N[C@H](CCC#N)c2ccc(OC)cc2)cc1 562055559 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C=CCCC(=O)N[C@@H](c1ccc(C(C)C)cc1)c1cccs1 60364812 KLLHGAYPMNEQFK-IBGZPJMESA-N 313.466 5.043 30 20 DKED CCC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC)cc1 90665389 PDLHHQYJNHGLEB-SFTDATJTSA-N 322.452 5.171 30 20 DKED CCCCCCCCCCCCCCC(=O)CC(=O)OCC 137677095 DXMQDLALLIBVJR-UHFFFAOYSA-N 312.494 5.600 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCCc2ccc(F)cc21)c1ccccc1 340445560 FIAQUKZPQAPTLP-NHCUHLMSSA-N 322.427 5.228 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc2ccccc12 539052193 FSTAOZMUOSWBRJ-VGSWGCGISA-N 314.432 5.535 30 20 DKED N#CCCC[C@H](NCc1ccccc1C1CC1)c1ccccc1 590069260 LWOGBFDDYJNUAE-NRFANRHFSA-N 304.437 5.089 30 20 DKED Cc1ccc(C(F)(F)F)c(N[C@H](C)c2cccc(C#N)c2)c1 600857511 PCVGYEHYEMOVLD-GFCCVEGCSA-N 304.315 5.059 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1c(F)cccc1F 609813758 NZAROXOVZLLGCU-NEPJUHHUSA-N 303.377 5.392 30 20 DKED Cc1cccc2c1C/C(=C\c1csc(-c3ccsc3)n1)C2=O 729150712 LNWCZSKTPYWEPD-NTUHNPAUSA-N 323.442 5.002 30 20 DKED N#Cc1ccc2cc(-c3ccc(Br)cc3)ccc2c1 116044554 MQHXIFIRTZAXMX-UHFFFAOYSA-N 308.178 5.141 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(C(C)C)c(O)cc1C 436670737 GUGQSZLVQWFPBO-UHFFFAOYSA-N 323.436 5.195 30 20 DKED CC#CCCCC(=O)Nc1ccc(S[C@@H](C)CC)cc1C 464643062 KZHUUEDMIIQYIZ-HNNXBMFYSA-N 303.471 5.018 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1cccc(F)c1)c1ccc(F)c(F)c1 480662861 KOGMBZMZVZMONL-KPZWWZAWSA-N 305.343 5.072 30 20 DKED COc1ccsc1/C=C/C(=O)c1cc(Cl)sc1Cl 764434594 ZZUFZZKPXIXWKF-NSCUHMNNSA-N 319.234 5.021 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1cccc(OC(F)F)c1 794934829 WHTLELPFIALMCU-RMKNXTFCSA-N 324.273 5.122 30 20 DKED CC(C)(C#N)CCCNc1cccc(SC(F)(F)F)c1 863365928 SXBQCFXTQHWADM-UHFFFAOYSA-N 302.365 5.040 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90664547 UKQJGDUJGWILJC-GXTWGEPZSA-N 304.846 5.097 30 20 DKED CCCCCCC[S@@](=O)Cc1csc(C2CCCC2)n1 133172831 QFOJRYQMOMSZJV-FQEVSTJZSA-N 313.532 5.020 30 20 DKED Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1C(F)(F)F 314790481 KAILGWXWZNRNEN-GFCCVEGCSA-N 304.315 5.059 30 20 DKED C=CCC[C@H](NC(=O)Nc1c(C)cccc1C)c1ccccc1 435650209 DQKBAGPXFWQFTO-SFHVURJKSA-N 308.425 5.132 30 20 DKED CC[C@@H](C)[C@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462751735 BFGMYHONWHYJHS-KUHUBIRLSA-N 312.844 5.089 30 20 DKED C=CCCOCCCCC(=O)Nc1cccc(-c2ccccc2)c1 576420644 ZPRLBPOCBYYHSU-UHFFFAOYSA-N 323.436 5.055 30 20 DKED Cc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)s1 728439431 KSILHSXQMJWJPH-AATRIKPKSA-N 317.460 5.138 30 20 DKED CC(C)c1ccc(C(=O)/C=C/c2nccc3ccccc23)cc1 740763444 CHCLZYPYLKDIJX-VAWYXSNFSA-N 301.389 5.254 30 20 DKED C[C@H](N[C@@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 743475610 SZEWQDWHRFRKMG-KBPBESRZSA-N 306.434 5.185 30 20 DKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cc2ccccc2o1 182646293 QTKMHXNOXGWGQD-HNNXBMFYSA-N 318.420 5.085 30 20 DKED Cc1noc(C2CC2)c1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 329088969 IGSWNAYGCKNMOE-VHDGCEQUSA-N 302.418 5.055 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(SC)cc1 484971026 LOUDQKIJLQAYHH-UHFFFAOYSA-N 318.486 5.009 30 20 DKED CC(C)[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1 614171369 RYUJYSOKTZTVGD-HXUWFJFHSA-N 324.443 5.114 30 20 DKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1 618806381 QTTQRGYEYYVWKO-NYHFZMIOSA-N 312.416 5.050 30 20 DKED O=C(/C=C/c1cccc2cnccc12)c1cc2ccccc2s1 780188226 HSWBMMGSCQIQCD-CMDGGOBGSA-N 315.397 5.346 30 20 DKED CCSc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 174055541 KWDZEALXTOCBKP-HUUCEWRRSA-N 310.466 5.082 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(Cl)c1 189902772 QOIMZSPQTLEHLI-UHFFFAOYSA-N 319.857 5.506 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(F)cc1F)c1ccc(C#N)cc1 447542408 OZXIYKCXSWHZML-RBUKOAKNSA-N 314.379 5.028 30 20 DKED Cc1ccsc1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990539 SUVXHNPCCMUUML-VOTSOKGWSA-N 305.402 5.015 30 20 DKED CC(C)CCCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 749023525 PLQJPMBLPQZWBZ-KRWDZBQOSA-N 308.425 5.018 30 20 DKED CCCCCCCCC(=O)Nc1c(-c2ccccc2)n[nH]c1C 813523002 CAWCDWCUTRSIFQ-UHFFFAOYSA-N 313.445 5.074 30 20 DKED Cc1nc(-c2ccccc2)sc1[C@H](C)/N=C/c1ccccc1O 920173630 CWMISWLLMPQWEV-DZUMZMOTSA-N 322.433 5.004 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H](C)C1 191453182 XEAOFPGWKNLRGS-HOTGVXAUSA-N 314.473 5.048 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(-c2ccncc2)cc1 366776510 MKROYICSOCLSIZ-QGZVFWFLSA-N 321.468 5.119 30 20 DKED CC(C)c1nc(SCCCC(C)(C)C#N)c2ccccc2n1 447329386 KCDVLCGMOZBHEJ-UHFFFAOYSA-N 313.470 5.175 30 20 DKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)CCCC(C)(C)C#N 472446241 JAVLMPGUOWMPFY-LBPRGKRZSA-N 313.272 5.316 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1cccc(F)c1F)c1ccc(F)c(F)c1 480680805 LOXVXOJBFRKJFL-ADLMAVQZSA-N 323.333 5.211 30 20 DKED CC(C)(C#N)CCN1CCCC[C@@H]1c1ccccc1C(F)(F)F 537362229 FOSFWYGIIIJKKR-MRXNPFEDSA-N 324.390 5.172 30 20 DKED CC(C)[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 538393606 BNFHARBHEGXQGP-KUHUBIRLSA-N 312.844 5.260 30 20 DKED C[C@H](CCc1cccc(F)c1)N[C@@H](CCCC#N)c1ccccc1 568656716 LJZOMLGKWFVVBX-UTKZUKDTSA-N 324.443 5.172 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccc(C)cc2)cc1 605904472 MDGBFQOMSVEGBQ-UHFFFAOYSA-N 324.424 5.217 30 20 DKED C[C@H](SCc1cccc(OC(F)F)c1)c1ccc(C#N)cc1 609825559 FFTRUZAAOBOHHT-LBPRGKRZSA-N 319.376 5.154 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(C)ccc1OC 90665149 WDESSFVDQZWPRJ-VQTJNVASSA-N 322.452 5.089 30 20 DKED CC(C)(C#N)CCCCNC(c1ccccc1)c1ccccc1 323450171 UAHMFMWIVXXORJ-UHFFFAOYSA-N 306.453 5.086 30 20 DKED CC(C)(C#N)CCCCSCc1cc(-c2ccccc2)on1 435885924 PYPLDFFQJXKGGQ-UHFFFAOYSA-N 314.454 5.295 30 20 DKED CC(C)C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccs1 512668092 SQRGQFGDNLNIFR-GUYCJALGSA-N 316.445 5.197 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1 610830044 ZBLADQATMRSWBE-LSDHHAIUSA-N 310.466 5.082 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 746047349 MGOXUVUKOJKITO-SUMWQHHRSA-N 320.358 5.068 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@H]1c1cccc(C)n1 766189992 WXRHWSULQGXBLO-IBGZPJMESA-N 316.489 5.194 30 20 DKED C=CCC[C@H](NC(=S)Nc1cccc(C)c1C)c1ccccc1 771851073 PXRQMJNGNDAUJU-IBGZPJMESA-N 324.493 5.297 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nccc2ccccc12 792106891 TXBFCVBUUUWMRO-VQIMIIECSA-N 320.436 5.018 30 20 DKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1cc2c(ccc3ccccc32)o1 453287487 GDRPZYXOXMMEBY-VYDXJSESSA-N 318.420 5.319 30 20 DKED N#Cc1cnc(Oc2cccc(Oc3ccccc3)c2)c(Cl)c1 513630181 LVDGEMJIVPGTDL-UHFFFAOYSA-N 322.751 5.191 30 20 DKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCC(C)(C)C#N)C1 538487957 HCIJCINELOXKON-BBRMVZONSA-N 324.390 5.028 30 20 DKED C[C@@H](SCc1ccc2ncccc2c1)c1ccc(C#N)cc1 546020215 KMXIZDBPKALREL-CQSZACIVSA-N 304.418 5.101 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 557273500 LLGGZMGNUFBHIT-JTSKRJEESA-N 318.464 5.261 30 20 DKED N#Cc1ccc(Oc2cccc(NCc3ccccc3F)c2)cc1 609221171 CRDVCRSMPVIKOL-UHFFFAOYSA-N 318.351 5.102 30 20 DKED CCC(C)(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 767071266 HIIUIXVASYMLSR-LJQANCHMSA-N 320.436 5.107 30 20 DKED C#Cc1ccc2ccccc2c1-c1c(C#C)ccc2ccccc12 90628124 HOIXLTOIPZAMTP-UHFFFAOYSA-N 302.376 5.623 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3ccccc3)cc2)o1 205606499 DZXYMCZHBXCDGN-RAXLEYEMSA-N 318.372 5.063 30 20 DKED N#CC1(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCCC1 255180482 BDSCOJLVIUISLD-UHFFFAOYSA-N 318.380 5.124 30 20 DKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C1CCCCCC1 523870199 WAMWNBIUGQHHOF-UHFFFAOYSA-N 324.449 5.196 30 20 DKED C[C@H](N[C@H](C)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1 531951387 MMQFRZBBRKYEPM-NWDGAFQWSA-N 319.235 5.277 30 20 DKED C[C@@H](CCc1cccc(F)c1)N[C@@H](CCCC#N)c1ccccc1 568656718 LJZOMLGKWFVVBX-UWJYYQICSA-N 324.443 5.172 30 20 DKED CC(C)(C)[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1 589340641 NHWLVSNKKLLTKL-VQTJNVASSA-N 322.427 5.062 30 20 DKED C[C@H](SCCC(C)(C)C#N)c1ncc(-c2ccccc2)o1 289383418 KTAAFYXEJCDLJR-ZDUSSCGKSA-N 300.427 5.076 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CC)CC1 475555760 OCIACWGQSASAMH-UHFFFAOYSA-N 314.473 5.192 30 20 DKED CSc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 516987452 RRJGVQFIPFBNSC-XOBRGWDASA-N 322.477 5.008 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cnc2ccsc2c1)c1ccccc1 536830981 GGZJAAWWNDSJDG-CRAIPNDOSA-N 322.477 5.654 30 20 DKED C[C@@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 537296918 YAIBBZFGQLEHRC-AUUYWEPGSA-N 310.416 5.135 30 20 DKED Cc1ccc(CNc2ccccc2S[C@@H](C)CC#N)cc1F 600559207 YYKGLKXBCIJDFP-AWEZNQCLSA-N 314.429 5.141 30 20 DKED Cc1cc2cc([C@H](C)N[C@H](C)c3cccc(C#N)c3)oc2cc1C 610829873 QMECMJAAGWSTNI-CVEARBPZSA-N 318.420 5.333 30 20 DKED C=CCC[C@@H](N[C@H](C)c1cc2cnccc2o1)c1ccccc1 657930272 MIKXLGBIHAFPFT-CRAIPNDOSA-N 306.409 5.186 30 20 DKED CC(C)c1ccc(C=NOCc2coc(-c3ccccc3)n2)cc1 823553008 IJLNHXWZTYMYCQ-UHFFFAOYSA-N 320.392 5.016 30 20 DKED CC(C)c1ccccc1CNc1ccccc1SC[C@H](C)C#N 864006689 XZRIGXCKPSROFR-MRXNPFEDSA-N 324.493 5.674 30 20 DKED C[C@H](NCc1cc(-c2ccccc2)cs1)c1ccc(C#N)cc1 77290320 LXEAMHIFCDPUNC-HNNXBMFYSA-N 318.445 5.138 30 20 DKED C=CCC[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccco1 513671798 FVZJSFUOBAMOOR-OAHLLOKOSA-N 309.331 5.096 30 20 DKED C[C@H](SCc1ccc(C#N)cc1)c1ccc(OC(F)F)cc1 522962133 YMYIHGAMHMCKPY-LBPRGKRZSA-N 319.376 5.154 30 20 DKED CC(C)c1nc2cc(N[C@H](C)c3ccc(C#N)cc3F)ccc2o1 540976166 IEEQGAOPSCBHIY-GFCCVEGCSA-N 323.371 5.135 30 20 DKED CC[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)s1 572208514 PGPPNCASHPQEKG-LSDHHAIUSA-N 316.857 5.001 30 20 DKED Cc1nc(-c2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2)oc1C 611482458 LPWJCCSLCLBEAL-AWEZNQCLSA-N 317.392 5.003 30 20 DKED C[C@@H](C#N)Oc1ccccc1NC1CCC(c2ccccc2)CC1 780746598 OYDHEYATJAMFGQ-IVMQYODDSA-N 320.436 5.116 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1F 189869312 OWDVSDKJWKKHCB-UHFFFAOYSA-N 315.363 5.069 30 20 DKED CC[C@@H](N[C@@H](c1ccc(OC)cc1)C(C)C)c1ccc(C#N)cc1 447513664 YAGRNTFQFIWCSQ-NHCUHLMSSA-N 322.452 5.005 30 20 DKED COc1ccccc1[C@H](CC(C)C)N[C@H](C)c1cccc(C#N)c1 539494944 WZQMEEGHCPPGOI-UZLBHIALSA-N 322.452 5.005 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccoc1)c1ccc(C(F)(F)F)cc1 540149037 LJYGTFHFXZCRMB-CXAGYDPISA-N 323.358 5.657 30 20 DKED CC(C)(C)C[C@H](NCc1ccc(CC#N)cc1)c1ccc(F)cc1 543185030 IBNSTUCBIHPMMY-FQEVSTJZSA-N 324.443 5.159 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2)s1 554365988 FCURKLLWHAGIAX-HNNXBMFYSA-N 312.482 5.396 30 20 DKED CCCCOc1ccc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)cc1 585764768 DRIPFQSVHPXAHN-IAGOWNOFSA-N 322.452 5.149 30 20 DKED FC(F)(F)C1CCC(C=NNc2ccc3ccccc3n2)CC1 767358391 ACDLIGHNSCNQDS-UHFFFAOYSA-N 321.346 5.001 30 20 DKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc2ccccc2s1 568936760 WRJYOHZFYRHISA-ACJLOTCBSA-N 318.445 5.111 30 20 DKED C[C@@H](NCc1ccc(C2CCCC2)cc1)c1ccc(C#N)cc1 576069598 UANZVMZYLSRFSA-MRXNPFEDSA-N 304.437 5.067 30 20 DKED CCCCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 585764770 DRIPFQSVHPXAHN-SJORKVTESA-N 322.452 5.149 30 20 DKED C[C@H](S[C@H](C)c1ccc(F)cc1F)c1ccc(C#N)cc1 609825726 PWZKLXZNAGNWBA-NWDGAFQWSA-N 303.377 5.392 30 20 DKED C#Cc1cccc(NCc2nc(-c3ccccc3Cl)cs2)c1 774278759 BTTGHWHKOUQOMK-UHFFFAOYSA-N 324.836 5.057 30 20 DKED CSc1ccc(/C=C/C(=O)c2cc3ccccc3o2)s1 798232656 ZEMXTZUWGMBLGB-SOFGYWHQSA-N 300.404 5.112 30 20 DKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 805947911 VKEYDCKBQGXJCL-CYBMUJFWSA-N 320.502 5.223 30 20 DKED Clc1cccc(Cl)c1C=NNc1nccc2sccc12 915979942 LVADKMABEBSCDD-UHFFFAOYSA-N 322.220 5.049 30 20 DKED N#Cc1cccc(CNc2cccc(COC3CCCCC3)c2)c1 237848230 INAYOWULTHXGBY-UHFFFAOYSA-N 320.436 5.020 30 20 DKED C[C@H](/N=C(/O)C1CCCCC1)/C(O)=N/CCC1=CCCCCC1 329803129 JPILTPIRNVIZDN-HNNXBMFYSA-N 320.477 5.149 30 20 DKED N#CCC[C@@H](NCc1ccc(C2CCC2)cc1)c1ccccc1 339314004 BUQONGMYRGSMDT-OAQYLSRUSA-N 304.437 5.089 30 20 DKED C[C@@H](SCc1ncc(Cl)cc1Cl)c1ccc(C#N)cc1 537422021 YFFKVGIMGWYQSD-SNVBAGLBSA-N 323.248 5.254 30 20 DKED C[C@H](N[C@@H]1CC[C@@H](C#N)C1)c1ccccc1-c1ccc(Cl)cc1 549927994 JQKUCKSCPPHZKA-HDMKZQKVSA-N 324.855 5.350 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(C)cc1C 632748176 BIGXVODJMYHRFN-UHFFFAOYSA-N 313.466 5.469 30 20 DKED Cc1oc(-c2cccs2)nc1CSCCCC(C)(C)C#N 161193892 GAUJIOLPLYSMLX-UHFFFAOYSA-N 320.483 5.275 30 20 DKED N#Cc1ccc(Oc2ccc(-c3ccccc3)cc2Cl)nc1 314073594 LVOCHLDZTPGRBY-UHFFFAOYSA-N 306.752 5.066 30 20 DKED CC(C)c1nc(CS[C@@H](C)c2cccc(C#N)c2)cs1 443162778 UDUOOWVCDXGCID-LBPRGKRZSA-N 302.468 5.133 30 20 DKED C[C@@H]1CCC[C@H](C(=O)Nc2sc(-c3ccccc3)cc2C#N)C1 525559416 PMOVGJWBAFDSLV-HIFRSBDPSA-N 324.449 5.052 30 20 DKED C/C=C\c1ccc(N[C@H](CCC#N)c2ccc(OC)cc2)cc1 562055560 FATBVXDQDVYCGU-MNKBLEIRSA-N 306.409 5.185 30 20 DKED COc1cc(C)c([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1C 753688779 VDKFPTKWSWHTHB-YLJYHZDGSA-N 322.452 5.008 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc(C(C)C)cs1 784877376 AVACIAWSMNKEOH-KGLIPLIRSA-N 306.475 5.049 30 20 DKED Cc1nc(C(C)C)sc1[C@@H](C)Nc1ccc(CCC#N)cc1 903297672 IVGNKUXMPXAYNM-CYBMUJFWSA-N 313.470 5.204 30 20 DKED N#Cc1cccc(CSCc2cccc(C(F)(F)F)c2)c1 61454126 CTCVAIPIQBSXFD-UHFFFAOYSA-N 307.340 5.010 30 20 DKED CC1(C#N)CCC(N[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1 414253485 ZIZXEQKKBNYMMA-BARLLCKDSA-N 316.876 5.038 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccsc3)s2)cc1 734304528 MUCHJSHNOKCETG-VOTSOKGWSA-N 311.431 5.076 30 20 DKED CC(C)n1cc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cn1 746686422 BMLRRMDUOYIIAA-HJWRWDBZSA-N 322.433 5.089 30 20 DKED Cc1c(NN=C2CCC[C@@H](C(C)(C)C)CC2)cccc1C(=O)O 1776087519 HVSXGTBUVHRGCX-CQSZACIVSA-N 316.445 5.088 30 20 DKED C[C@H](SC1=Nc2ccccc2CS1)c1ccc(C#N)cc1 118174123 LBDZSLJPOZABED-LBPRGKRZSA-N 310.447 5.287 30 20 DKED C=CCCCN(C)C(=O)Nc1c(CCC)cccc1C(C)C 189993180 CPGJMQJPVOGWQS-UHFFFAOYSA-N 302.462 5.192 30 20 DKED CCc1c([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)oc2ccccc12 325107856 BKPVXKFHXUYLSQ-LSDHHAIUSA-N 318.420 5.279 30 20 DKED C[C@H]1C[C@H](C(O)=Nc2ccc3c(c2)oc2ccccc23)CCC1=O 328909472 DRYSPIYRRJMNGP-QWHCGFSZSA-N 321.376 5.179 30 20 DKED CC[C@H](N[C@@H](c1ccc(OC)cc1)C(C)C)c1ccc(C#N)cc1 447513663 YAGRNTFQFIWCSQ-LEWJYISDSA-N 322.452 5.005 30 20 DKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2)c(C)c1 499741057 FPIIKLRTKZGZTE-AWEZNQCLSA-N 324.449 5.010 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)s1 512642388 PDNTYDMNFCNRFX-YGRLFVJLSA-N 322.836 5.214 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 551204097 ABEVUWNBBPVBSB-DZGCQCFKSA-N 318.873 5.487 30 20 DKED CC(C)(C)c1cc(OC[C@@H](C#N)CCC#N)cc(C(C)(C)C)c1 554295319 DFWBCPOMRZGSRC-OAHLLOKOSA-N 312.457 5.104 30 20 DKED Cc1cc(C)c([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1C 577634388 PONOLNLNSWRPIQ-SIKLNZKXSA-N 320.480 5.698 30 20 DKED Cc1c(N[C@H](C)c2cccc(C#N)c2)cccc1C(F)(F)F 600851467 ZYTXLFJDLMMCOU-GFCCVEGCSA-N 304.315 5.059 30 20 DKED Cc1cc(S[C@H](C)c2ccc(C#N)cc2)c2ccccc2n1 609825894 ZJNGXYIPJUJJIO-CQSZACIVSA-N 304.418 5.268 30 20 DKED CC(C)(C)c1cc(/C=N/c2ccccc2N)c(O)c(C(C)(C)C)c1 169486365 WOIXERHXLOOLRS-YDZHTSKRSA-N 324.468 5.320 30 20 DKED C[C@H](SCc1cccc2cccnc12)c1cccc(C#N)c1 443133063 NGLJXDLLPVDEJP-AWEZNQCLSA-N 304.418 5.101 30 20 DKED CC[C@@H](N[C@H](CC(C)C)c1cccs1)c1ccc(C#N)cc1 447527678 FRZJYGCVYJVFLN-QZTJIDSGSA-N 312.482 5.448 30 20 DKED CCC(CC)[C@@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 534169820 WFWBCFXVNFXXOU-UONOGXRCSA-N 318.486 5.092 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C)c1cccc(C#N)c1 538407102 IVBAMARMAUAXHE-RYMBOPBQSA-N 324.855 5.260 30 20 DKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CC1CCCCC1 603969109 DAQWCTJMKBCSHD-UHFFFAOYSA-N 324.449 5.196 30 20 DKED C=CCCCNc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 607149952 DQHIDPKOXORTCY-UHFFFAOYSA-N 322.330 5.271 30 20 DKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1nccc2ccccc12 792091617 LUJJAFHJSJMHKI-YJBOKZPZSA-N 308.425 5.018 30 20 DKED C[C@@H](C=NNc1nc(-c2ccccc2)cs1)c1ccccc1 916545768 XVRZZWDUIXCAHK-AWEZNQCLSA-N 307.422 5.012 30 20 DKED CCC(CC1CCCCC1)=NNc1ccc(Cl)c(C(=O)O)c1 1776034585 NSXAIGYZETWDAB-UHFFFAOYSA-N 322.836 5.187 30 20 DKED CCC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC)cc1 90665390 PDLHHQYJNHGLEB-RTWAWAEBSA-N 322.452 5.171 30 20 DKED Cc1ccc(Oc2ccccc2CNCC(C)(C)CCC#N)cc1 462749380 PTUPHYWPLLRTGH-UHFFFAOYSA-N 322.452 5.207 30 20 DKED Cc1c(CSC(C)C)cccc1NCc1cccc(C#N)c1 462762353 LXBUJJLPAKSAKM-UHFFFAOYSA-N 310.466 5.120 30 20 DKED CCc1ccc(CNc2ccccc2S[C@@H](C)CC#N)cc1 600848410 RMFUKWKYTDOHRJ-HNNXBMFYSA-N 310.466 5.255 30 20 DKED N#Cc1ccc(CNc2ccc3oc4ccccc4c3c2)c(F)c1 602411788 KVRJDZXIOLTJRO-UHFFFAOYSA-N 316.335 5.209 30 20 DKED C=CC[C@H](C)NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 735065548 FBXQQVKIEWTXHV-NSHDSACASA-N 321.873 5.373 30 20 DKED CCCCCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1 742964430 AKOXXHHGGRXUNK-NVXWUHKLSA-N 305.462 5.248 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1cccc(OC)c1 886552592 KBCMHBMBKBMDKF-LJQANCHMSA-N 317.473 5.109 30 20 DKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)CCc2ccccc21 96032913 RFTFFIMSGABYCC-VBKFSLOCSA-N 317.413 5.023 30 20 DKED C=CC[C@@H](C(=O)Nc1cc(C(C)C)c(O)cc1C)c1ccccc1 187080770 SGICJPJKCBLFAG-QGZVFWFLSA-N 323.436 5.122 30 20 DKED CC[C@H](NCCCCC(C)(C)C#N)c1ccccc1OC(F)F 444678189 YJBITXCCPQAVHU-HNNXBMFYSA-N 324.415 5.049 30 20 DKED Cc1occc1-c1nc2sc(C)c(C)c2c(C2CC2)c1C#N 518737204 MDNZIQHHFDZPTB-UHFFFAOYSA-N 308.406 5.231 30 20 DKED C[C@@H](c1cccs1)N(CCC(C)(C)C#N)Cc1ccccc1 539588549 QRXNYGXROYNUNB-INIZCTEOSA-N 312.482 5.251 30 20 DKED C=CCC[C@@H](NCc1cc(-c2cccs2)on1)c1ccccc1 540458273 MMPRUDOXZGWRMY-QGZVFWFLSA-N 324.449 5.200 30 20 DKED C[C@@H](SCCC(C)(C)C#N)[C@@H](C)SCCC(C)(C)C#N 790283103 PFIZVDMLYIEMKJ-ZIAGYGMSSA-N 312.548 5.110 30 20 DKED CCCCCCCCCC=NNc1ccc(C(=O)O)c(F)c1 1776074694 OEXRFDMHMJQNGG-UHFFFAOYSA-N 308.397 5.062 30 20 DKED C=CCC[C@@H](NCc1csc(-c2ccoc2)n1)c1ccccc1 180046133 YWKRVZSLTIDFQQ-GOSISDBHSA-N 324.449 5.200 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)[C@@H]1C 191504874 LZNWYAGSGDMSRN-HOTGVXAUSA-N 314.473 5.191 30 20 DKED CCC(C)(C)OCc1ccccc1N/C(O)=N/C1CCCCC1 330826477 FRGOSZHCRJJBFK-UHFFFAOYSA-N 318.461 5.050 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1csc(Cl)c1 340440605 CMKLRZXRPKWBCB-XJKSGUPXSA-N 318.873 5.487 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1F 340444139 CEEFCABVPICULY-VQTJNVASSA-N 310.416 5.302 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccccc1 556203101 ZXTNXIKXPFZMTI-WOJBJXKFSA-N 324.855 5.352 30 20 DKED C=CCCCN(C)C(=O)Nc1ccccc1Oc1cccc(C)c1 605904955 QQPKVVCLUFWHDC-UHFFFAOYSA-N 324.424 5.217 30 20 DKED CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(Cl)c1 619754489 AWYRSYPXHCINRN-QGZVFWFLSA-N 319.235 5.106 30 20 DKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccsc1 727780059 GFYNGJRQEFYZFN-FPLPWBNLSA-N 311.431 5.076 30 20 DKED C#CCCCCNC(=S)Nc1c(C(C)C)cccc1C(C)C 758433011 FVMLLLXBNWGTNZ-UHFFFAOYSA-N 316.514 5.023 30 20 DKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/C(=O)c1cscn1 806573971 XVGGYFPFYVYDLJ-VLHCFCLRSA-N 323.339 5.004 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90665105 ZVWOKEVNTSUNQJ-GJZGRUSLSA-N 318.873 5.487 30 20 DKED Cc1noc(C)c1N=C(O)C1(C2CCCCC2)CCCCC1 329907243 KSVCIUMGOXKSFA-UHFFFAOYSA-N 304.434 5.410 30 20 DKED C=CCCc1ccccc1NC(=O)c1ccc(Cl)cc1Cl 410356159 WEDHJHYPBYKWFK-UHFFFAOYSA-N 320.219 5.364 30 20 DKED N#CCCCCN1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1 446711057 JOGULUWCTLDXQQ-FQEVSTJZSA-N 324.855 5.133 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cc(C)c(C)o1)c1ccc(F)c(F)c1 502433312 VNTWZZUFVUOADL-SGTLLEGYSA-N 305.368 5.143 30 20 DKED N#Cc1cccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 520959325 ARTMMYUDADMELL-HXUWFJFHSA-N 324.855 5.233 30 20 DKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1csc2ccccc12 810216962 UCJZVAHJILIJCX-BFUOFWGJSA-N 318.445 5.111 30 20 DKED Cc1cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(C)s1 340451870 PXAYDCSJTVNRHL-DNVCBOLYSA-N 312.482 5.451 30 20 DKED CC(C)O[C@@H](CSCCCC(C)(C)C#N)c1ccccc1 427701863 ODANQHQCNFPQBP-KRWDZBQOSA-N 305.487 5.216 30 20 DKED Cc1cccc([C@@H](NCC(C)(C)CCC#N)c2cccc(F)c2)c1 562036403 WIYWQZHODONKGS-HXUWFJFHSA-N 324.443 5.143 30 20 DKED CC(C)c1cnc(S[C@H](C#N)C2CCCCC2)n1C(C)C 610034363 CNQCFVQIDJWKSA-MRXNPFEDSA-N 305.491 5.152 30 20 DKED C[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1cccc(C#N)c1 611475535 PSYSXPFGOIKAGX-OAHLLOKOSA-N 308.425 5.046 30 20 DKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1 618806389 QTTQRGYEYYVWKO-QRQCRPRQSA-N 312.416 5.050 30 20 DKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3C)o2)o1 734305883 HDUUCBYPQDCLND-VMPITWQZSA-N 310.324 5.192 30 20 DKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1cccs1 737405242 HBHRGYVZRZWSOZ-NSHDSACASA-N 323.870 5.298 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@@H](C)C(C)C 475584765 ZUISTXFWNKTJNK-INIZCTEOSA-N 316.489 5.437 30 20 DKED CC(C)OCc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 594496096 GWBJFQSHZIDTDD-UHFFFAOYSA-N 322.452 5.025 30 20 DKED Cc1cc(F)ccc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 731322474 ZWJDLAKBSIGTEL-NTMALXAHSA-N 323.392 5.154 30 20 DKED COCc1ccc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cc1 741840248 LROPIRLJENJUEH-RMKNXTFCSA-N 321.203 5.036 30 20 DKED COCc1cccc(C=NN(c2ccccc2)c2ccccc2)c1 743417563 LMOOESCXLODESS-UHFFFAOYSA-N 316.404 5.005 30 20 DKED CC(=NN(Cc1ccccc1)Cc1ccccc1)c1ccsc1 749099512 PNAVUIBYOXROLL-UHFFFAOYSA-N 320.461 5.175 30 20 DKED C[C@H](C=NOc1ccccc1C(F)(F)F)CCc1ccccc1 754712266 IWGJLTBKQQTCTE-AWEZNQCLSA-N 321.342 5.339 30 20 DKED C=CC[C@H](N[C@H](C)[C@@H](C)c1ccc(Cl)cc1)c1ccncc1 792989090 WMOILSHAQKEDBX-CLCXKQKWSA-N 314.860 5.134 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(CC)c1 794995574 PDXBPDQMEGWMEC-UHFFFAOYSA-N 324.493 5.024 30 20 DKED C=CC[C@H](OC(=O)CCC(F)F)c1ccc(Cl)c(Cl)c1 797554533 VDIRWGULYMBQSM-LBPRGKRZSA-N 323.166 5.199 30 20 DKED CCSc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 174055525 KWDZEALXTOCBKP-GJZGRUSLSA-N 310.466 5.082 30 20 DKED C=CCC[C@H](NCc1cc(Cl)sc1Cl)c1ccco1 513690999 PNKFAQUBYVJOLW-NSHDSACASA-N 316.253 5.445 30 20 DKED CC[C@@H](C#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 593509675 GEZFXCIFWKMRLI-CABCVRRESA-N 324.449 5.028 30 20 DKED C=CCC[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccccc1 611394432 JAFRVYRWEUUUAB-VXKWHMMOSA-N 316.448 5.233 30 20 DKED CC(C)(C)c1ncc(/C=C2/CCCc3ccccc3C2=O)s1 736430803 IJFBDUANAMTBFD-KAMYIIQDSA-N 311.450 5.043 30 20 DKED C[C@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1 83988657 IFCOIEKGJLNKFV-HNNXBMFYSA-N 308.425 5.046 30 20 DKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1nc2ccccc2o1 183272435 WNCDDSTZILPRSH-OLZOCXBDSA-N 308.406 5.255 30 20 DKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(-c2cccs2)cc1 442849818 CPSAUEJBKSJHCG-KLAILNCOSA-N 324.493 5.396 30 20 DKED CCCCCCCCC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747197968 PZNYHLICQXCURK-CQSZACIVSA-N 306.475 5.193 30 20 DKED N#CCc1ccc(N[C@H](Cc2ccccc2)c2ccccc2)cc1 324842817 INMZBLARORVTHR-JOCHJYFZSA-N 312.416 5.149 30 20 DKED CC(C)(C#N)CCCSCc1ccc(-c2ncco2)cc1F 419626653 XIUJRCYMDJSGBK-UHFFFAOYSA-N 318.417 5.044 30 20 DKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc2ccccc2s1 551806504 NOCUIVZKAUFOJU-AWEZNQCLSA-N 318.445 5.113 30 20 DKED C=CCCC(=O)Nc1ccc(SC2CCCCC2)cc1C 588037065 SGCFUPJLAARUAH-UHFFFAOYSA-N 303.471 5.325 30 20 DKED C=CC[C@@H](N[C@@H]1CCCc2ccc(C(C)C)cc21)c1ccncc1 761451892 PIHBDLAREIJXBV-FGZHOGPDSA-N 320.480 5.489 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccccc1Cl 108355221 DNMPPJIXGMDQHA-CYBMUJFWSA-N 316.857 5.204 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](C)CC 475550559 ONWVCQZFXNPYDJ-GJZGRUSLSA-N 302.462 5.095 30 20 DKED CC(C)(C#N)CCCSCc1cccc(C(F)(F)F)c1 480404937 YZDOOMBAIXAHBR-UHFFFAOYSA-N 301.377 5.269 30 20 DKED C=CCCCSCc1csc(-c2ccccc2OC)n1 609803887 JJQALKCFHLGMHB-UHFFFAOYSA-N 305.468 5.018 30 20 DKED Cc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1F 745990557 UNBVEIGBVKHJGZ-RUDMXATFSA-N 317.363 5.092 30 20 DKED C[C@@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C)(C#N)CC1 445422302 MERJZLUYFSRCRL-KRWDZBQOSA-N 320.436 5.166 30 20 DKED Cc1cc(C)c(CNc2ccccc2S[C@@H](C)CC#N)c(C)c1 520943538 FHPJMUCKHAQKBC-KRWDZBQOSA-N 324.493 5.618 30 20 DKED C[C@@H](SCc1ccc(C#N)cc1)c1ccc(OC(F)F)cc1 522962132 YMYIHGAMHMCKPY-GFCCVEGCSA-N 319.376 5.154 30 20 DKED C[C@H](N[C@@H](c1ccccc1F)C1CCCC1)c1ccc(C#N)cc1 537289236 RKPDJLRVRZNQCB-YCRPNKLZSA-N 322.427 5.279 30 20 DKED C[C@H](SCCCC1(C#N)CCOCC1)c1ccccc1Cl 541881385 RQLAFHMSIPKYKP-AWEZNQCLSA-N 323.889 5.235 30 20 DKED C=CCC[C@@H](Nc1cccc(COCC2CC2)c1)c1ccco1 552275186 NUSLZVQVBYITNF-LJQANCHMSA-N 311.425 5.326 30 20 DKED C#CC[C@@H](N[C@H](C)c1cc(Cl)sc1Cl)c1ccccc1 773106700 LQOXUTDVECVTFI-BXUZGUMPSA-N 324.276 5.470 30 20 DKED CCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 781505707 AMOCGSVUJZYNNE-RDTXWAMCSA-N 320.502 5.439 30 20 DKED CC(C)c1cccc(NC(=S)Nc2ccc(CCC#N)cc2)c1 905647333 DPEPYILJKWVYEE-UHFFFAOYSA-N 323.465 5.075 30 20 DKED C[C@H](C=NNc1nc(-c2ccccc2)cs1)c1ccccc1 916545769 XVRZZWDUIXCAHK-CQSZACIVSA-N 307.422 5.012 30 20 DKED COc1cc(C(=O)/C=C/c2ccc(Cl)s2)ccc1SC 109572584 VNSSCFLHOQCOAF-GQCTYLIASA-N 324.854 5.028 30 20 DKED N#CCCCCSCc1nc(-c2c(F)cccc2F)cs1 127872358 NELLSOBRUDVOGS-UHFFFAOYSA-N 324.421 5.015 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1csc(Cl)c1 191388350 JZJNLTXRUDQPOU-WFASDCNBSA-N 304.846 5.097 30 20 DKED CC(C)(C#N)c1ccccc1CSc1ccnc2ccccc12 488817035 DIFYTVSPBFPYCV-UHFFFAOYSA-N 318.445 5.328 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(Cl)c1 512621518 YWHQPUMWTNUFFW-XIKOKIGWSA-N 316.807 5.153 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 550829096 AVJXVFRLACUPLI-XMSQKQJNSA-N 320.480 5.896 30 20 DKED CC(=NNc1ccc(Cl)cc1)c1sc(C(C)C)nc1C 751127677 SIXYKBZORMYVSX-UHFFFAOYSA-N 307.850 5.064 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)s1 920064694 XQJGFEWRSVYHNP-ARJAWSKDSA-N 317.460 5.138 30 20 DKED CCCCCC[C@@H]1CCCC1=NNc1ccc(C(=O)O)c(F)c1 1776074375 WUTOODZWKAXQSJ-CYBMUJFWSA-N 320.408 5.062 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1sc(C)nc1C)c1ccccc1 181507467 KSUNFAOIDKYXIV-WMLDXEAASA-N 300.471 5.118 30 20 DKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 181724808 YGJHBQBTJIODSE-KBPBESRZSA-N 306.434 5.185 30 20 DKED Cc1csc(-c2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2)n1 183013680 RZDWRWWQSSDWPS-AWEZNQCLSA-N 319.433 5.163 30 20 DKED Cc1ccc2c(c1)[C@H](N[C@@H](CCC#N)c1ccccc1)CCC2 358336078 CAQQMRDIIKFMGB-LEWJYISDSA-N 304.437 5.007 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)CC(F)F 457744368 KGAGEEDDKBGEET-ZDUSSCGKSA-N 309.400 5.158 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1cccc(CSC(C)C)c1C 466425177 JCJDAXFBIBNHOL-CQSZACIVSA-N 305.487 5.177 30 20 DKED C[C@H](Sc1ncc(C#N)cc1Cl)c1ccc(Cl)cc1 513623171 CSBUEEQUBOMCKV-VIFPVBQESA-N 309.221 5.113 30 20 DKED CC(C)COc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 610829784 KTFLLMBBRNKARX-SJORKVTESA-N 322.452 5.005 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc2cc(Cl)ccc2o1 611438792 SNRWHGKYZUVEMD-OLZOCXBDSA-N 324.811 5.370 30 20 DKED CCCCCCCCCC(=O)N(C)[C@H](C)c1sc(C)nc1C 730202249 JFZZFDWPCAYHKA-OAHLLOKOSA-N 324.534 5.420 30 20 DKED C=C(Cl)CN(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1 741810589 LPENTYKYJOEUGG-HNNXBMFYSA-N 315.844 5.108 30 20 DKED CCCCCC[C@H]1CCCC1=NNc1cccc(C(=O)O)c1C 1776086554 AWPYEIUXFMPCHD-HNNXBMFYSA-N 316.445 5.232 30 20 DKED C[C@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1ccc(C#N)cc1 195613867 GWGVYOBOSIMNLB-MGPUTAFESA-N 304.437 5.022 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCC2 340449475 VISPDJMUFYZLIT-VGSWGCGISA-N 318.464 5.261 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccccc1 502405179 LGHFHADYEOYIOP-UWJYYQICSA-N 323.484 5.356 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(C)c1 530454336 WNBQYBGROHQBIZ-UHFFFAOYSA-N 321.464 5.418 30 20 DKED Cc1ccsc1/C=C/C(=O)c1nc(-c2ccccc2)cs1 732570732 HHYNDFVPVHAKPW-BQYQJAHWSA-N 311.431 5.076 30 20 DKED C=CCC[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccco1 796868293 FZPAOGLCILRING-QGZVFWFLSA-N 314.404 5.138 30 20 DKED CC(=NNc1nccc2sccc12)c1oc2ccccc2c1C 915980382 PUNNHXLTMDYVDC-UHFFFAOYSA-N 321.405 5.187 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)cc1F 90665877 JCJCEUFYBBAZJN-RBUKOAKNSA-N 314.379 5.051 30 20 DKED C[C@@H]1CC[C@H](N[C@@H](CCC#N)c2ccccc2)c2sccc21 453183379 YDJUZEHRCAWJEI-JLSDUUJJSA-N 310.466 5.321 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)C(C)C 567322702 GTVQIBHMLIWDPD-UHFFFAOYSA-N 302.462 5.095 30 20 DKED Cc1cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc(C)c1F 572189479 UMMXCZHHOGRDAD-FXAWDEMLSA-N 324.443 5.528 30 20 DKED C[C@@H](SCc1cccc(OC(F)F)c1)c1ccc(C#N)cc1 609825558 FFTRUZAAOBOHHT-GFCCVEGCSA-N 319.376 5.154 30 20 DKED CCc1c([C@H](C)N[C@@H](C)c2cccc(C#N)c2)oc2ccccc12 611438282 CQOFIUSBGBTHGB-GJZGRUSLSA-N 318.420 5.279 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H]2CCCC(C)(C)C2)n1 756573249 WYXSYHDCHSAOFB-ZIAGYGMSSA-N 318.486 5.049 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccc(C)cc1 918722335 FCQBGANJJXRIDG-UHFFFAOYSA-N 306.519 5.374 30 20 DKED Cc1cc(N[C@H](CCC#N)c2ccccc2)c2cc(F)ccc2n1 301814535 ZMXSBBWBNREAHA-GOSISDBHSA-N 319.383 5.139 30 20 DKED C[C@@H](N[C@@H](c1ccc(F)cc1)C(C)(C)C)c1cccc(C#N)c1 319660968 BTRBIXRWCPGSOZ-KUHUBIRLSA-N 310.416 5.135 30 20 DKED COc1cc(CSCCCCC(C)(C)C#N)ccc1SC 435885824 OLYRPTDBMQHHRE-UHFFFAOYSA-N 323.527 5.370 30 20 DKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H]1CCC[C@H](C#N)C1 463281505 KXGJURALLNTYJT-OTWHNJEPSA-N 324.493 5.012 30 20 DKED C=CCOc1cccc(CN[C@H](C)c2oc3ccccc3c2C)c1 513104967 PJTBYZYIAZDMIV-MRXNPFEDSA-N 321.420 5.157 30 20 DKED N#CCCCCSCCCc1ccc(C(F)(F)F)cc1 610798056 PXRTVMCPJBZROS-UHFFFAOYSA-N 301.377 5.065 30 20 DKED CCCCCCCCC(=O)N[C@H](C)c1nc2ccccc2s1 734112469 KOMPJASLNFMHJV-CQSZACIVSA-N 318.486 5.224 30 20 DKED COc1cccc2cc(C(=O)/C=C/c3cc4ccccc4o3)oc12 750901347 DUORBBQSLCEUFN-MDZDMXLPSA-N 318.328 5.084 30 20 DKED Cc1cccc2c1C/C(=C/c1cnc(-c3cccs3)s1)C2=O 751514803 WJBJHNHJMANHKR-WQLSENKSSA-N 323.442 5.002 30 20 DKED Cc1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)s1 751515263 XCGUXKXSSSRBBE-AATRIKPKSA-N 317.460 5.138 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(C)c1C 475572767 JXKKXXZVWOJAIX-UHFFFAOYSA-N 322.452 5.799 30 20 DKED C=CCCC1(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)CC1 483038708 AEDKOYJXRTVBMQ-UHFFFAOYSA-N 317.738 5.044 30 20 DKED CC(C)c1ccc([C@H](NCc2ccc(C#N)cc2)C(C)C)cc1 512833377 KXNGZNYSXNCYKA-OAQYLSRUSA-N 306.453 5.169 30 20 DKED CC1(C)CC[C@@H]2C[C@@H](NCc3ccc(C#N)s3)c3cccc1c32 538493302 ZQTVIIHLMKYAFB-FZKQIMNGSA-N 322.477 5.009 30 20 DKED C=CCCc1ccccc1NC(=O)C1CC(c2cccc(F)c2)C1 548772010 FIPBTHJTMFPYDG-UHFFFAOYSA-N 323.411 5.077 30 20 DKED CC[C@@H](C#N)C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1 593509676 GEZFXCIFWKMRLI-GJZGRUSLSA-N 324.449 5.028 30 20 DKED CCC(C)(C)OCc1ccccc1N[C@@H](C)c1cccc(C#N)c1 612574896 RYYAPFJZOZQPHJ-INIZCTEOSA-N 322.452 5.437 30 20 DKED C=CC[C@H](N[C@@H](C)c1cc2ccc(C)cc2o1)c1ccncc1 756036123 NZWZZVLJKDYEJB-YJBOKZPZSA-N 306.409 5.104 30 20 DKED C=CC[C@H](N[C@@H](C)c1cc(Cl)cc(Cl)c1)c1ccncc1 766019500 MCSWWLULRXTUDI-SJCJKPOMSA-N 321.251 5.356 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792106876 TXBFCVBUUUWMRO-LPHOPBHVSA-N 320.436 5.018 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1 154327941 JUIRLYRXBXWLQD-HUUCEWRRSA-N 310.466 5.082 30 20 DKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccccc1C#N 520173031 FOFAAIPKYFSTDV-LBPRGKRZSA-N 319.235 5.058 30 20 DKED C=C[C@H](CC(=O)N1CCC[C@H]1c1cccc(C)c1)c1ccccc1 535367141 DLQTZGPHHXSCCA-NQIIRXRSSA-N 319.448 5.018 30 20 DKED Cc1cccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1C 559860430 ULQGMWMWYLLRMD-RXVVDRJESA-N 306.453 5.389 30 20 DKED C[C@@H](N[C@H](C)c1ccc(-c2ccccc2)o1)c1cccc(C#N)c1 610830511 YDTFRVXEGIFVME-HZPDHXFCSA-N 316.404 5.230 30 20 DKED O=C(/C=C\c1ccc2cnccc2c1)c1cc2ccccc2s1 782350643 BZHDTLJVCLAPGC-VURMDHGXSA-N 315.397 5.346 30 20 DKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1csc2ccccc12 804438044 LCDOWBSNTMIQCY-MRVPVSSYSA-N 319.842 5.056 30 20 DKED CC[C@H](NCc1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 447520039 SAFYGGKAKDHODZ-KRWDZBQOSA-N 319.235 5.106 30 20 DKED N#CCC[C@H](Nc1ccnc2c(Cl)cccc12)c1ccccc1 553510448 CUAPWKJJKAENLM-KRWDZBQOSA-N 321.811 5.345 30 20 DKED C[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1ccc(Cl)s1 594515601 OGOSBMCIYNGANA-LBPRGKRZSA-N 316.857 5.003 30 20 DKED Cc1ccc([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)s1 768402874 RGRYBLHJBITHKH-PPDQVPDSSA-N 324.493 5.111 30 20 DKED C=CC[C@@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccncc1 795795031 LHHHPTYYMBAFFV-UXHICEINSA-N 306.453 5.101 30 20 DKED C=CC[C@@H](N[C@@H]1CCC(C)(C)c2ccccc21)c1ccncc1 795795038 LHHHPTYYMBAFFV-WOJBJXKFSA-N 306.453 5.101 30 20 DKED CC(C)(C#N)CCCSC[C@@H]1[C@@H](c2ccccc2)C1(F)F 902575407 IRILWFOMILXXJJ-HUUCEWRRSA-N 309.425 5.098 30 20 DKED Cc1ccc(-c2csc3ncnc(NN=C4CCCC4)c23)cc1 7861969 LYTJSMMZKFHYGL-UHFFFAOYSA-N 322.437 5.009 30 20 DKED CC1(C)C[C@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 358337026 DXZIBHCBKYTYNP-UXHICEINSA-N 304.437 5.044 30 20 DKED CC(C)c1ccc([C@H](N[C@H]2CC[C@@H](C#N)C2)c2cccs2)cc1 442647973 LLEGDUPFAHNLCW-BPAFIMBUSA-N 324.493 5.243 30 20 DKED CC[C@H](N[C@H](C)c1c(F)cccc1Cl)c1ccc(C#N)cc1 517278342 KYBMWQDXSOIGFN-PXAZEXFGSA-N 316.807 5.153 30 20 DKED Cc1c(COc2ccccc2)cccc1NCCCC(C)(C)C#N 531902757 FXTSLWPZXYBDNB-UHFFFAOYSA-N 322.452 5.316 30 20 DKED C[C@@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)c(F)c1 538508454 MYSWSPVAQLPXRJ-AUUYWEPGSA-N 310.416 5.135 30 20 DKED C=CCC[C@@H](N[C@H](C)c1sc(CC)nc1C)c1ccccc1 540150308 IBVDHOVEJWHYSI-RHSMWYFYSA-N 314.498 5.372 30 20 DKED CSc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1Cl 600851338 NORPGRXWJVAWTA-NSHDSACASA-N 302.830 5.107 30 20 DKED C[C@H](Nc1ccccc1OC1CCCC1)c1cccc(C#N)c1 611482534 YWOURQNFTCBVDA-HNNXBMFYSA-N 306.409 5.053 30 20 DKED Cc1ccccc1C(=O)/C=C\c1csc(-c2ccsc2)n1 920064684 IZRSNURKVJRVMB-SREVYHEPSA-N 311.431 5.076 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)cc(F)c1 189908677 XPCSPYBFGRBGED-UHFFFAOYSA-N 315.363 5.069 30 20 DKED Cc1c(COC(C)(C)C)cccc1N[C@@H](C)c1cccc(C#N)c1 538554770 WQUCSOHSWDQVOS-INIZCTEOSA-N 322.452 5.355 30 20 DKED C#CC[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccccc1 773117386 VPIQOZUNDLOYTP-RDTXWAMCSA-N 317.354 5.121 30 20 DKED C[C@@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1F 781421811 LLQHUDRCKGTGKP-SNVBAGLBSA-N 322.355 5.185 30 20 DKED O=C1/C(=C\c2ccsc2)CCc2nc(-c3ccccc3)sc21 207732358 ZTEKILQYPZDEOU-UVTDQMKNSA-N 323.442 5.084 30 20 DKED C=CC[C@@H]1N(C(=O)Nc2c(C)cc(C)cc2C)CCCC1(C)C 444818411 OFNMTQYEHYSZHT-KRWDZBQOSA-N 314.473 5.210 30 20 DKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CCCC(C)(C)C#N 475729069 MKMCXHNROJCKMK-HUUCEWRRSA-N 306.881 5.094 30 20 DKED Cc1cc(C)cc(CNc2ccccc2SC[C@@H](C)C#N)c1 487399429 XNDDCIASNHQKKC-INIZCTEOSA-N 310.466 5.167 30 20 DKED N#Cc1ccc(SCc2csc(-c3cccs3)n2)cc1 509670076 XLOJZFKCMLNFRX-UHFFFAOYSA-N 314.460 5.036 30 20 DKED C=CCCN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 533393785 MLXZEBYFINKKBT-KRWDZBQOSA-N 310.441 5.178 30 20 DKED C#CC[C@@H](N[C@@H](C)c1ccc(OC(C)(C)C)cc1)c1ccccc1 765802305 AIUKHDDVRJCKFT-LAUBAEHRSA-N 321.464 5.279 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1csc2ccccc12 781421937 IXZZSYNOTFIYLE-OLZOCXBDSA-N 324.424 5.324 30 20 DKED N#Cc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c1 205882071 IXXJQJVDZIFJFW-NTEUORMPSA-N 309.368 5.121 30 20 DKED CC(C)(C#N)CCCCSCc1cc(F)cc2cccnc12 435887812 DWLIFIGYOBKUTM-UHFFFAOYSA-N 316.445 5.327 30 20 DKED C=CC[C@H]1N(C(=O)Nc2cccc(C(F)F)c2)CCCC1(C)C 445245191 UBPRFGMVNNSZCL-OAHLLOKOSA-N 322.399 5.223 30 20 DKED CC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)s1 537407761 ZUJDUJPDIABUGI-HZMBPMFUSA-N 322.836 5.214 30 20 DKED CC[C@H](c1ccc(Cl)cc1Cl)N1CCC(CC#N)CC1 578496420 CWFVNABLGOWGEX-MRXNPFEDSA-N 311.256 5.070 30 20 DKED C=CCOc1cccc(CN[C@H](CC)c2cccc(Cl)c2)c1 618466268 BNXQKSXRQUAVRQ-LJQANCHMSA-N 315.844 5.146 30 20 DKED C=CCCc1ccccc1NC(=O)C1(c2ccc(F)cc2)CCC1 669675495 ZTNOAUJELFNHBK-UHFFFAOYSA-N 323.411 5.005 30 20 DKED Cc1ncccc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 728785681 JMTGOMKUNOYKGE-NTMALXAHSA-N 313.356 5.186 30 20 DKED CSc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1 730550213 PHYMNCSHLMRFTA-UHFFFAOYSA-N 312.221 5.172 30 20 DKED Cc1ccc(F)c(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745990535 STUGVJAWSLRETE-VQHVLOKHSA-N 317.363 5.092 30 20 DKED CCSc1ccccc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1 154327848 JUIRLYRXBXWLQD-GJZGRUSLSA-N 310.466 5.082 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccccc1Cl 444598009 NZUOQCYASBOVFE-KRWDZBQOSA-N 304.865 5.197 30 20 DKED C[C@H](c1ccc2ccccc2c1)N(CCCSCC#N)C1CC1 466736412 WEWVZXDSWFHUED-MRXNPFEDSA-N 324.493 5.012 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCCCCOC(C)(C)C 473667034 ZQBTZRWYHVOLIA-HNNXBMFYSA-N 320.502 5.088 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(F)c(OC)c1)c1ccccc1 536833617 PYOGDANMIQZJEW-DNVCBOLYSA-N 313.416 5.192 30 20 DKED Cc1cc(F)c(C(F)(F)F)cc1N[C@@H](C)c1ccc(C#N)cc1 600850835 CBQJLUKIMKQEMR-NSHDSACASA-N 322.305 5.198 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](C)C2CCCCC2)n1 747196158 HEZQJGNAMJTBRV-UKRRQHHQSA-N 318.486 5.049 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)oc2c1 425929042 LZHKBOXLNHJBDM-HUUCEWRRSA-N 304.393 5.025 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1F)c1ncc(-c2ccccc2)o1 525629939 TYKZZDOJYBKPAT-GFCCVEGCSA-N 324.380 5.206 30 20 DKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H](CC1CC1)c1ccccc1 553873773 QLSWXFSVCGIJFP-VXKWHMMOSA-N 316.448 5.067 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc21 555000740 WVDPFZGTIQDSSU-CEMLEFRQSA-N 316.448 5.020 30 20 DKED CC(C)(CC#N)CSCCCCSCC(C)(C)CC#N 579972744 IWWXKHBZKNXFEO-UHFFFAOYSA-N 312.548 5.113 30 20 DKED CC[C@H](N[C@H](C)c1ccccc1OC(C)C)c1ccc(C#N)cc1 583544870 IVSSQWAUYCLOHS-UZLBHIALSA-N 322.452 5.147 30 20 DKED C[C@@H](S[C@H](C)c1c(F)cccc1F)c1ccc(C#N)cc1 609813761 NZAROXOVZLLGCU-VXGBXAGGSA-N 303.377 5.392 30 20 DKED CC(CSC(C)(C)C)=NNc1cccc(C(F)(F)F)c1 729634021 VZABCGUJCYOUEC-UHFFFAOYSA-N 304.381 5.025 30 20 DKED CC1(C)CCC/C(=C\c2csc(-c3ccsc3)n2)C1=O 757533695 HWMRBYHOIQDZBG-DHZHZOJOSA-N 303.452 5.034 30 20 DKED CC[C@H](C)Oc1ccc(N[C@@H](C)c2ccc(C#N)cc2F)cc1 781423884 ZITHGZKRIZJQQT-KBPBESRZSA-N 312.388 5.048 30 20 DKED Cc1cc2cc(C(=O)/C=C\c3scnc3C3CC3)oc2cc1C 782341961 MWGHTMXBVPNSHC-WAYWQWQTSA-N 323.417 5.280 30 20 DKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(C(C)C)c1 1776784691 HXYZIIHKHBJUER-LJQANCHMSA-N 319.489 5.103 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc2ccccc2c1 174358484 UNSBDNIFOHUVFT-CVEARBPZSA-N 300.405 5.123 30 20 DKED CSc1ccc(Cl)c(N[C@@H](C)c2cccc(C#N)c2)c1 600852025 KNDQMLORVWUUAP-NSHDSACASA-N 302.830 5.107 30 20 DKED CC[C@@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 610008090 FTRPZVMJJIFHEA-GOSISDBHSA-N 314.379 5.329 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C(C)(C)C#N)cc1)C(C)C 614179625 VFDSBQUQSWOSEU-OAQYLSRUSA-N 320.480 5.283 30 20 DKED CC[C@H](NCc1cccc(C#N)c1F)c1cccc2ccccc12 794830099 YKEPXGDQCFKJTL-FQEVSTJZSA-N 318.395 5.091 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1cccn1C 916959275 ZOUCVWRIZHRUPJ-IBGZPJMESA-N 318.505 5.219 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1C(C)(C)C 43314290 COZMUFDPPQHUAA-UHFFFAOYSA-N 322.452 5.204 30 20 DKED N#Cc1csc(CN[C@H](CC2CCCC2)c2ccccc2)c1 533104829 OJKZFOIANKGPIS-LJQANCHMSA-N 310.466 5.031 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cnc(C(C)(C)C)s1 736434805 VYMROLINCFSPIF-MDZDMXLPSA-N 324.449 5.126 30 20 DKED CCCCCCCCCCC(=O)N1CC[C@]2(C)[C@@H](C1)C2(F)F 816786868 OXHFGNASNYHWQW-NVXWUHKLSA-N 315.448 5.021 30 20 DKED CCCCCCCCC(=O)N1CCCCC[C@H]1c1cccn1C 912999584 UMEDQIZSXFOVOZ-IBGZPJMESA-N 318.505 5.219 30 20 DKED C[C@@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1ccc(C#N)cc1 924785616 OTYPECAAZWEMHN-GHMZBOCLSA-N 324.371 5.050 30 20 DKED CC(C)N(CCCC#N)Cc1ccc(-c2ccc(F)cc2)s1 64801566 PLDMMFZPXUQFLJ-UHFFFAOYSA-N 316.445 5.068 30 20 DKED CCCCCCCC(=O)OC(F)(F)c1ccc(F)c(F)c1F 103679880 AERZFSLRHXRIPF-UHFFFAOYSA-N 324.289 5.057 30 20 DKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1nc2ccccc2o1 190822396 JIVWYIMWZSZLKV-OLZOCXBDSA-N 308.406 5.255 30 20 DKED CC(C)Oc1ccccc1-c1nc(-c2cccc(C#N)c2)cs1 439154245 RRIJNFZVFPHUDZ-UHFFFAOYSA-N 320.417 5.136 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@@H](C)CC 475561252 LJNUNYIHCWAOBP-INIZCTEOSA-N 316.489 5.438 30 20 DKED C[C@H](CCC(C)(C)C)C(=O)Nc1ccccc1SCCC#N 542553603 GNSBOVOGVSVAOQ-CQSZACIVSA-N 318.486 5.093 30 20 DKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842941912 UIRJQRYNSMDMRV-WBMJQRKESA-N 324.449 5.024 30 20 DKED CC(C)[C@H]1CCCCCC1=NNc1ccc(Cl)c(C(=O)O)c1 1776034106 OCCQSOFLBMEZCN-CYBMUJFWSA-N 322.836 5.042 30 20 DKED Cc1ccc(F)cc1CNc1ccccc1S[C@H](C)CC#N 187282998 OEIMJKUPPAVPJF-CQSZACIVSA-N 314.429 5.141 30 20 DKED C[C@H](Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 324231492 VGNPMRMBCQOVQX-INIZCTEOSA-N 314.388 5.524 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@H](CCCC#N)c1ccccc1)CC2 340451836 PDRRLQXBDJUIHP-RTWAWAEBSA-N 304.437 5.007 30 20 DKED CC[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccc(C#N)cc1 447525571 ARAIATSKDGGPDP-KSSFIOAISA-N 320.461 5.575 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccoc1)c1ccc(C(F)(F)F)cc1 540149038 LJYGTFHFXZCRMB-DYVFJYSZSA-N 323.358 5.657 30 20 DKED CC[C@H](CC#N)NCc1ccc(-c2cccc(Cl)c2Cl)o1 546581862 HGMYLILYJIQGAL-LLVKDONJSA-N 323.223 5.035 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cccc(SCC)c1 606948759 ONHXLUUBDUSBDN-UHFFFAOYSA-N 306.475 5.009 30 20 DKED C[C@H](Sc1ccc(C#N)cc1F)c1ccc(OC(F)F)cc1 610165725 JBOADJUMBALFME-JTQLQIEISA-N 323.339 5.152 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc(C2CC2)cc1 681607069 OBBPTMODKJIBKN-UHFFFAOYSA-N 309.434 5.094 30 20 DKED FC(F)(F)c1ccc2sc(NN=C3CCCCC3)nc2c1 743445336 PWZFUMSFMBHIPB-UHFFFAOYSA-N 313.348 5.047 30 20 DKED Cc1ccc2cc(C(=O)/C=C\c3cnc(C(C)C)s3)oc2c1 754824482 JSVBUBCQNZGCEH-SREVYHEPSA-N 311.406 5.217 30 20 DKED COc1ccc(/C=C/C(=O)c2ccc(F)cc2F)c2ccccc12 915984083 HLGGAOFPNZFTMJ-UXBLZVDNSA-N 324.326 5.023 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2[nH]1 925755377 NKGVRPKBMCQFER-OAHLLOKOSA-N 319.408 5.024 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90664550 UKQJGDUJGWILJC-TZMCWYRMSA-N 304.846 5.097 30 20 DKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)C[C@@H]1CCCCC1(C)C 329181253 DSKQMFJEYOZONG-JJRVBVJISA-N 322.493 5.083 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)cc(F)c1 340444222 HACBJPUFBNYFSE-AUUYWEPGSA-N 314.379 5.051 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(C(F)F)c1 485335199 ZNXNDUWTENPDQU-UHFFFAOYSA-N 322.399 5.224 30 20 DKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc2ccccc12 554996698 ARZUXIBVEWJBBS-QRQCRPRQSA-N 312.416 5.050 30 20 DKED CC(C)(C#N)CCSCc1coc(-c2cccc(Cl)c2)n1 569266976 PRFFUKWUBQQADS-UHFFFAOYSA-N 320.845 5.168 30 20 DKED C[C@H](Nc1cccc(-c2cccs2)c1)c1cccc(C#N)c1 600850164 QOYNMBDGNDBIBF-AWEZNQCLSA-N 304.418 5.460 30 20 DKED CC[C@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(F)cc1F 610008092 FTRPZVMJJIFHEA-SFHVURJKSA-N 314.379 5.329 30 20 DKED C=CCC[C@@H](NCc1ccc(OC(C)(C)C)cc1)c1ccco1 671756147 UKOXKHPPXGOHMZ-GOSISDBHSA-N 313.441 5.254 30 20 DKED C[C@@H](Nc1cccc(SC(F)(F)F)c1)c1cccc(C#N)c1 864021437 LIQLQBLYINBHHE-LLVKDONJSA-N 322.355 5.343 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1C(C)C 43231146 ALDOUNUKKGHHSH-UHFFFAOYSA-N 314.454 5.092 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2ccccc2s1 188258676 FLEYJYQVBIGNFF-YJBOKZPZSA-N 320.461 5.597 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1cccc(C#N)c1)CC2 427854767 BNHXDXNWTOECBD-BTYIYWSLSA-N 304.437 5.020 30 20 DKED C[C@H](NCCCCC(C)(C)C#N)c1cccc(Cl)c1Cl 444683349 GAGYIDRTDFZYJL-LBPRGKRZSA-N 313.272 5.364 30 20 DKED Cc1ccccc1C1CC(N(CCCC(C)(C)C#N)C2CC2)C1 472255119 HMYJMXMRFRCYNV-UHFFFAOYSA-N 310.485 5.035 30 20 DKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1 520959473 MRNCLPLUINUAMK-FQEVSTJZSA-N 324.855 5.233 30 20 DKED C[C@H](Nc1cccc(N2CCCCCC2)c1)c1cccc(C#N)c1 537532599 APZCKEIOFIJJKH-KRWDZBQOSA-N 319.452 5.112 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1sccc1Cl 566964829 LEKFOCAJIKIFLZ-UHFFFAOYSA-N 319.857 5.506 30 20 DKED Cc1ccsc1C(=O)/C=C/c1cnc(-c2cccs2)s1 751514093 PLKVHPKYAJTDLA-SNAWJCMRSA-N 317.460 5.138 30 20 DKED FC(F)C1CC(=NNc2c(Cl)cc(Cl)cc2Cl)C1 766008476 IDKJTOLZUNGLNL-UHFFFAOYSA-N 313.562 5.090 30 20 DKED C=CCC[C@@H](N[C@H]1CCc2ccc(Cl)nc21)c1ccccc1 788673809 YHGLOMYPOIAHTQ-SJORKVTESA-N 312.844 5.019 30 20 DKED O=C(/C=C\c1cccnc1)c1ccc(SC2CCCC2)cc1 914702736 KNMGLVQVFXBZQX-GHXNOFRVSA-N 309.434 5.012 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccccc1 189883078 RKVGTPKSHXSJGC-QGZVFWFLSA-N 321.464 5.356 30 20 DKED CCC(CC)n1ccc(CS[C@H](C)c2ccc(C#N)cc2)n1 433625579 RPEQWBLPYGKUKA-CQSZACIVSA-N 313.470 5.110 30 20 DKED Cc1nc(C(C)C)sc1[C@H](C)N(C)CCCCC(C)(C)C#N 444674675 KXSVVVGQLVSLHO-HNNXBMFYSA-N 321.534 5.288 30 20 DKED CCC(CC)[C@@H](NCc1ccc(CC#N)cc1)c1ccccc1 544120905 UAWWHGPBOGTNLA-OAQYLSRUSA-N 306.453 5.020 30 20 DKED C[C@H](CCc1ccccc1)N[C@H](CCCC#N)c1ccccc1 559866096 UNDFQTWDWAXFMI-WIYYLYMNSA-N 306.453 5.032 30 20 DKED Cc1cc(SC(C)(C)C)ccc1N[C@@H](C#N)Cc1ccccc1 725843530 UQOHWDMTQZTIIO-QGZVFWFLSA-N 324.493 5.432 30 20 DKED C/C(=C\C(=O)Nc1sc(-c2ccccc2)cc1C#N)C(C)(C)C 744361432 LULWGJSPQPTEIF-JLHYYAGUSA-N 324.449 5.218 30 20 DKED COc1ccc2cc(/C=C\C(=O)c3ccc(F)cc3F)ccc2c1 96765430 KWPWWVVFOKDWOU-OQFOIZHKSA-N 324.326 5.023 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)oc2c1 425929043 LZHKBOXLNHJBDM-LSDHHAIUSA-N 304.393 5.025 30 20 DKED Cc1ccccc1[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 479765902 KQESMCAJTDJCNL-HOCLYGCPSA-N 310.466 5.420 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2)cc1 563741411 WVSCNLANWXYFIJ-QGZVFWFLSA-N 306.453 5.334 30 20 DKED CC[C@H](CNc1ccccc1S[C@H](C)CC#N)CC(F)F 594704640 CCHGMACTUYEXAA-OLZOCXBDSA-N 312.429 5.174 30 20 DKED C[C@@H](NCCCCC#N)c1ccc(O[C@H](C)c2ccccc2)cc1 595009865 DRKWLKHBCIQAHU-QZTJIDSGSA-N 322.452 5.171 30 20 DKED O=C1/C(=C\c2cnc(C3CCC3)s2)[C@H]2CCCc3cccc1c32 763288667 IPPCUHTWRHTZMV-DISPHTKASA-N 321.445 5.110 30 20 DKED C[C@@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)c(F)c1 777673174 HBIUJIRLGBWNGL-SNVBAGLBSA-N 322.355 5.185 30 20 DKED O=C(/C=C\c1ccc(-c2ccccc2F)o1)c1ccccc1F 917030874 LCDIXHDUEHWAHK-LUAWRHEFSA-N 310.299 5.121 30 20 DKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)s1 37777481 OQYDCLAHMIAENQ-GFCCVEGCSA-N 320.845 5.257 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 340448046 ISMMMNOSAWONJF-LEWJYISDSA-N 306.453 5.471 30 20 DKED C=CCCCCCS[C@@H](C)C(=O)Nc1c(C)cccc1C 485580057 PRONBPVUTSVWLS-INIZCTEOSA-N 305.487 5.110 30 20 DKED N#Cc1cccc(CNC2(c3ccc(Cl)cc3)CCCCC2)c1 520219803 LMJIOIDNUZRGKC-UHFFFAOYSA-N 324.855 5.161 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc2ccccc2n1)c1ccccc1 537946266 XHWBJDUIJGASRT-UWJYYQICSA-N 316.448 5.593 30 20 DKED C[C@@H](Nc1ccc(N2CCCCCC2)cc1)c1ccc(C#N)cc1 743475158 OGSNCHFYJSGUGX-QGZVFWFLSA-N 319.452 5.112 30 20 DKED CC[C@@H](C)Oc1ccc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1 776869937 SLWAFNHNCJPJOW-ZIAGYGMSSA-N 312.388 5.048 30 20 DKED C=CCC[C@H](N[C@H](C)c1ncco1)c1ccc(C(F)(F)F)cc1 925598198 QOZYKFVZQLOJLX-DOMZBBRYSA-N 324.346 5.052 30 20 DKED CCC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccsc1 340447182 PFEJFBYZNMPECX-RBUKOAKNSA-N 312.482 5.614 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)C)cn1 464484582 SXGXFROPHGAXGQ-UHFFFAOYSA-N 322.452 5.309 30 20 DKED Cc1ccc2c(c1)[C@@H](Nc1cccc(OCCCC#N)c1)CCC2 538527166 UTMIKXMAIWZDLS-NRFANRHFSA-N 320.436 5.167 30 20 DKED CC[C@](C)(C#N)C(=O)Nc1ccc(Sc2ccccc2)cc1C 572277287 LNTGNOAFSLGALM-LJQANCHMSA-N 324.449 5.025 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792106872 TXBFCVBUUUWMRO-APWZRJJASA-N 320.436 5.018 30 20 DKED CCCC[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 799891278 CGRVCVOJXUUPEX-JXFKEZNVSA-N 320.436 5.107 30 20 DKED C=CCN(C(=O)Nc1cc(Cl)ccc1C(C)(C)C)C(C)C 801831683 WPQUQYAHNYENCJ-UHFFFAOYSA-N 308.853 5.066 30 20 DKED CC(C)c1ccc(C=NOCc2csc(C(C)(C)C)n2)cc1 918185461 ADIFZYQVCMGKEU-UHFFFAOYSA-N 316.470 5.115 30 20 DKED Cc1c([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)oc2ccccc12 124609862 SMZOGNYOIUCIIH-LSDHHAIUSA-N 304.393 5.025 30 20 DKED CC(C)(CCC#N)CNc1ccc(COCc2ccccc2)cc1 151072067 NGAZEPRNAHXFDD-UHFFFAOYSA-N 322.452 5.145 30 20 DKED N#Cc1ccc(F)c(CNc2cccc(-c3cccs3)c2)c1 487377820 JIWURBCVNFOFPD-UHFFFAOYSA-N 308.381 5.038 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C/c2nc(Cl)cs2)cc1 759084142 NVFBOIGUSMMXPI-BQYQJAHWSA-N 323.870 5.193 30 20 DKED C=CCC[C@@H](NC(=S)Nc1ccc(C)cc1C)c1ccccc1 771850430 KRDWFTWMDTVAEB-LJQANCHMSA-N 324.493 5.297 30 20 DKED CC(/C=C/C(=O)c1cncs1)=C\c1cccc(C(F)(F)F)c1 806573291 HTEWWQQYGRLQMC-LCAICKDSSA-N 323.339 5.004 30 20 DKED N#C[C@@H](Cc1ccccc1)Sc1nc(-c2ccccc2)cs1 855897169 FZWXVHYOFCRDCD-MRXNPFEDSA-N 322.458 5.037 30 20 DKED CSc1ccc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1 303771613 MYHXEDRXAAXAGR-MDZDMXLPSA-N 317.479 5.059 30 20 DKED N#CC1CCC(CN[C@H](CC2CC2)c2ccc(Cl)cc2)CC1 442866232 KNZSEMLYTRGIHN-LADRWXRNSA-N 316.876 5.101 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)C1CCC1 475564614 MWBIXXLRJUMMDM-HNNXBMFYSA-N 314.473 5.191 30 20 DKED CSc1cc(Cl)ccc1N[C@H](C)c1cccc(C#N)c1 600852022 KGWKQGCSCJKORX-LLVKDONJSA-N 302.830 5.107 30 20 DKED Cc1nc(-c2ccc(N[C@H](C)c3ccc(C#N)cc3)cc2)oc1C 611482511 TZTDLURSJDGARU-CQSZACIVSA-N 317.392 5.003 30 20 DKED O=C(O)c1ccc(NN=C2CCCCCCCCCCC2)cc1 1776012028 SGNMKBMHAMOHLK-UHFFFAOYSA-N 316.445 5.457 30 20 DKED C[C@H](N[C@@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 74335969 PDQRPFQNCQUTAM-HOTGVXAUSA-N 300.405 5.123 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(F)c(Cl)c1 90664898 KJNOOYKOOUMJMQ-FZKQIMNGSA-N 316.807 5.175 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccc(F)cc1)c1ccc(F)c(F)c1 480658608 LALWNSISXZUARL-KZULUSFZSA-N 305.343 5.072 30 20 DKED CCC(=CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC 759146239 ZHFGXWFVNOZUEW-FQEVSTJZSA-N 318.420 5.027 30 20 DKED CCCCCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917045816 AIUFKNZAZPIUFL-LBPRGKRZSA-N 320.845 5.096 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2c(c1)CCC2 340449471 VISPDJMUFYZLIT-JTSKRJEESA-N 318.464 5.261 30 20 DKED C=C[C@@](C)(CC)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 442963440 GZVATHTVXJKPMJ-IERDGZPVSA-N 322.452 5.401 30 20 DKED CC(C)(C#N)CCCCNC1(c2cccc(C(F)(F)F)c2)CC1 444660869 SQMJKLWADPJQPB-UHFFFAOYSA-N 324.390 5.004 30 20 DKED CC(C)Oc1ccccc1[C@H](C)Nc1ccc(C#N)c(Cl)c1 518372073 ARSBDDGWIILJRN-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(C#N)c1 538396676 XVESLENQHQLYGT-XOBRGWDASA-N 324.855 5.404 30 20 DKED C=CCCC[C@H](C)Sc1nnc(-c2ccccc2Cl)o1 540371277 DUFURTCCFZTICH-NSHDSACASA-N 308.834 5.227 30 20 DKED C=CCC[C@H](Nc1cccc(COCc2ccco2)c1)C1CC1 561801231 ZDRJPLYSHWUXIZ-FQEVSTJZSA-N 311.425 5.153 30 20 DKED CC[C@@H](N[C@@H](C)c1ccccc1OC(C)C)c1ccc(C#N)cc1 583544868 IVSSQWAUYCLOHS-OXJNMPFZSA-N 322.452 5.147 30 20 DKED Cc1ccc(-c2ccccc2NCc2cc(C#N)ccc2F)s1 864032658 GULOMLFBVAEPSC-UHFFFAOYSA-N 322.408 5.346 30 20 DKED Cc1ccccc1[C@H](Sc1cc(C#N)ccn1)c1ccccc1 71918222 JOGGGYYKMDBRMB-HXUWFJFHSA-N 316.429 5.143 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(C)ccc1OC 90665150 WDESSFVDQZWPRJ-WOJBJXKFSA-N 322.452 5.089 30 20 DKED N#CCc1ccc(NCc2cc(-c3ccccc3)cs2)cc1 237834819 BUNJLIHWOBAZAQ-UHFFFAOYSA-N 304.418 5.093 30 20 DKED Cc1cnc([C@@H](C)/N=C(/O)C2(C3CCCCC3)CCCCC2)o1 329434934 LIKHQHMMGWTDSZ-OAHLLOKOSA-N 318.461 5.531 30 20 DKED CSc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 340449325 UOTOQBQPHIHHOB-OXQOHEQNSA-N 324.493 5.494 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](C)c1cc(Cl)ccc1Cl 614406822 ALBISMOFJAIKOA-LBPRGKRZSA-N 319.235 5.024 30 20 DKED CC[C@H](NCC1CCC(C#N)CC1)c1cccc2ccccc12 619673718 WYQSTIPGPRWCIA-BPZDKFOGSA-N 306.453 5.210 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1ccccc1SC(C)(C)C 788520464 RHGSCGMGFGGVTK-OAHLLOKOSA-N 324.493 5.300 30 20 DKED C=CCCCCC[C@@H](C)Nc1ccc(NC(C)=O)c(Cl)c1 793546948 PDHAXCILVQHYIR-CYBMUJFWSA-N 308.853 5.235 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1c(C)cccc1C 918541732 IPSDYGRTZXNPRR-UHFFFAOYSA-N 304.478 5.518 30 20 DKED N#CCC[C@H](N[C@H]1CCCc2c(Cl)cccc21)c1ccccc1 349756914 JABNFHCRAVQXSZ-PMACEKPBSA-N 324.855 5.352 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccccc1CCC 485754004 FHMZRMRKGJPRNH-UHFFFAOYSA-N 311.450 5.170 30 20 DKED CC(/C=C/c1ccncc1C#N)=C\c1ccccc1C(F)(F)F 504720037 GTRWELQFJZMYLH-FCXQYMQBSA-N 314.310 5.089 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)cc1 512658965 BGHOUUJIYXBSFG-KPZWWZAWSA-N 316.807 5.153 30 20 DKED C=CCC[C@H](NCc1ccc(-c2ccncc2)cc1)c1ccco1 552058368 DVQIHXBTXQQTLQ-FQEVSTJZSA-N 318.420 5.139 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C/c1cnc(C3CCC3)s1)C2=O 766695195 HRPVMRMNIGPXNA-PFSWGADMSA-N 309.434 5.102 30 20 DKED C=CC[C@@H](C(=O)O[C@@H](C)CCCC(F)(F)F)c1ccccc1 778735556 KHBLEWDKSJLEIO-DZGCQCFKSA-N 314.347 5.011 30 20 DKED Cc1cccc(NN=Cc2c(Cl)ccc(Cl)c2Cl)c1 818199425 MWALLGIKPIYCRI-UHFFFAOYSA-N 313.615 5.401 30 20 DKED C=CCSc1nnc(SCc2ccc(C(C)C)cc2)s1 72099067 YPGKZZSVZHPELK-UHFFFAOYSA-N 322.524 5.232 30 20 DKED Cc1c([C@H](NCc2cc(C#N)cs2)C(C)C)oc2ccccc12 236732209 WMNMZFHQLZNQQL-GOSISDBHSA-N 324.449 5.161 30 20 DKED CC(O)=Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 329013789 PKQXUAXTKIOIMI-FHLIZLRMSA-N 314.429 5.489 30 20 DKED C[C@H](S[C@@H](C)c1c(F)cccc1F)c1ccc(C#N)cc1 609813760 NZAROXOVZLLGCU-RYUDHWBXSA-N 303.377 5.392 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@H](c2cc3ccccc3[nH]2)C1 618285824 DLWGKSBIZUIUSV-SFHVURJKSA-N 323.484 5.067 30 20 DKED C[C@H]1C/C(=C/c2coc(-c3ccccc3)n2)C(=O)c2ccccc21 751535827 NDICUWVFSVHTFX-QXPQOBGOSA-N 315.372 5.115 30 20 DKED C=CC[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 766022029 VUCHPARTRIZNHF-GUYCJALGSA-N 320.358 5.068 30 20 DKED CC[C@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 774315083 OGYQSGJYDLTMCJ-INIZCTEOSA-N 318.392 5.436 30 20 DKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1cc2ccccc2o1 779358624 SNKORYNJADJBAS-FNORWQNLSA-N 318.159 5.031 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@@H](C)[C@H]1C 417035371 FYKKECBNHGOUSZ-ARFHVFGLSA-N 314.473 5.047 30 20 DKED N#CCCCCS[C@@H](c1ccccc1)c1ccc(F)c(F)c1 480387050 JNENMNWKEFBSNG-SFHVURJKSA-N 317.404 5.481 30 20 DKED CCSCc1cccc(N[C@@H](C)c2ccc(C#N)c(F)c2)c1 540838362 QHUZFYFPMPHELI-ZDUSSCGKSA-N 314.429 5.124 30 20 DKED C[C@@H](Sc1ccc(C#N)cn1)c1ccc(Cl)c(Cl)c1 604116598 CYVJXXHMNJBDIY-SECBINFHSA-N 309.221 5.113 30 20 DKED C#CC[C@@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccccc1 765802185 AIUKHDDVRJCKFT-DYESRHJHSA-N 321.464 5.279 30 20 DKED C[C@H]1/C(=C/c2csc(-c3cccs3)n2)C(=O)c2ccccc21 809158238 ZEELTWOAIKZFKW-PDICVPPASA-N 323.442 5.255 30 20 DKED CCCCc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1 390293208 IMZQJKLFPJUDCX-MRXNPFEDSA-N 308.425 5.105 30 20 DKED CCCc1ccc([C@H](N[C@H]2CC[C@H](C#N)C2)c2cccs2)cc1 442640021 ZIZARMWGGFGMQN-QRFRQXIXSA-N 324.493 5.072 30 20 DKED CC(/C=C/c1ccc(C#N)cn1)=C\c1cccc(C(F)(F)F)c1 486121133 AYMYEZFXHYJUHV-WWFUZLPXSA-N 314.310 5.089 30 20 DKED C[C@H](NCc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 541090973 XQSHXRJRDHKTDT-KRWDZBQOSA-N 312.416 5.076 30 20 DKED C[C@H](N[C@H](C)c1ccc(F)c2ccccc12)c1cccc(C#N)c1 551039155 MHCWFIYUOLWUQF-LSDHHAIUSA-N 318.395 5.262 30 20 DKED CCc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)s1 551204874 GNHJQZUVAASPMX-MAUKXSAKSA-N 312.482 5.396 30 20 DKED COc1ccc(NCCCC(C)(C)C#N)cc1Cc1ccccc1 762783679 GSYHDYTVURREPY-UHFFFAOYSA-N 322.452 5.028 30 20 DKED C[C@H](Sc1ccc(C#N)cc1)c1ccc(OC(F)F)cc1 108964823 PYZPPSXYYJUWNA-NSHDSACASA-N 305.349 5.013 30 20 DKED CC(C)c1ccc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 192995259 KIIISJIOQNVSBW-DLBZAZTESA-N 322.452 5.124 30 20 DKED Cc1ccc(NCC(C)(C)CCC#N)cc1OCCC(C)C 462731597 PBPCVTTVMLVGCG-UHFFFAOYSA-N 302.462 5.162 30 20 DKED CC(C)Oc1ccc([C@H](C)NCC(C)(C)CCC#N)cc1Cl 577667385 NIMLIDLZGXFERM-AWEZNQCLSA-N 322.880 5.108 30 20 DKED C[C@H](S[C@H](C)c1c(F)cccc1F)c1ccc(C#N)cc1 609813759 NZAROXOVZLLGCU-NWDGAFQWSA-N 303.377 5.392 30 20 DKED CCCCCCCCC(=O)N[C@@H](c1ccccc1)c1ccccn1 105745771 LPVJLCFFLTVRLA-NRFANRHFSA-N 324.468 5.038 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccc2)o1 205565343 LZQCAGXGQZNAOK-SEYXRHQNSA-N 318.372 5.063 30 20 DKED C[C@@H](Nc1ccc2cc(C#N)ccc2n1)c1cc2ccccc2o1 301824409 NTIIVDFKSJXXCD-CYBMUJFWSA-N 313.360 5.026 30 20 DKED CC#CCCCC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 464440711 LFQXVHXDYVUAPE-KRWDZBQOSA-N 319.448 5.085 30 20 DKED Cc1cccc2nc(N[C@@H](CCC#N)c3ccccc3)sc12 480079571 CFBIHAKJOKCLGM-HNNXBMFYSA-N 307.422 5.062 30 20 DKED C[C@H](N[C@H]1CCC(C)(C)c2ccccc21)c1cccc(C#N)c1 538407924 OWHIFMWRUNNUTR-YWZLYKJASA-N 304.437 5.022 30 20 DKED CC(C)(C)C[C@H](NCCCC(C)(C)C#N)c1ccc(F)cc1 540366803 XRBFGYQVIRHQNE-KRWDZBQOSA-N 304.453 5.223 30 20 DKED Cc1cc2c(cc1C)[C@@H](N[C@@H](C)c1cccc(C#N)c1)CCS2 614633868 JECXHNGSPQVNFI-KXBFYZLASA-N 322.477 5.063 30 20 DKED c1ccc(-c2cc3c(NN=C4CCCCC4)ncnc3s2)cc1 8284946 RDGQMILSWOATQB-UHFFFAOYSA-N 322.437 5.090 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CSCCC(C)C 189888777 NTNIGLHAQOINQA-UHFFFAOYSA-N 319.514 5.256 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(F)c1F 340442008 DTRSYSARJZWBJY-KDOFPFPSSA-N 314.379 5.051 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)cc(F)c1 340444225 HACBJPUFBNYFSE-KUHUBIRLSA-N 314.379 5.051 30 20 DKED C[C@H]1CCC[C@@H](CCSCCCC2(C#N)CCOCC2)C1 508588659 NTXNEATVYPWIMX-IRXDYDNUSA-N 309.519 5.037 30 20 DKED Cc1ccc(C)c(CNc2ccccc2SC[C@H](C)C#N)c1 519424167 UGFLZVIJVWXQRI-OAHLLOKOSA-N 310.466 5.167 30 20 DKED C[C@H](NN=C(CCC(F)(F)F)CCC(F)(F)F)C(C)(C)C 853349969 MTRKAMOZGVHIFK-VIFPVBQESA-N 320.321 5.052 30 20 DKED C[C@@H](N[C@H]1CCC(C)(C)c2ccccc21)c1ccc(C#N)cc1 195613869 GWGVYOBOSIMNLB-QRWLVFNGSA-N 304.437 5.022 30 20 DKED Cc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1-c1ccncc1 427857255 IFISRULZCPKXPR-MRXNPFEDSA-N 313.404 5.102 30 20 DKED C[C@@H](SCc1cccc2cccnc12)c1cccc(C#N)c1 443133065 NGLJXDLLPVDEJP-CQSZACIVSA-N 304.418 5.101 30 20 DKED C[C@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)c(F)c1 777598922 ICZASEUYFLVOFM-JTQLQIEISA-N 322.355 5.185 30 20 DKED CC(C)Sc1cccc(Cl)c1C=NNC1CCCCC1 786043237 LPDLRODRAIFQLP-UHFFFAOYSA-N 310.894 5.097 30 20 DKED C=CCN(C(=O)Nc1ccc(N=Nc2ccccc2)cc1)C(C)C 916706167 JZJYHODRWXQBBB-UHFFFAOYSA-N 322.412 5.530 30 20 DKED CCCCSc1ccc(SCCCC)c(C#N)c1C#N 2088642676 UGFJEFGIUGEGQI-UHFFFAOYSA-N 304.484 5.214 30 20 DKED C[C@H](C#N)Oc1ccccc1N[C@H](C)c1ccc2ccccc2c1 182260540 WCPAKKPIBRAXSP-HZPDHXFCSA-N 316.404 5.304 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(CC#N)cc1 276321952 OWXFCADKMOQAPH-UHFFFAOYSA-N 320.436 5.081 30 20 DKED CCc1ccc([C@H](CC)N[C@H](CCC#N)c2ccccc2)cc1 358340923 MZSUJDDOMWLQDW-LEWJYISDSA-N 306.453 5.335 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)c1ccccc1 519542407 DJURGVLVROSWTK-UHFFFAOYSA-N 308.425 5.207 30 20 DKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccc3ccccc3c2)s1 736432882 JJRNCLKHQKPIBM-KHPPLWFESA-N 321.445 5.490 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 467118447 VXZAZMHPORZNBG-IAGOWNOFSA-N 322.452 5.401 30 20 DKED Cc1c(CSC(C)C)cccc1NC(=O)CCCCCC#N 588159221 DGZZKDSFOBBNPZ-UHFFFAOYSA-N 318.486 5.049 30 20 DKED CC(C)(C#N)CCCNc1ccc(C(F)(F)C(F)(F)F)cc1 610780448 HGPZQBZJBUEMCS-UHFFFAOYSA-N 320.305 5.083 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2ccccc2)cc1F 683780416 HMYLUMXLWGEJTE-QGZVFWFLSA-N 324.399 5.065 30 20 DKED 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322.424 5.006 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2ccccc2s1 188258701 FLEYJYQVBIGNFF-QAPCUYQASA-N 320.461 5.597 30 20 DKED Cc1ccc(C(C)(C)C)cc1[S@@](=O)CCCCC(C)(C)C#N 435437831 MNWIMBGUJGDDNG-QFIPXVFZSA-N 319.514 5.120 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(C(C)C)cc1C(C)C 519191783 QVEQWRBNSGOBBB-UHFFFAOYSA-N 302.462 5.363 30 20 DKED CC(C)(CCC#N)CN[C@@H]1CCCc2c1sc1ccccc21 558239738 YOSKNKMATQWAQL-MRXNPFEDSA-N 312.482 5.198 30 20 DKED CC[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(Cl)cc1 594914164 DSDUSQVWPHMNRP-LJQANCHMSA-N 324.855 5.136 30 20 DKED Cc1nc(-c2ccc(N[C@H](C)c3cccc(C#N)c3)cc2)oc1C 611482459 LPWJCCSLCLBEAL-CQSZACIVSA-N 317.392 5.003 30 20 DKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1ccc(Cl)s1 730433198 DODJBKCOLYEKSI-VURMDHGXSA-N 301.798 5.087 30 20 DKED Cc1cc(CSC2=Nc3ccccc3CS2)ccc1C#N 783108338 BTWSMLWEEFYXOA-UHFFFAOYSA-N 310.447 5.034 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(F)ccc1F 90665047 WYROQJWSMBVVCE-RBUKOAKNSA-N 314.379 5.051 30 20 DKED 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5.154 30 20 DKED CC(C)c1ccc(C=NO[C@H](C)c2ncc(C(C)(C)C)o2)cc1 756847901 LKWZKASWTLJXKC-CQSZACIVSA-N 314.429 5.207 30 20 DKED C#CC[C@H](N[C@H]1C[C@H](C)Sc2sccc21)c1ccccc1 773113753 DUMKEDRWFLKBDW-JQFCIGGWSA-N 313.491 5.028 30 20 DKED C#CCCCCC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 773280661 CUBMQDMJOAGRMN-KRWDZBQOSA-N 319.448 5.085 30 20 DKED CC[C@H](C)Oc1ccc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1 776869936 SLWAFNHNCJPJOW-UONOGXRCSA-N 312.388 5.048 30 20 DKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842941902 UIRJQRYNSMDMRV-BLLLJJGKSA-N 324.449 5.024 30 20 DKED C[C@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 74335975 PDQRPFQNCQUTAM-JKSUJKDBSA-N 300.405 5.123 30 20 DKED CC(C)(C#N)CCCCN1CCCC[C@H]1c1ccc(F)cc1F 444668568 VDMQQFPZCWZKLB-SFHVURJKSA-N 320.427 5.212 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 480676058 ASFVMZGJYMWSHL-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1c(C(C)C)cccc1C(C)C 486780013 PWAGPIHZJLAOSW-INIZCTEOSA-N 314.473 5.506 30 20 DKED CC(C)CCc1nc(CSCc2cccc(C#N)c2)cs1 517295738 QMPYACMFEDGKDW-UHFFFAOYSA-N 316.495 5.037 30 20 DKED CC(C)c1ccc([C@@H](NC(=O)CCCCCC#N)C(C)C)cc1 588460095 LYXBYPFMVUVABV-FQEVSTJZSA-N 314.473 5.097 30 20 DKED C=CCN(CC=C)C(=O)Nc1ccc(C(C)C)cc1C(C)C 642504231 YCJVXHIYSRGOLB-UHFFFAOYSA-N 300.446 5.139 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 766019291 LKNXUZSFCJAKQJ-SJCJKPOMSA-N 321.251 5.356 30 20 DKED CC(=NNc1c(C)cccc1C(C)C)c1cnn(C(C)C)c1C 812232279 BBAJCNBFAARKFZ-UHFFFAOYSA-N 312.461 5.040 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(F)cc1F 90665875 JCJCEUFYBBAZJN-OALUTQOASA-N 314.379 5.051 30 20 DKED CSc1ccccc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 417354938 AELAIHCEEAKYJY-KUHUBIRLSA-N 322.477 5.008 30 20 DKED C[C@H](N[C@@H](c1ccc(F)cc1)C1CCCC1)c1cccc(C#N)c1 537296549 CUYWQDRCQQHZPV-YCRPNKLZSA-N 322.427 5.279 30 20 DKED CC(C)(C)[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1 589340637 NHWLVSNKKLLTKL-UXHICEINSA-N 322.427 5.062 30 20 DKED FC(F)(F)c1ccccc1ON=Cc1csc2ccccc12 754709595 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C=CCC[C@H](N[C@@H](C)c1csc(C(C)C)n1)c1ccccc1 469802831 VXJVJNWMHORYHO-RDJZCZTQSA-N 314.498 5.625 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(C(F)F)nc1)c1ccccc1 657929485 HXCTUKVLJPGWBJ-WMLDXEAASA-N 316.395 5.377 30 20 DKED Cc1ncsc1/C=C\C(=O)c1cccc(-c2ccccc2)c1 742433255 UXOLCZDOCBPIIK-KHPPLWFESA-N 305.402 5.015 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1Cl 37201466 ZFQURRSABAIHAK-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C=CCC[C@@H](C(=O)N1[C@H]2CC[C@H]1c1ccccc12)c1ccccc1 478056638 ZNXSXKILORFWGY-QMMLZNLJSA-N 317.432 5.155 30 20 DKED C=CCC[C@H](NCc1ccc(C)cc1SC)c1ccco1 513697977 VERGBNXEFRFCHY-INIZCTEOSA-N 301.455 5.107 30 20 DKED C[C@H](N[C@H](C#N)c1ccc(Cl)cc1)c1cc2ccccc2o1 585719286 MCODBDUCIFBYGX-BLLLJJGKSA-N 310.784 5.002 30 20 DKED C=CCCCCCN(C)C(=O)c1cc2c(ccc3ccccc32)[nH]1 606881103 FVFIZICUITWNGX-UHFFFAOYSA-N 320.436 5.140 30 20 DKED Cc1ccsc1C(=O)/C=C\c1csc(-c2ccsc2)n1 733749625 QOMWDKIEYNOEHE-IHWYPQMZSA-N 317.460 5.138 30 20 DKED Cc1ccc(F)c(C(=O)/C=C/c2csc(-c3ccccc3)n2)c1 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DKED C=C(C)[C@@H](NCc1ccsc1Cl)c1ccc(F)c(F)c1 480251647 JITFQAFRBAAOCU-CQSZACIVSA-N 313.800 5.087 30 20 DKED C=C(C)CCSCC(=O)Nc1c(C(C)C)cccc1C(C)C 507852343 VYVFFRSSOXQOTM-UHFFFAOYSA-N 319.514 5.571 30 20 DKED CC(C)c1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)cc1 512625789 QMDQPIWONFCKGW-LSDHHAIUSA-N 310.416 5.233 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC(C)(C)C)cc1 613242445 DOBZGGCPVDCSFR-JKSUJKDBSA-N 322.452 5.147 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(CC(C)C)cc1)c1ccncc1 766021619 QRYHQDDXZCNACI-LAUBAEHRSA-N 308.469 5.248 30 20 DKED C=CCCC[C@@H](c1ccccc1)c1nc(CCC(F)(F)F)no1 904865341 ANUJCSCDOGCPFC-AWEZNQCLSA-N 324.346 5.053 30 20 DKED CC(C)Oc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665038 YUHKEQQMBFXXLR-LAUBAEHRSA-N 322.452 5.169 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CCC)C(C)C 476158859 ROQIQEVEFDNJAH-SFHVURJKSA-N 301.474 5.549 30 20 DKED C[C@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1 495402822 SKICEOHCXUGRGZ-HRAATJIYSA-N 304.437 5.140 30 20 DKED Cc1ccc2nc(/C=C/c3ccc(O[C@H](C)C#N)cc3)ccc2c1 110967435 JWHVUCIFJXERBK-KZJSRBBCSA-N 314.388 5.005 30 20 DKED Cc1ccc(C2CC(Nc3cccc(OCCCC#N)c3)C2)cc1 324410435 VSEXIKYAKSRZQD-UHFFFAOYSA-N 320.436 5.036 30 20 DKED CC(C)(C)[C@H](N[C@H]1CC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1 442852377 XWYPAPNDVHLQMC-VBNZEHGJSA-N 324.390 5.074 30 20 DKED CO[C@H](C)c1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 482003370 UAPUUZUYXLNASP-QVKFZJNVSA-N 320.436 5.145 30 20 DKED CC(C)c1ccc(NC(=O)c2ccc(C#N)cc2)c(C(C)C)c1 512390464 FUDQGNAOHLTHKV-UHFFFAOYSA-N 306.409 5.057 30 20 DKED CC1(C)C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 520850943 MZILGMGQJGDVJK-NHCUHLMSSA-N 318.464 5.434 30 20 DKED N#CCCC[C@@H](N[C@@H]1CCc2ccc(Cl)cc21)c1ccccc1 551212330 ZJTDQMFEIINTNC-WOJBJXKFSA-N 324.855 5.352 30 20 DKED CC(C)(C#N)CCCCN1CC2(CC=CC2)[C@H]1c1ccccc1 592186038 ABGUCVOIRHBREA-LJQANCHMSA-N 308.469 5.100 30 20 DKED C=CCC[C@@H](NCc1ccoc1)c1ccc(C(F)(F)F)cc1 749834622 FBUODUYCXBGPOM-MRXNPFEDSA-N 309.331 5.096 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C\c1cnc(-c3cccs3)s1)C2 751513746 NOVOXXGRMDFKCR-LCYFTJDESA-N 323.442 5.002 30 20 DKED C[C@@H](OC(=O)CCCCCC#N)c1ccc(Cl)cc1Cl 805696097 VZQMNYGKLBNOBU-LLVKDONJSA-N 314.212 5.072 30 20 DKED C=CCCC(=O)Nc1ccc(Oc2ccccc2Cl)cc1 60364859 NRHJUFIDGCFPLB-UHFFFAOYSA-N 301.773 5.037 30 20 DKED N#CCCCOc1cccc(CNc2cccc3ccccc23)c1 157714301 DJPSCXLQUCMLJP-UHFFFAOYSA-N 316.404 5.134 30 20 DKED N#CCCC[C@@H](N[C@H]1CCCc2cc(F)ccc21)c1ccccc1 340450327 XEHRPJUUCADNJX-RTWAWAEBSA-N 322.427 5.228 30 20 DKED C=CCC[C@@H](NCc1cnc2ccccc2c1)c1ccccc1 499609985 JAGQAVAZUUGZCF-HXUWFJFHSA-N 302.421 5.032 30 20 DKED Cc1cc(C)c(CNc2ccccc2SC[C@@H](C)C#N)c(C)c1 520826379 QMOGDWBCGRQRML-HNNXBMFYSA-N 324.493 5.476 30 20 DKED C=C[C@@H](CC(=O)N1CCCC[C@@H]1c1ccccc1)c1ccccc1 545969100 DPKWMKQBXJBXCN-GHTZIAJQSA-N 319.448 5.100 30 20 DKED CCC(CC)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccs1 561453977 AXCIWVBCIPTVEK-IFXJQAMLSA-N 312.482 5.448 30 20 DKED CCCCCCC[C@H](NCc1nnc(C)s1)c1ccccc1 780744108 KGCVZFXPFVPHST-KRWDZBQOSA-N 317.502 5.038 30 20 DKED CC#CC(=O)Nc1ccc(Cl)cc1-c1cccc2ccccc12 801282321 ZCZOROIZBTURHS-UHFFFAOYSA-N 319.791 5.122 30 20 DKED Cc1ccc(-c2ccccc2NCc2ccccc2C#N)s1 864032328 BZQMDCQADBPBGS-UHFFFAOYSA-N 304.418 5.207 30 20 DKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(-c2ccccc2)cc1 11038226 XEAJRBSVODMKGO-QGZVFWFLSA-N 312.416 5.076 30 20 DKED N#CCCC[C@H](N[C@H]1CCCc2cc(F)ccc21)c1ccccc1 340450328 XEHRPJUUCADNJX-SFTDATJTSA-N 322.427 5.228 30 20 DKED N#CCCC[C@H](N[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 340453002 QDUGJGPGSUQIMU-IKGGRYGDSA-N 324.390 5.132 30 20 DKED N#CCCC[C@@H](NCCSC1CCCCC1)c1ccccc1 433021174 WBVYIDKXASYRGB-LJQANCHMSA-N 316.514 5.077 30 20 DKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)CCCC(C)(C)C#N 472437007 BBAGRUMSQGZJAK-ZDUSSCGKSA-N 312.379 5.028 30 20 DKED C=C(C)[C@H](N[C@H](C)c1ccc(F)cc1)c1ccc(F)c(F)c1 480658610 LALWNSISXZUARL-XIKOKIGWSA-N 305.343 5.072 30 20 DKED C[C@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)cc1F 512655055 REYSRZBGIPKWHX-LIRRHRJNSA-N 310.416 5.135 30 20 DKED CCC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 610830014 XOUZYUJVPGPNAX-AUUYWEPGSA-N 312.844 5.404 30 20 DKED CC1(C#N)CCC(Nc2cccc(C3SCCS3)c2)CC1 823529593 VUKWRPKUHVCZMJ-UHFFFAOYSA-N 318.511 5.050 30 20 DKED Cc1ccc2c(c1)C/C(=C/c1csc(-c3ccsc3)n1)C2=O 921270414 UZYDGDCTHWECBM-ZSOIEALJSA-N 323.442 5.002 30 20 DKED CCCCCCCCCC[C@@H](C)Nc1cc(C(=O)O)ccn1 1776785270 MVBJGTDPMNXJSB-OAHLLOKOSA-N 306.450 5.111 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC)c1 340458049 XNZLTLHXGLDMFV-RTWAWAEBSA-N 322.452 5.171 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)CC2 427870200 ZBLFFRLSIGNGSO-BTYIYWSLSA-N 304.437 5.020 30 20 DKED C=CCC1(C(=O)Nc2ccc(-c3ncc(C(C)C)o3)cc2)CCC1 479097589 COFCKIZZSOQUJP-UHFFFAOYSA-N 324.424 5.150 30 20 DKED CCC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 610830017 XOUZYUJVPGPNAX-LIRRHRJNSA-N 312.844 5.404 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(SC(C)(C)C)cc1 736970240 UXANDCFMZKSEBD-UHFFFAOYSA-N 306.475 5.007 30 20 DKED CCCCCCC[C@H](NCc1cscn1)c1ccccc1 765511345 WYAOYDIEDZJSCX-SFHVURJKSA-N 302.487 5.335 30 20 DKED CC[C@@H](C)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 795206043 VLPQEDCEQDKYSN-UZLBHIALSA-N 320.436 5.107 30 20 DKED C=CC[C@@H](OC(=O)CCC(F)F)c1ccc(Cl)c(Cl)c1 797554532 VDIRWGULYMBQSM-GFCCVEGCSA-N 323.166 5.199 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ncco1)c1ccc(C(F)(F)F)cc1 925598201 QOZYKFVZQLOJLX-WFASDCNBSA-N 324.346 5.052 30 20 DKED C=CCCc1ccccc1NC(=O)c1cc(C)c(F)cc1Cl 410370739 YJKRHCQATUUQGS-UHFFFAOYSA-N 317.791 5.158 30 20 DKED C=CCC[C@@H](NCc1ccccc1N1CCCCC1)c1ccco1 552285049 AOPQUVGLKXLJFP-LJQANCHMSA-N 324.468 5.067 30 20 DKED Cc1c(C(=O)/C=C/c2cncc3ccccc23)oc2ccccc12 772795532 ATMGVJAUALLJIQ-ZHACJKMWSA-N 313.356 5.186 30 20 DKED FC(F)(F)[C@@H]1CCC[C@H](C=NNc2cccc3ncccc23)C1 853290305 VTYRRZSTSLZKIL-QWHCGFSZSA-N 321.346 5.001 30 20 DKED CCc1ccc(C=NOCc2cc(Cl)cc3cccnc23)cc1 914786285 CEDQROKQMCXCNB-UHFFFAOYSA-N 324.811 5.001 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CCCC 191424049 YFWQWEBRZUIZIR-UHFFFAOYSA-N 302.462 5.192 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(F)c1F 340441989 DTRSYSARJZWBJY-KBXCAEBGSA-N 314.379 5.051 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H](C)c1cc2ccccc2o1 410370293 SDDGLCLHUZMLKP-OAHLLOKOSA-N 319.404 5.294 30 20 DKED C[C@H](c1ccc(Cl)cc1)[S@](=O)CCC1(C#N)CCCCC1 414238805 KLZJDDBXRHLJCG-SPLOXXLWSA-N 323.889 5.014 30 20 DKED CC(C)(C)[C@@H](NCc1ccc(C#N)cc1Cl)c1ccccc1 439444431 UTYQDSDBMROZGA-SFHVURJKSA-N 312.844 5.089 30 20 DKED CC[C@H](N[C@H](CC)c1cccc(Cl)c1)c1ccc(C#N)cc1 447542051 HZAXFSMKABBRBN-RBUKOAKNSA-N 312.844 5.404 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(F)(F)F 476141195 HPRNLBCCXUPMBG-UHFFFAOYSA-N 313.363 5.210 30 20 DKED CC(C)(C#N)CCCSCc1ccccc1Br 476469841 GIJQWECGVAIINK-UHFFFAOYSA-N 312.276 5.012 30 20 DKED CCSc1ccc([C@@H](C)N[C@@H](CC)c2ccc(C#N)cc2)cc1 569432998 ZLIYYZKYDKRNCR-QRWLVFNGSA-N 324.493 5.472 30 20 DKED CCCCCCCCCCCN(C)[C@H]1CC[C@H](CC(=O)O)C1 1776784559 FTHGKOCIUUYPQZ-ROUUACIJSA-N 311.510 5.092 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C)c1ccc(C#N)cc1 540525316 SWGGRRHXRADVFD-WZBLMQSHSA-N 324.855 5.260 30 20 DKED CCC(=NNc1nccc2sccc12)c1ccc(Cl)s1 733203339 DVSYKGYWUOPLES-UHFFFAOYSA-N 321.858 5.237 30 20 DKED CCCc1ccc(C(=O)/C=C\c2nccc3ccccc23)cc1 740764657 BGRYATYHXVDCQZ-SEYXRHQNSA-N 301.389 5.083 30 20 DKED CC1(C)CCC[C@@H](CC(=O)[C@@H](C#N)c2nccc3ccccc23)C1 792103661 LOCSFPCPUZLFQJ-MAUKXSAKSA-N 320.436 5.018 30 20 DKED C[C@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccc(C#N)cc1 231666673 BIUSDIFQXGUKQQ-RYUDHWBXSA-N 319.235 5.277 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C[C@@H]1CCC[C@H](C)C1 330173549 HMBCGUIUPDELAQ-DZGCQCFKSA-N 311.429 5.190 30 20 DKED Cc1nc(C(O)=Nc2ccc(C(C)C)cc2C(C)C)c(C)o1 331201477 QEWUSRCPTYPAPU-UHFFFAOYSA-N 300.402 5.175 30 20 DKED C=C(C)[C@H](NCc1ccc(C(F)F)cc1)c1ccc(F)c(F)c1 474925655 FPLMHQXMQBLJKC-KRWDZBQOSA-N 323.333 5.309 30 20 DKED C[C@@H](Nc1ccc(F)cc1OCC#N)c1ccc2ccccc2c1 760217658 XXOGMOUVLJLLCM-CQSZACIVSA-N 320.367 5.054 30 20 DKED CC/C(C)=C(/C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 779836734 FVOOZBFBNIORKG-IBIZNAIESA-N 318.420 5.027 30 20 DKED CC(C)(C#N)CCCOc1ccc(SC(F)(F)F)cc1 795247481 HQKMIPJQHRQWIT-UHFFFAOYSA-N 303.349 5.007 30 20 DKED Cc1noc(C)c1/C=C\C(=O)c1ccc(C2CCCCC2)cc1 916137092 ISMXBIMIVJBEAX-SEYXRHQNSA-N 309.409 5.235 30 20 DKED C=C(C)c1cccc(NC(=O)N(CC)[C@@H](CC)c2ccncc2)c1 934875536 GLXLTXGHCSRIHZ-IBGZPJMESA-N 323.440 5.120 30 20 DKED CC[C@@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 303232715 WCDKXWNBWPGZAZ-INIZCTEOSA-N 320.436 5.010 30 20 DKED CC1(C)Cc2occc2[C@@H](Nc2cccc(OCCCC#N)c2)C1 498755463 YQAIBPPPLCKWLH-SFHVURJKSA-N 324.424 5.088 30 20 DKED CC(C)C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccs1 561139573 DXFPTKPCURMCDJ-MOPGFXCFSA-N 324.493 5.374 30 20 DKED Cc1cc(N2CCCCCC2)ccc1NCC(C)(C)CCC#N 570365898 UZVWTHLQGZXMAC-UHFFFAOYSA-N 313.489 5.117 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cc2cnccc2o1)c1ccccc1 657930275 MIKXLGBIHAFPFT-YJBOKZPZSA-N 306.409 5.186 30 20 DKED Cc1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)cc1 751510343 QUYOVQLRYFHIEX-CMDGGOBGSA-N 311.431 5.076 30 20 DKED CSc1ccc(C(=O)/C=C/c2ccc(Cl)nc2)c(Cl)c1 765613525 NBOGCEOHXVYVMM-QHHAFSJGSA-N 324.232 5.006 30 20 DKED C=CC[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccncc1 766022858 YDBSZLIZXSXINC-SJCJKPOMSA-N 321.251 5.356 30 20 DKED C[C@H](SCCC(C)(C)C#N)[C@@H](C)SCCC(C)(C)C#N 790283099 PFIZVDMLYIEMKJ-OKILXGFUSA-N 312.548 5.110 30 20 DKED Cc1ccc(-c2ccccc2NCc2ccc(F)c(C#N)c2)s1 864032404 DUNNIHRBWLKWTJ-UHFFFAOYSA-N 322.408 5.346 30 20 DKED C=CCN(C(=S)Nc1ccc2ccccc2c1)c1ccccc1 915995175 INDPSLZWZXLGND-UHFFFAOYSA-N 318.445 5.229 30 20 DKED Cc1noc(C)c1/C=C/C(=O)c1ccc(C2CCCCC2)cc1 916137091 ISMXBIMIVJBEAX-OUKQBFOZSA-N 309.409 5.235 30 20 DKED CC[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 303232716 WCDKXWNBWPGZAZ-MRXNPFEDSA-N 320.436 5.010 30 20 DKED CC[C@H](N[C@@H](CC)c1ccc(Cl)s1)c1ccc(C#N)cc1 447526012 BSRSNJWATAMUPI-GJZGRUSLSA-N 318.873 5.465 30 20 DKED C=CCC[C@H](N[C@@H](C)c1ccc(F)c(OC)c1)c1ccccc1 536833622 PYOGDANMIQZJEW-KXBFYZLASA-N 313.416 5.192 30 20 DKED CC(C)(C)[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1 563330080 JQACLYQMAXVVNU-VQTJNVASSA-N 322.427 5.062 30 20 DKED C=CC1CCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 601079028 MFANVHVBPPUUGS-UHFFFAOYSA-N 320.392 5.016 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)sc1C 682803579 CVESBDPSBXLHSF-UHFFFAOYSA-N 313.466 5.469 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(O)cc1 744334436 MUNZXECTGRFDPQ-LJQANCHMSA-N 317.473 5.196 30 20 DKED C[C@H](Sc1snc(Cl)c1C#N)c1ccc(Cl)cc1 301935647 TZIWWUZQVRFVHO-ZETCQYMHSA-N 315.250 5.175 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1 537016006 STAFQFYHBYJNQV-QGZVFWFLSA-N 312.416 5.076 30 20 DKED CC(=NNc1cccc2ccccc12)c1nc2ccccc2s1 747060554 XBGCIJHXQCTEAI-UHFFFAOYSA-N 317.417 5.286 30 20 DKED O=C(/C=C/c1ccsc1)c1ccc(N2CCCCCC2)cc1 916132968 WEARJUAJCMEVQN-BJMVGYQFSA-N 311.450 5.025 30 20 DKED C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCC(C)(C)C#N 287691674 XCOZBQGZGUOMFB-NYHFZMIOSA-N 319.514 5.124 30 20 DKED C=CCC(C)(C)C(=O)N1CC=C(c2cccc3ccccc23)CC1 433244517 YORARDDQEQYWBY-UHFFFAOYSA-N 319.448 5.058 30 20 DKED CCCc1cccc(CN[C@H](CCCC#N)c2ccccc2)c1 552313209 UTJGHWSCSSYERK-OAQYLSRUSA-N 306.453 5.164 30 20 DKED C=CC[C@@H](NCc1ccc(C2CCCC2)cc1)c1ccncc1 812756042 HVNNRGCSUTWLLD-OAQYLSRUSA-N 306.453 5.146 30 20 DKED C[C@H](Nc1cccc(C(F)F)c1Cl)c1ccc(C#N)cc1 541741794 VGPKTRLLMVGWEJ-JTQLQIEISA-N 306.743 5.322 30 20 DKED CC(=NNc1c(F)cccc1F)c1cc(Cl)sc1Cl 735614850 CZXUQZVFRCMVMI-UHFFFAOYSA-N 321.179 5.169 30 20 DKED Cc1c(C(=O)/C=C\c2cccc3cnccc23)oc2ccccc12 782887235 JTPOJLCEAOBBFS-KTKRTIGZSA-N 313.356 5.186 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccs1 189878246 VMMHGDVCFBFIRE-AWEZNQCLSA-N 313.466 5.342 30 20 DKED Cc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)s1 303151619 MUUCQCJMWHXLRZ-CMDGGOBGSA-N 311.431 5.076 30 20 DKED Cc1c([C@@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)oc2ccccc12 477850774 CTFCLZDZQBVMGG-UONOGXRCSA-N 322.383 5.164 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@@H]2CCc3cc(C#N)ccc32)c2ccccc21 618801979 CZEZDFQXZNQKBZ-BDTNDASRSA-N 316.448 5.020 30 20 DKED C=CCC[C@H](Nc1ccc2c(cnn2C(F)F)c1)c1ccco1 671759384 BYSYZTXFGHMHLB-AWEZNQCLSA-N 317.339 5.144 30 20 DKED CC(=NNc1ccc(F)cc1F)c1cc(Cl)sc1Cl 744539597 RCNWYPAAIFWKJZ-UHFFFAOYSA-N 321.179 5.169 30 20 DKED C=CC[C@H](N[C@H](C)c1cc(Cl)ccc1Cl)c1ccncc1 766022857 YDBSZLIZXSXINC-PXAZEXFGSA-N 321.251 5.356 30 20 DKED CCCCC[C@@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)C(C)C 792089859 AQOXQYTTWUAPHM-MJGOQNOKSA-N 322.452 5.264 30 20 DKED C=CCC[C@H](Nc1ccc(OCC(F)F)cc1)c1ccco1 796886911 DTZVFBMQKBUOPY-HNNXBMFYSA-N 307.340 5.043 30 20 DKED CC(/C=C/C(=O)c1cscn1)=C\c1cccc(C(F)(F)F)c1 806573970 XVGGYFPFYVYDLJ-LCAICKDSSA-N 323.339 5.004 30 20 DKED C=CCCC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 78466562 GJOXPACXLGCVPG-MRXNPFEDSA-N 309.409 5.040 30 20 DKED Cc1cccc2c1[C@@H](C)C[C@H]2N[C@@H](CCC#N)c1ccccc1 90665684 WYYDKHJKBASRAL-FFZOFVMBSA-N 304.437 5.178 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1C 421502692 HKGMHUDWIOKEEY-UHFFFAOYSA-N 311.400 5.238 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@H]1CCC[C@@H](C#N)C1 463299340 DUYSNCGMSGVOFN-WBVHZDCISA-N 302.487 5.131 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(C)C)C1 475557576 CTUIMHJNUYEJKE-KRWDZBQOSA-N 314.473 5.048 30 20 DKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)CCCC(C)(C)C#N 475729068 MKMCXHNROJCKMK-GJZGRUSLSA-N 306.881 5.094 30 20 DKED N#CCC[C@H](NC1CC(c2cccc(Cl)c2)C1)c1ccccc1 541216723 YQZFDPFUWGINSX-UUKMXZOPSA-N 324.855 5.221 30 20 DKED C=CC[C@H](N[C@H](CC)c1cccc(Cl)c1)c1ccncc1 746048271 ZVZWYMVIAUZQQA-MSOLQXFVSA-N 300.833 5.093 30 20 DKED N#Cc1ccc(/C=C2\CCc3c(sc4ccccc34)C2=O)s1 763102702 ZWQRPBKGESCKOH-PKNBQFBNSA-N 321.426 5.047 30 20 DKED CSc1ccc(C(=O)/C=C\c2ccc(C(F)F)cc2)cc1 794937149 GBSLUVTWRXZUSX-WCIBSUBMSA-N 304.361 5.242 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)s1 90665108 ZVWOKEVNTSUNQJ-HUUCEWRRSA-N 318.873 5.487 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCC)c1 189870278 VCTXQUCUJFLATG-UHFFFAOYSA-N 323.436 5.190 30 20 DKED CC(C)[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315860947 MKJRHCKLCGTDHY-KUHUBIRLSA-N 312.844 5.260 30 20 DKED C=CCN(CCCCC(C)(C)C#N)Cc1ccc(Cl)s1 444598369 ONJYXLCNEDXWOI-UHFFFAOYSA-N 310.894 5.110 30 20 DKED N#CCCCCN[C@H](CCCc1ccccc1)c1ccc(F)cc1 495049524 SUYJSSMONDIBIC-OAQYLSRUSA-N 324.443 5.173 30 20 DKED N#CCCC[C@H](NCc1ccc2c(c1)CCCC2)c1ccccc1 552083455 GEIMEOWCZMVIGP-QFIPXVFZSA-N 318.464 5.090 30 20 DKED N#Cc1ccc(CSCc2cccc(C(F)(F)F)c2)cc1 58685589 KYOZFHAJZUXGQJ-UHFFFAOYSA-N 307.340 5.010 30 20 DKED CC(C)(C#N)CCCCN(Cc1ccc(Cl)cc1)C1CC1 444598137 PRYOQBLJIVEYPD-UHFFFAOYSA-N 304.865 5.024 30 20 DKED C=CCC(CC=C)C(=O)N1CCCCC[C@H]1c1ccc(CC)o1 467535754 BFTOMCDRZGJUBH-SFHVURJKSA-N 315.457 5.054 30 20 DKED CC(C)(C#N)c1ccccc1CNC1(c2ccccc2)CCCC1 538188867 RMEZSTSQZLYRGH-UHFFFAOYSA-N 318.464 5.047 30 20 DKED CCCc1ccc(-c2ccc(NC[C@@H](C#N)CCC#N)cc2)cc1 566997347 LYPINRBHTILMSZ-GOSISDBHSA-N 317.436 5.162 30 20 DKED CC(C)CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccoc1 586794285 MLKRYBQUEMEDGV-GOSISDBHSA-N 316.832 5.072 30 20 DKED CC(C)C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccs1 594927978 RRJQBTXZOVSRSZ-SFHVURJKSA-N 324.493 5.180 30 20 DKED C=CCC[C@@H](Nc1ccc(OC(F)F)c(OC)c1)c1ccco1 850560666 GZUSTOSKIYSJOG-CYBMUJFWSA-N 323.339 5.009 30 20 DKED O=C1/C(=C/c2csc(-c3cccs3)n2)CCc2ccccc21 78481746 WSBZMVRAYYPMAP-JLHYYAGUSA-N 323.442 5.084 30 20 DKED CC(C)(C#N)CCCCN[C@@H](c1ccccc1)c1ccc(F)cc1 444668607 VXAVBZFFKAJGAZ-FQEVSTJZSA-N 324.443 5.225 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc2c(c1)COC2)c1ccccc1 539046384 DUHZYCUGEFSYKT-IIBYNOLFSA-N 307.437 5.075 30 20 DKED Cc1ccc(C)c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 581622060 RRGJIBNLWVUBBT-NQIIRXRSSA-N 306.453 5.389 30 20 DKED COc1ccc2oc(C(=O)/C=C\c3sccc3C)c(C)c2c1 729150819 MWWZJKXUUFINIP-ALCCZGGFSA-N 312.390 5.016 30 20 DKED C=CC[C@H](N[C@H]1CCCc2ccc(C(C)C)cc21)c1ccncc1 761451893 PIHBDLAREIJXBV-VXKWHMMOSA-N 320.480 5.489 30 20 DKED Cc1ccc(-c2ccccc2NC(=O)CCCCCC#N)s1 869834450 WCWNMROBKMADJZ-UHFFFAOYSA-N 312.438 5.136 30 20 DKED CSc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 920945831 GSFSRYHKSHJCPM-UHFFFAOYSA-N 312.221 5.172 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1cccc(C(=O)O)c1C 1776089832 IRLHBINGFBPZDB-HNNXBMFYSA-N 318.461 5.478 30 20 DKED N#CCc1ccc(NCc2ccc(-c3ccccc3Cl)o2)cc1 237661145 LFCBHMNNFAKXSP-UHFFFAOYSA-N 322.795 5.278 30 20 DKED N#C[C@H]1CCC[C@H](Nc2cccc(COC3CCCCC3)c2)C1 463287678 KIKSMALOUIONIE-WMZOPIPTSA-N 312.457 5.030 30 20 DKED C[C@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)cc1F 512280242 OGGNMBTUNHANCK-YCRPNKLZSA-N 322.427 5.279 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc2ccccc12 539604166 IHNCVYLCXOSKFA-CABCVRRESA-N 318.395 5.262 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@H](C)c1cccc(C#N)c1 611473265 UCOPDSXFECCNJJ-CYBMUJFWSA-N 314.816 5.172 30 20 DKED CC(C)n1nccc1/C=C\C(=O)c1ccc(-c2cccs2)cc1 794937553 KFIXLHKYUDWTND-KTKRTIGZSA-N 322.433 5.089 30 20 DKED N#Cc1ccc(-c2csc(-c3cc4ccccc4o3)n2)cc1 316885374 QLIFMEOYQRPAGB-UHFFFAOYSA-N 302.358 5.095 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 324925876 VWZTWICBODEAGR-QGZVFWFLSA-N 312.416 5.076 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1 340446436 ONZZMKXUQMAILA-WOJBJXKFSA-N 310.416 5.302 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1cc2ccccc2o1 486431247 CPOOSCBBADLKGT-AWEZNQCLSA-N 322.433 5.297 30 20 DKED C=CCC[C@@H](NCc1nccc2ccccc12)c1ccccc1 772856774 QMAGCEALNISQAZ-HXUWFJFHSA-N 302.421 5.032 30 20 DKED CCCCCCCCC[C@H](C)CC(=O)N1CCC(C)(C#N)CC1 787510411 LOBBRJGTORKNHY-SFHVURJKSA-N 320.521 5.306 30 20 DKED C[C@H](OC(=O)CCCCC#N)c1ccccc1-c1ccccc1 847636864 UWTHGNBXBGJLPS-INIZCTEOSA-N 307.393 5.042 30 20 DKED Cc1cc(C)c(C(=O)/C=C/c2ccc3ncccc3c2)cc1C 916155905 LUKHFSLMJXKPRM-VQHVLOKHSA-N 301.389 5.056 30 20 DKED C[C@@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 340444767 JKFPBDIJIGWWKB-TYCQWZJGSA-N 304.437 5.260 30 20 DKED CC(C)O[C@H](CSCCCC(C)(C)C#N)c1ccccc1 427701864 ODANQHQCNFPQBP-QGZVFWFLSA-N 305.487 5.216 30 20 DKED C=CCC[C@H](NCc1cc(F)c(Cl)cc1F)c1ccco1 560536256 NLRCHIORWQMPNQ-HNNXBMFYSA-N 311.759 5.008 30 20 DKED CC(C)[C@H]1C[C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc21 618569976 LWRDLQUOPOLRAP-RVHYNSKXSA-N 304.437 5.093 30 20 DKED O=C(/C=C\c1cccnc1Cl)c1cc2cc(Cl)ccc2o1 728700034 KYWBTMVWYOGFBV-HYXAFXHYSA-N 318.159 5.031 30 20 DKED CC(C)(C#N)c1ccccc1CNc1cccc2ccccc12 486463017 RZMWEXVECMJVCK-UHFFFAOYSA-N 300.405 5.253 30 20 DKED Cc1ccsc1/C=C\C(=O)c1cc(Cl)sc1Cl 744869341 XAIUHBYAXZVFLP-IHWYPQMZSA-N 303.235 5.321 30 20 DKED Cc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)s1 745990513 RMYPZUPZKXJTPC-CMDGGOBGSA-N 305.402 5.015 30 20 DKED C=CC[C@H](N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccncc1 779406374 WKVMBHLMUSGCOQ-SFTDATJTSA-N 322.427 5.064 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nccc2ccccc12 792093580 XTRAUXDJXOCFQK-CRAIPNDOSA-N 308.425 5.018 30 20 DKED Cc1ccc([C@H](C)Nc2ccc(C#N)cc2C(F)(F)F)s1 36973692 LMVBGDIMEOOOBK-JTQLQIEISA-N 310.344 5.120 30 20 DKED CC(C)(CCC#N)CN[C@H](CC1CC1)c1ccc(Cl)cc1 348215481 NGEQFEJRTSTKSX-QGZVFWFLSA-N 304.865 5.101 30 20 DKED Cc1ccc([C@H](NCCCC(C)(C)C#N)c2ccccc2)cc1 471697784 QVNFZHPBAKITPT-HXUWFJFHSA-N 306.453 5.004 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccc(CC)o1)c1ccc(F)c(F)c1 480691477 BVKLICGZAMZAIZ-SGTLLEGYSA-N 305.368 5.088 30 20 DKED CC(C)(C)c1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 565437495 IEHZIZNPMNXDAH-OAQYLSRUSA-N 320.480 5.509 30 20 DKED CC(C)c1ccc(C=NOCc2cc(-c3ccccc3)on2)cc1 727484171 YTOGCLXDSURMCX-UHFFFAOYSA-N 320.392 5.016 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 744016361 LPGQSZJHJYDSRF-ZIAGYGMSSA-N 314.454 5.079 30 20 DKED COc1cc(C(=O)/C=C\c2cc3ccccc3o2)ccc1SC 750907817 BMHHIGYKTOPEHS-HJWRWDBZSA-N 324.401 5.059 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(CC(C)C)cc1)c1ccncc1 766021626 QRYHQDDXZCNACI-UWJYYQICSA-N 308.469 5.248 30 20 DKED O=C(/C=C/c1ccc(Cl)cc1Cl)c1ccc(F)cc1F 916127568 KGEKXJMDBJXFPO-QHHAFSJGSA-N 313.130 5.168 30 20 DKED C[C@@H](S[C@H](C)c1ncc(C(C)(C)C)o1)c1ccc(C#N)cc1 85228671 ARVLLHACOQACMB-CHWSQXEVSA-N 314.454 5.399 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH]ccc2c1 189877882 JZHOZSMOVRAVPZ-UHFFFAOYSA-N 318.420 5.272 30 20 DKED C[C@@H](SCc1cc(-c2ccccc2)on1)c1cccc(C#N)c1 443145006 MDTNIMFMNCRAFN-CQSZACIVSA-N 320.417 5.208 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(CCC)c1 464472719 QNKXYHQQLVTIEY-UHFFFAOYSA-N 322.452 5.138 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cccc(F)c1)c1ccc(F)c(F)c1 480662864 KOGMBZMZVZMONL-XIKOKIGWSA-N 305.343 5.072 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 480669783 WCKXPSWRNHCTRV-VOJFVSQTSA-N 323.333 5.211 30 20 DKED COc1ccccc1[C@@H](CC(C)C)N[C@H](C)c1ccc(C#N)cc1 538392999 GDISCAGFAGLZJZ-OXQOHEQNSA-N 322.452 5.005 30 20 DKED C[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1csc(Cl)c1 594517241 JCNDEPWQMPOFFC-GFCCVEGCSA-N 316.857 5.003 30 20 DKED C[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)C1CCCCC1 726317715 CTAWIOLLILJREJ-CRAIPNDOSA-N 320.436 5.018 30 20 DKED C=CCN(C(=O)Nc1ccc(Oc2ccccc2)cc1C)C(C)C 731541433 ARMHVXBDGJZKIK-UHFFFAOYSA-N 324.424 5.216 30 20 DKED CC(C)(C)[C@H](NCc1ccc(C#N)cc1)c1cc2ccccc2o1 779392977 PKTGDWLREWPPIE-HXUWFJFHSA-N 318.420 5.181 30 20 DKED CCCC[C@@H](CC)CC(CC)=NNc1ccc(C(=O)O)cc1 1776014298 PLEJZKKOGGYHOV-CQSZACIVSA-N 304.434 5.169 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccsc1 91412081 LKDSDEHDMQKEOL-HNNXBMFYSA-N 318.445 5.138 30 20 DKED C=CCCCCCN(C)C(=O)Nc1c(C)cccc1C(C)C 157646748 ASQSWMGXACRVPF-UHFFFAOYSA-N 302.462 5.329 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 447573704 IRZMBFJRLLFABG-BDTNDASRSA-N 318.464 5.506 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 480669933 OINUTAAVWDMJJG-ADLMAVQZSA-N 323.333 5.211 30 20 DKED C=CCN(Cc1csc(C2CCCC2)n1)Cc1cccs1 520172889 NUPBZZOWCMBPCW-UHFFFAOYSA-N 318.511 5.050 30 20 DKED CC[C@H](N[C@@H](C)c1ccccc1OC(C)C)c1ccc(C#N)cc1 583544867 IVSSQWAUYCLOHS-JXFKEZNVSA-N 322.452 5.147 30 20 DKED O=C(/C=C\c1cccnc1Cl)c1ccc(-c2ccccc2)cc1 726363294 OZBFPFSXZAMODI-SEYXRHQNSA-N 319.791 5.298 30 20 DKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2scnc2C)c1 729644234 SZFJITUQSMINKD-ZHACJKMWSA-N 319.429 5.323 30 20 DKED CC(C)CCCCCC(=O)Nc1ccccc1SCCC#N 747878780 KFJJLHNTAMRABS-UHFFFAOYSA-N 318.486 5.237 30 20 DKED O=C1/C(=C\c2cccc(-c3cccnc3)c2)CCc2sccc21 768490803 SEQUNWMRSSLOMX-VBKFSLOCSA-N 317.413 5.023 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1ccc(-c2ccccc2)o1 782341215 IGNGGGYAXZEUIX-FLIBITNWSA-N 321.401 5.177 30 20 DKED C[C@H](Sc1nc(Cl)c(C#N)s1)c1ccc(Cl)cc1 804389153 NGJZPLKMIPYEER-ZETCQYMHSA-N 315.250 5.175 30 20 DKED C[C@@H](NCc1ccc(C#N)cc1)c1ccccc1SC(C)(C)C 815560542 KBICCPCUXJNKDX-OAHLLOKOSA-N 324.493 5.300 30 20 DKED CCCCCCC[C@H](N[C@@H]1CCn2ccnc21)c1ccccc1 834835950 JYYOUKFMTCJHGO-RBUKOAKNSA-N 311.473 5.019 30 20 DKED CC(C)(C)Nc1ccccc1NCc1ccc(C#N)cc1Cl 844607012 MGPZLHCWCKXZCH-UHFFFAOYSA-N 313.832 5.034 30 20 DKED CCCCCCCC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 919754635 YPXZWGXSLZHMKT-UHFFFAOYSA-N 314.429 5.257 30 20 DKED Cc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)s1 303061447 XQJGFEWRSVYHNP-ONEGZZNKSA-N 317.460 5.138 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 340456197 VVTFPEZXVVODHT-IFXJQAMLSA-N 314.379 5.051 30 20 DKED Cc1ccccc1C1CC(N[C@H](CCCC#N)c2ccccc2)C1 340458586 YJCCDYZSUOQDJW-QETWGEEDSA-N 318.464 5.266 30 20 DKED C=CCCCCCSCC(=O)Nc1c(C)cccc1Cl 485595683 AICCLDFPJPTBKL-UHFFFAOYSA-N 311.878 5.067 30 20 DKED N#CCCCCN[C@H]1CCCCC[C@H]1c1ccc(Cl)cc1 581419989 LNMZLTQZJDAUCS-ROUUACIJSA-N 304.865 5.040 30 20 DKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(C)cc1 195656634 MWGXEPHFAZMHHB-FQEVSTJZSA-N 308.425 5.241 30 20 DKED N#CCC[C@@H](NC1CC(c2cccc(Cl)c2)C1)c1ccccc1 541216707 YQZFDPFUWGINSX-LYBXBRPPSA-N 324.855 5.221 30 20 DKED CC[C@H](Cc1ccccc1)N[C@@H](CCCC#N)c1ccccc1 574059313 LCPSEMDOGWJTAG-RTWAWAEBSA-N 306.453 5.032 30 20 DKED C=CCC[C@H](C(=O)Nc1cccc(F)c1Cl)c1ccccc1 584685399 YLIURRWWKVQBNJ-AWEZNQCLSA-N 317.791 5.168 30 20 DKED CCc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)s1 741474619 XRRYKFLMJAKMNB-CMDGGOBGSA-N 319.429 5.269 30 20 DKED CCCCCCCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccco1 743804343 XOFMFLLERRSLLV-DLBZAZTESA-N 305.462 5.330 30 20 DKED C=CC[C@@H](N[C@@H](CC)c1cccc(Cl)c1F)c1ccncc1 763537379 CTGAAOLNKOMYCM-DLBZAZTESA-N 318.823 5.232 30 20 DKED CC[C@H](C)Oc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 776869934 SLWAFNHNCJPJOW-KBPBESRZSA-N 312.388 5.048 30 20 DKED C=CC[C@H](N[C@H](C)c1cccc(CC(C)C)c1)c1ccncc1 796772257 PQSMCOTVDDIMLC-UTKZUKDTSA-N 308.469 5.248 30 20 DKED N#CCCCCCC(=O)Oc1c(Cl)cc(Cl)cc1Cl 807917403 YXJTZPOIVFNJRN-UHFFFAOYSA-N 320.603 5.026 30 20 DKED N#Cc1ccc(CNc2ccc(SC3CCCC3)cc2)s1 157457033 SJUMJENEAWJLNU-UHFFFAOYSA-N 314.479 5.267 30 20 DKED N#CCC[C@@H](Nc1ncc(-c2ccccc2)s1)c1ccccc1 301781396 JPYGSTFKHXMSEB-QGZVFWFLSA-N 319.433 5.267 30 20 DKED C=CCCC(=O)N(Cc1cccc2ccccc12)C1CCCC1 303220098 UQFSZHHCOFHZHF-UHFFFAOYSA-N 307.437 5.077 30 20 DKED CCC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1 321666323 SYQGRFFIPOXOMM-HXUWFJFHSA-N 308.425 5.322 30 20 DKED CC(C)(C)c1ccc(CNc2cccc(OCCCC#N)c2)cc1 324388768 PJOGSYQVSLZTAZ-UHFFFAOYSA-N 322.452 5.279 30 20 DKED Cc1ccccc1-c1ccc(CN(CCCC#N)C(C)C)s1 498560998 UUWUGYPTMMTAMQ-UHFFFAOYSA-N 312.482 5.238 30 20 DKED CCCC(CCC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 510514906 ONGFBYPMFWIQLU-AWEZNQCLSA-N 318.486 5.093 30 20 DKED C=C[C@H](CC(=O)Nc1c(CC)cccc1CC)c1ccccc1 533965729 RDMGFDSKNYGPJQ-GOSISDBHSA-N 307.437 5.110 30 20 DKED C=CCC(C)(C)CN[C@H](c1cccnc1)c1cc2ccccc2o1 550856023 QEQOGEOOHIBAGY-HXUWFJFHSA-N 320.436 5.109 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1cc2cc(Cl)ccc2o1 580591281 AZXXDJZBEFCFOH-GFCCVEGCSA-N 304.821 5.067 30 20 DKED Cc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1F 741471957 DDLGFDVXQPDQNK-FPLPWBNLSA-N 317.363 5.092 30 20 DKED C#CC[C@@H](N[C@@H](C)c1ccccc1SCC)c1ccccc1 773103972 CVUWCGSBPCSLQY-QFBILLFUSA-N 309.478 5.214 30 20 DKED CC(=NNc1ccc(C(C)C)cc1)c1c(C)nn(C(C)C)c1C 835018768 UEWJRDMOWHBUSA-UHFFFAOYSA-N 312.461 5.040 30 20 DKED CCCCCCCCCC[C@@H](C)Nc1ccc(C(=O)O)c(C)n1 1776785262 LZTXTCYQZOFTJF-OAHLLOKOSA-N 320.477 5.419 30 20 DKED C[C@@H](Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 37071370 USYWEXVIFSKPGW-LLVKDONJSA-N 305.208 5.233 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](C)c1ccc(Cl)cc1Cl 165173619 VQKKNACKGBQSFL-LBPRGKRZSA-N 319.235 5.024 30 20 DKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CC1)c1cccc(C#N)c1 181409814 UNDLYTDSDIFNQI-BFUOFWGJSA-N 310.828 5.014 30 20 DKED CCOc1ccccc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 340447187 PFJAWFUPHOQSBY-YLJYHZDGSA-N 322.452 5.171 30 20 DKED CCCC[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(OC)cc1 539496772 UMYKQUDNLQZWRS-KKSFZXQISA-N 322.452 5.149 30 20 DKED C=CCC[C@@H](NCc1ccccc1COC(C)C)c1ccco1 556865456 RUNCHOFVLURQSV-LJQANCHMSA-N 313.441 5.002 30 20 DKED C[C@@H](N[C@H](C#N)c1ccc(Cl)cc1)c1cc2ccccc2o1 585719289 MCODBDUCIFBYGX-MLGOLLRUSA-N 310.784 5.002 30 20 DKED Cc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1C(F)(F)F 600850414 APYQBHFKLCWIPQ-LBPRGKRZSA-N 304.315 5.059 30 20 DKED N#Cc1ccc(S[C@@H](C#N)c2ccc(Cl)cc2)c(Cl)c1 619864424 OMJGTNVIQWUMFP-HNNXBMFYSA-N 319.216 5.222 30 20 DKED CC(C)c1ccccc1CNc1ccccc1S[C@H](C)CC#N 864006419 UVXRGUWCFAHJJZ-MRXNPFEDSA-N 324.493 5.816 30 20 DKED CC(C)(C)CC(C)(C)/N=C(/O)c1ccc(Cl)c(N)c1Cl 330950684 KHYGSLIWMSDTPO-UHFFFAOYSA-N 317.260 5.095 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(C2CC2)c1 340308471 FHGRQGRDNQXTNL-IIBYNOLFSA-N 304.437 5.260 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cccc(F)c1F)c1ccc(F)c(F)c1 480680810 LOXVXOJBFRKJFL-ZMZPIMSZSA-N 323.333 5.211 30 20 DKED C=CCC[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccccc1 538260121 XPIQRRVVZKUKNX-MRXNPFEDSA-N 314.498 5.238 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](C)c1ccc(F)c2ccccc12 588975877 LLEVHDSXSXVJJL-HNNXBMFYSA-N 318.395 5.010 30 20 DKED COCc1cccc(/C=C/C(=O)c2cc(Cl)ccc2Cl)c1 742429769 YZMOSGCTNYYXAT-VMPITWQZSA-N 321.203 5.036 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C=C1CCC(C)CC1 789720039 UCGPYKOKCRXCAC-UHFFFAOYSA-N 311.469 5.614 30 20 DKED CC1(C)CCC[C@H](CC(=O)[C@H](C#N)c2nccc3ccccc23)C1 792103664 LOCSFPCPUZLFQJ-QAPCUYQASA-N 320.436 5.018 30 20 DKED O=C(/C=C\c1cccc(Cl)c1Cl)c1cc(F)ccc1F 916133516 VDRDUUSLKXKRRO-DAXSKMNVSA-N 313.130 5.168 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCCCSC 189894810 YFXIZEBOEAGCOW-UHFFFAOYSA-N 305.487 5.010 30 20 DKED N#CCCCCNCc1ccc(-c2ccc(Cl)c(Cl)c2)o1 237772300 PZXHEVIXWWGTGX-UHFFFAOYSA-N 323.223 5.037 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@H](CCCC#N)c1ccccc1)CCC2 340430931 AIKZQFRWVDZYON-YADHBBJMSA-N 318.464 5.397 30 20 DKED N#CCC[C@@H](C#N)COc1ccc(Cl)cc1C1CCCCC1 550177362 VMOITLYGDANMAR-AWEZNQCLSA-N 316.832 5.210 30 20 DKED CCC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 733680663 BAMRQTMUVLFYOH-JKSUJKDBSA-N 324.424 5.001 30 20 DKED C#CCCCCCC(=O)N1CCCCC[C@H]1c1cccc(C)c1 779950937 PHJBICRDJFBQRK-FQEVSTJZSA-N 311.469 5.022 30 20 DKED C[C@H](Nc1ccc(C2CCC2)cc1)c1ccc(OCC#N)cc1 786970189 OTSOXRAOGKZMLY-HNNXBMFYSA-N 306.409 5.030 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1cc(C)on1 915694854 DGDVYQOJYSGPML-SFHVURJKSA-N 320.477 5.177 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@@H]1c1cccn1C 916959276 ZOUCVWRIZHRUPJ-LJQANCHMSA-N 318.505 5.219 30 20 DKED COc1cccc(C=Nc2ccc3c(c2)oc2ccccc23)c1O 254404900 ZKVBJKFOYDQYPN-UHFFFAOYSA-N 317.344 5.051 30 20 DKED C[C@H](S[C@@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1 609825855 XQILJTBVZOAKDW-RYUDHWBXSA-N 303.377 5.392 30 20 DKED O=C(/C=C\c1ccc(-c2c(F)cccc2F)o1)c1ccsc1 734367657 KXESAOPGONSWBT-XQRVVYSFSA-N 316.328 5.182 30 20 DKED CSc1ccc(C(=O)/C=C\c2cccnc2Cl)c(Cl)c1 765613839 NPWYQLMYMQRDBO-DAXSKMNVSA-N 324.232 5.006 30 20 DKED FC(F)(F)C1CCC(C=NNc2cccc(Cl)c2)CC1 767358480 KPHKLTGNZUZSQV-UHFFFAOYSA-N 304.743 5.106 30 20 DKED C[C@@H](N[C@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 192755344 PGBIZNCUVLBFRX-HZPDHXFCSA-N 300.405 5.123 30 20 DKED N#CCCCOc1cccc(NCc2cccc3ccccc23)c1 237826827 LWYJPDCLUULRKL-UHFFFAOYSA-N 316.404 5.134 30 20 DKED CC(C)C[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1 462728411 UEOHVMXLLKPRFK-LJQANCHMSA-N 312.844 5.089 30 20 DKED C=C(C)[C@H](NCc1coc2ccccc12)c1ccc(F)c(F)c1 479410091 QQFFBSLNDOXVDS-IBGZPJMESA-N 313.347 5.118 30 20 DKED C=C(C)[C@H](N[C@@H](CC)c1cccs1)c1ccc(F)c(F)c1 480698732 MXWZGOLWGURQQT-RDJZCZTQSA-N 307.409 5.384 30 20 DKED N#Cc1ccc(CNc2cccc(-c3cccs3)c2)c(F)c1 506889684 OHMPXYUZUAUPIM-UHFFFAOYSA-N 308.381 5.038 30 20 DKED C=CCC[C@H](Nc1ccc(NC(C)=O)c(Cl)c1)c1ccco1 560545968 OTYWLFBBPUYEPI-INIZCTEOSA-N 318.804 5.011 30 20 DKED Cc1ccc(C(F)(F)F)c(N[C@@H](C)c2cccc(C#N)c2)c1 600857513 PCVGYEHYEMOVLD-LBPRGKRZSA-N 304.315 5.059 30 20 DKED CCCCC[C@H](C)CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1 742575300 DRCDQJNDJYXBTM-DLBZAZTESA-N 314.473 5.074 30 20 DKED O=C(/C=C/c1cccc(O)c1)c1ccc(-c2ccccc2)s1 747188013 DPHWVNVTXKPFAK-MDZDMXLPSA-N 306.386 5.017 30 20 DKED CCCCCCCCC(=O)Nc1n[nH]c(C)c1-c1ccccc1 748841665 PHKQKWXITZVETA-UHFFFAOYSA-N 313.445 5.074 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cccc(Cl)c1Cl)c1ccncc1 766017737 CSSYRAOUTICKQG-BLLLJJGKSA-N 321.251 5.356 30 20 DKED CC[C@@H](N[C@H](CC)c1cc(F)ccc1F)c1ccc(C#N)cc1 447588547 URPWUNGCFZYAGD-RTBURBONSA-N 314.379 5.028 30 20 DKED C=CCC1(C(=O)Nc2cccc(-c3ncco3)c2C)CCCCC1 452265361 PAQCYOWOZDRYHS-UHFFFAOYSA-N 324.424 5.115 30 20 DKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)C(C)C 505011420 VHBGMHBAERIMOX-UHFFFAOYSA-N 322.452 5.248 30 20 DKED CCCCCCCC(=O)Nc1ccc(F)cc1C(F)(F)F 728006896 VPBZQLXLUBHQAR-UHFFFAOYSA-N 305.315 5.144 30 20 DKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccncc3)cc2F)s1 751520459 AYFIQABWTQAOJM-WAYWQWQTSA-N 323.392 5.154 30 20 DKED CC[C@H]1C[C@H](C=NN(c2ccccc2)c2ccccc2)CCO1 779751042 AYDADCTVTGJHEY-XLIONFOSSA-N 308.425 5.016 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc(OC(F)F)cc1 794931744 POABCULSFGFFAD-XCVCLJGOSA-N 324.273 5.122 30 20 DKED CC1(C)C[C@@H](Nc2cccc(OCCCC#N)c2)c2ccccc21 539626472 QFPOEWSIVKJXGM-HXUWFJFHSA-N 320.436 5.204 30 20 DKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)CC(C)(C)CCC#N 539849624 HJSVATGNVYCQEH-GJZGRUSLSA-N 306.881 5.094 30 20 DKED C=CCC[C@H](N[C@H](C)c1nccc2ccccc12)c1ccccc1 558493887 YDKUOWZEUSFMHZ-UTKZUKDTSA-N 316.448 5.593 30 20 DKED Cc1cc(CN[C@@H](C)c2ccc(F)c3ccccc23)ccc1C#N 567306778 JYLHRYDGZUGBHW-HNNXBMFYSA-N 318.395 5.010 30 20 DKED CC(C)(C#N)CCCNC1(c2ccc(C(F)(F)F)cc2)CCC1 598644232 YIRRJYPVRQSFSR-UHFFFAOYSA-N 324.390 5.004 30 20 DKED CC(C)c1ccc([C@H](C)Nc2ccccc2O[C@@H](C)C#N)cc1 780743965 CCVVHWLIHXUZTN-HOTGVXAUSA-N 308.425 5.274 30 20 DKED Cc1cc(CNc2ccccc2SC[C@@H](C)C#N)c(C)s1 435893739 OMXYGYWPRMIMPX-LBPRGKRZSA-N 316.495 5.229 30 20 DKED CC#CCCCC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 464440712 LFQXVHXDYVUAPE-QGZVFWFLSA-N 319.448 5.085 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1SC 484971632 MSKYCJOKGCBCCM-UHFFFAOYSA-N 318.486 5.009 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc2ccccc2c1)c1ccncc1 749128820 MCHIULFMRKQWNC-IERDGZPVSA-N 302.421 5.203 30 20 DKED O=C(/C=C/c1c(Cl)oc2ccccc12)c1ccc2c(c1)COC2 761205529 OIDNENNIBWDCKC-BQYQJAHWSA-N 324.763 5.013 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccc(OC)cc1 884919744 OFOMNJIOKYDHJG-IBGZPJMESA-N 317.473 5.109 30 20 DKED CC(C)Oc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665035 YUHKEQQMBFXXLR-UTKZUKDTSA-N 322.452 5.169 30 20 DKED C=C(C)CN(CC)C(=O)Nc1c(C(C)C)cccc1C(C)C 104971488 FRNUKOYDNYWSIF-UHFFFAOYSA-N 302.462 5.363 30 20 DKED C=CCCCN(C)C(=O)Nc1cccc(CSC(C)C)c1C 173884318 FGFHEKPMABIXQM-UHFFFAOYSA-N 320.502 5.067 30 20 DKED Cc1noc(C)c1[C@H](C)C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 328676918 LTMCVDSDCMVVBA-VJUNAUMWSA-N 318.461 5.100 30 20 DKED Cc1ccccc1[C@H](N[C@@H](C)c1cccc(C#N)c1)C(C)(C)C 540592172 UEFZTYROKPPWQG-JXFKEZNVSA-N 306.453 5.305 30 20 DKED C=CC[C@@H](C(=O)Nc1cc(C)c(F)cc1Cl)c1ccccc1 561814220 YOTGXYLUZPHYOQ-CQSZACIVSA-N 317.791 5.086 30 20 DKED Cc1c([C@H](C)NCc2ccc(C#N)c(Cl)c2)oc2ccccc12 619755712 QAONRDLMVACZMW-ZDUSSCGKSA-N 324.811 5.117 30 20 DKED Cc1cc(C=NOc2ccccc2C(F)(F)F)ccc1Cl 779784795 SAMARTSOPQZOEH-UHFFFAOYSA-N 313.706 5.080 30 20 DKED C[C@@H](Sc1nc(-c2ccccc2)co1)c1cccc(C#N)c1 436240047 NENCQWQPLGOLEW-CYBMUJFWSA-N 306.390 5.067 30 20 DKED CC(C)Sc1ccc([C@@H](C)NCCCCC(C)(C)C#N)cc1 444678083 VRWBLXNSPORQSV-MRXNPFEDSA-N 318.530 5.558 30 20 DKED C=C1CCN([C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 477302970 OFVBOODPZARMKP-AWEZNQCLSA-N 316.832 5.016 30 20 DKED CC[C@H](C)[C@H](NCc1cc(C#N)cs1)c1ccc(Cl)cc1 530879313 UXCVJHRJNDDUQQ-SJCJKPOMSA-N 318.873 5.150 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 531950924 DSNZCFCBASUJBX-JKSUJKDBSA-N 324.493 5.471 30 20 DKED CCC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccccc1 538141920 YQVBOIGZOSTVMZ-FQEVSTJZSA-N 306.453 5.119 30 20 DKED N#CC1(CSC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 538415566 BYMKGIHBSYCKMY-UHFFFAOYSA-N 315.388 5.091 30 20 DKED Cc1cc(C#N)ccc1CS[C@H](C)c1nc2ccccc2o1 614394908 YOPYRXMUDBTMQB-CYBMUJFWSA-N 308.406 5.002 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)cc1 618802063 FNJSWFIARHUGTP-VFNWGFHPSA-N 304.437 5.020 30 20 DKED CCCC[C@@H](CC)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 735397900 YTZIBGWRHDLSGV-WBVHZDCISA-N 308.425 5.018 30 20 DKED N#CCOc1ccc(CSc2ccc(Cl)c(Cl)c2)cc1 742454235 BKAFYWUUEONYSI-UHFFFAOYSA-N 324.232 5.188 30 20 DKED C=C(C)[C@H](N[C@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 186452835 IHRPWESFPNWUJI-BZNIZROVSA-N 322.424 5.006 30 20 DKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc2ccccc2c1 212898425 WMGSYDKRJJSJFT-WQLSENKSSA-N 309.368 5.284 30 20 DKED C[C@@H](Nc1ccc(C(C)(C)C)cc1)c1ccc(OCC#N)cc1 319933921 ROHOHZRQRCIXGM-OAHLLOKOSA-N 308.425 5.060 30 20 DKED Cc1noc(C)c1C/N=C(/O)C1(C2CCCCC2)CCCCC1 329953104 NCVWABBFMVGMLH-UHFFFAOYSA-N 318.461 5.279 30 20 DKED CCSc1ccc(Cl)cc1N[C@@H](C)c1cccc(C#N)c1 600847984 FHFUZWAEESEWEX-LBPRGKRZSA-N 316.857 5.497 30 20 DKED Cc1cc(C#N)ccc1CN[C@H](C)c1ccc(SC(C)C)cc1 614407720 XQVHRIVUVXUWFH-MRXNPFEDSA-N 324.493 5.218 30 20 DKED C=CC[C@@H](N[C@H](CC)c1cccc(Cl)c1F)c1ccncc1 763537382 CTGAAOLNKOMYCM-IAGOWNOFSA-N 318.823 5.232 30 20 DKED CC(/C=C\C(=O)c1cscn1)=C/c1cccc(C(F)(F)F)c1 806573968 XVGGYFPFYVYDLJ-FUVGTJSASA-N 323.339 5.004 30 20 DKED Cc1coc2ccc(N=C(O)C[C@@H]3CCO[C@@H](C(C)C)C3)cc12 330043180 FBAVBQOBGMQWIL-RDTXWAMCSA-N 315.413 5.171 30 20 DKED CC(C)(C#N)CCCCSCc1ccccc1OC(F)F 435886377 WPOMLVRIZKKBJA-UHFFFAOYSA-N 313.413 5.241 30 20 DKED CC(C)(CCC#N)CNc1ccc(COc2ccccc2)cc1 500695582 FUFQJMUQKOQEKY-UHFFFAOYSA-N 308.425 5.007 30 20 DKED CSc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(C#N)cc1)CCC2 519829960 VRPUIJZJWWUNGL-XOBRGWDASA-N 322.477 5.008 30 20 DKED CC(C)(C#N)CCCN[C@H](CCc1ccccc1)c1ccccc1 539276825 OARRJAYYGDVAAJ-OAQYLSRUSA-N 320.480 5.280 30 20 DKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc2ccccc2c1 619746598 BPNHCMNVXFVPFO-CQSZACIVSA-N 320.823 5.216 30 20 DKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nccc2ccccc12 792093586 XTRAUXDJXOCFQK-YJBOKZPZSA-N 308.425 5.018 30 20 DKED COc1cccc2cc([C@H](C)Nc3ccc(CCC#N)cc3)oc12 903297676 IYKZBYTWLPFTAL-AWEZNQCLSA-N 320.392 5.071 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1c(F)cccc1F 918541770 JRWKNERQWZHGMJ-UHFFFAOYSA-N 312.404 5.179 30 20 DKED CC(C)CC[C@H]1CCC(=NNc2ccc(Cl)c(C(=O)O)c2)C1 1776033752 BZEPXSCVYFTVNZ-LBPRGKRZSA-N 322.836 5.042 30 20 DKED N#Cc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cc1 109039597 LXBSGOIKLZRTEK-GDNBJRDFSA-N 309.368 5.121 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC)C1 191431731 MAYCLJIDJKRIAT-MRXNPFEDSA-N 314.473 5.192 30 20 DKED C[C@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1 195614548 AAGPACDQCUUSMF-IFXJQAMLSA-N 310.416 5.135 30 20 DKED Cc1nc(SCCCC(C)(C)C#N)n(C2CCCCC2)c1C 475940984 VJHQDWJLBYIHQD-UHFFFAOYSA-N 319.518 5.427 30 20 DKED CC(C)c1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 502390697 UWHJOWAOHONQRN-UHFFFAOYSA-N 321.424 5.255 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618802060 FNJSWFIARHUGTP-QVKFZJNVSA-N 304.437 5.020 30 20 DKED CCCCCCCCCC(=O)N1CCC(OC2CCCC2)CC1 749523347 WVAFQBVFSSUAHE-UHFFFAOYSA-N 323.521 5.077 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C\c2nc(Cl)cs2)cc1 759084145 NVFBOIGUSMMXPI-FPLPWBNLSA-N 323.870 5.193 30 20 DKED CC(C)(C#N)CCCSc1nnc(CCC2CCCCC2)o1 177287727 FNNBKEAZANNIEO-UHFFFAOYSA-N 321.490 5.005 30 20 DKED N#CCCSc1ccccc1NCc1cccc(Cl)c1F 187944865 WQGOSOFSWZJELB-UHFFFAOYSA-N 320.820 5.097 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](C)c1ccc(SC(C)C)cc1 614407715 XQVHRIVUVXUWFH-INIZCTEOSA-N 324.493 5.218 30 20 DKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1c[nH]c2cc(F)ccc12 741842724 GZYVDWJKFSWBIR-HYXAFXHYSA-N 323.298 5.088 30 20 DKED N#CCCCOc1cccc(N[C@H]2CCSc3ccccc32)c1 193905876 LHJUVTSGYRGEDC-SFHVURJKSA-N 324.449 5.018 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(C)(C)CC1 476128353 CBUFGPRHSYTZGN-UHFFFAOYSA-N 313.485 5.693 30 20 DKED CC(C)(C#N)c1ccc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1 614171062 VAUVZTKDKOXHTN-FQEVSTJZSA-N 320.480 5.365 30 20 DKED C=CCOc1cccc(CN[C@@H](CC)c2cccc(Cl)c2)c1 618466264 BNXQKSXRQUAVRQ-IBGZPJMESA-N 315.844 5.146 30 20 DKED C[C@H](Sc1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 735616693 FDOBJOHCWHGOLZ-NSHDSACASA-N 307.340 5.430 30 20 DKED CSc1ccc(C(=O)/C=C/c2cc3cc(F)ccc3o2)cc1 741849435 XXXJAQQTRCCESR-VMPITWQZSA-N 312.365 5.190 30 20 DKED CCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 744016053 IEKZTNZOLLLURF-KBPBESRZSA-N 314.454 5.079 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccc(C#N)cc1 192988772 GBDZXFBVRSYNMA-DJJJIMSYSA-N 310.828 5.014 30 20 DKED C=CCCC(=O)N(CCC)[C@@H](C)c1ccc(Cl)c(Cl)c1 523272919 MEKAJOVHEPXABP-LBPRGKRZSA-N 314.256 5.259 30 20 DKED COc1cc(/C=C\C(=O)c2coc3ccccc23)ccc1SC 747704490 AFRRKNUGDHIDCA-CLFYSBASSA-N 324.401 5.059 30 20 DKED C=CC[C@H](N[C@H](C)c1ccc(OC(C)(C)C)cc1)c1ccncc1 765805209 VDWVPHJZMDKVFS-UZLBHIALSA-N 324.468 5.227 30 20 DKED C=CC[C@H](N[C@@H]1C[C@@H](C(C)C)c2ccccc21)c1ccncc1 774185415 BOQJGSIOXFLXCI-PCCBWWKXSA-N 306.453 5.173 30 20 DKED C[C@H](OC(=O)CCCCCC#N)c1ccc(Cl)cc1Cl 805696098 VZQMNYGKLBNOBU-NSHDSACASA-N 314.212 5.072 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@H]1c1cccs1 885027272 YFMJEWRNPHFSCT-INIZCTEOSA-N 307.503 5.552 30 20 DKED N#Cc1c(-c2ccccc2)cc(-c2ccc(F)cc2)nc1Cl 83204023 BBSRPNJUPIZGNK-UHFFFAOYSA-N 308.743 5.080 30 20 DKED C[C@H](S[C@H](C)c1ncc(C(C)(C)C)o1)c1ccc(C#N)cc1 85228669 ARVLLHACOQACMB-QWHCGFSZSA-N 314.454 5.399 30 20 DKED CCCCCCCCCCCCCCCCCC[C@H](C)CC 90134030 OSJUENOXPFOHLF-JOCHJYFZSA-N 310.610 8.684 30 20 DKED C[C@@H](NC(c1cccs1)c1cccs1)c1ccc(C#N)cc1 192988881 JDSSBYJPMNHCMI-CYBMUJFWSA-N 324.474 5.121 30 20 DKED Cc1c([C@@H](NCc2cccc(C#N)c2)C(C)C)oc2ccccc12 236791007 BKFAXFBAJGEYKD-FQEVSTJZSA-N 318.420 5.100 30 20 DKED CCc1ccc([C@H](CC)N[C@@H](CCC#N)c2ccccc2)cc1 358340936 MZSUJDDOMWLQDW-SFTDATJTSA-N 306.453 5.335 30 20 DKED N#Cc1cccc(CSCc2ccc(C(F)(F)F)cc2)c1 521558505 HRPYCZCAGURMDC-UHFFFAOYSA-N 307.340 5.010 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)c(C)c1 530454530 HBRKAMWIKAHMEZ-UHFFFAOYSA-N 321.464 5.337 30 20 DKED CC1(C)CC[C@H]2C[C@@H](NCc3ccc(C#N)s3)c3cccc1c32 538493303 ZQTVIIHLMKYAFB-SCLBCKFNSA-N 322.477 5.009 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCC1CCC(F)(F)CC1 417036169 SQOKEDNCQNZZQE-ZDUSSCGKSA-N 324.440 5.318 30 20 DKED CC(C)(C#N)CCCCSc1nc(-c2ccccc2)co1 436244014 XDUIZLKENPVXHE-UHFFFAOYSA-N 300.427 5.154 30 20 DKED COc1ccccc1[C@H](CC(C)C)N[C@@H](C)c1ccc(C#N)cc1 538392996 GDISCAGFAGLZJZ-JXFKEZNVSA-N 322.452 5.005 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2c(s1)CCC2 556198229 QVTBIRZTWNDNCJ-YJBOKZPZSA-N 324.493 5.323 30 20 DKED C=CCC[C@H](NCc1ccccc1OC1CCC1)c1ccco1 560546894 XTDJVNQIHXAOKJ-SFHVURJKSA-N 311.425 5.008 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)CCCCCC#N 588973054 UGWDVWDMJWJXFE-UHFFFAOYSA-N 300.446 5.175 30 20 DKED C=CCCCSc1nnc(-c2ccc(C(C)(C)C)cc2)o1 605076732 XUWIYWHZKMOESB-UHFFFAOYSA-N 302.443 5.092 30 20 DKED O=C1/C(=C\c2ccsc2)CCc2cc(SC(F)F)ccc21 750916006 JSQVYIOJWUELAW-GHXNOFRVSA-N 322.401 5.275 30 20 DKED C=CC[C@H](N[C@H](C)c1cc2cc(C)c(C)cc2o1)c1ccncc1 766018456 HYPOPCZSEJIVOV-APWZRJJASA-N 320.436 5.413 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC 340441713 DFSSQVSAKGNQEQ-VQTJNVASSA-N 322.452 5.171 30 20 DKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2ccccc2)cc1C 516699787 WPOWTVOREOHSSB-IBGZPJMESA-N 320.436 5.234 30 20 DKED C[C@H]1CCC[C@@H](C(=O)Nc2sc(-c3ccccc3)cc2C#N)C1 525559415 PMOVGJWBAFDSLV-DZGCQCFKSA-N 324.449 5.052 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc2oc3ccccc3c2c1 591474199 GJRNQSMMQUWMMJ-UHFFFAOYSA-N 308.381 5.016 30 20 DKED O=C1/C(=C/c2cnc(-c3ccccc3)s2)CCc2sccc21 727267484 VMJJKSKNLOELDQ-JLHYYAGUSA-N 323.442 5.084 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cc(Cl)cc(Cl)c1)c1ccncc1 766019506 MCSWWLULRXTUDI-YVEFUNNKSA-N 321.251 5.356 30 20 DKED C[C@H]1/C(=C\c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 809155866 HCMPDGJUHLHPLV-FNQVVVRFSA-N 323.442 5.255 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCC(F)(F)C1 283397938 FILHSOLENLNLMD-OAHLLOKOSA-N 321.411 5.303 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)CCCC 464476758 CAMFDCMYPOJQJP-MRXNPFEDSA-N 301.474 5.693 30 20 DKED N#CCC[C@H](/N=C/c1c(O)ccc2ccccc12)c1ccccc1 747690597 OSKKVCSBTLOIEM-VRMLFSPKSA-N 314.388 5.009 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(OC(C)(C)C)cc1)c1ccncc1 765805206 VDWVPHJZMDKVFS-JXFKEZNVSA-N 324.468 5.227 30 20 DKED C=CC[C@H](N[C@H](C)[C@H](C)c1ccc(Cl)cc1)c1ccncc1 792989096 WMOILSHAQKEDBX-KHYOSLBOSA-N 314.860 5.134 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1 884919748 OFOMNJIOKYDHJG-LJQANCHMSA-N 317.473 5.109 30 20 DKED CCCCCCCC(=O)Nc1cccc(NC(=O)CCC)c1C 126842420 BREXIFGDDYGCLA-UHFFFAOYSA-N 318.461 5.033 30 20 DKED C=CC[C@@H](CC)NC(=O)Nc1c(CCC)cccc1C(C)C 439383766 SBRDZLNEPINKAR-MRXNPFEDSA-N 302.462 5.239 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CC=CCC1 475575250 ZMDSMVZIOXKFLS-MRXNPFEDSA-N 312.457 5.016 30 20 DKED C[C@@H](NCc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 543877335 YBADFECZIDQDBC-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2CC2)cc1 613900170 ARMUMZYZCCEBFA-UHFFFAOYSA-N 319.448 5.668 30 20 DKED Cc1ncccc1/C=C/C(=O)c1ccc(Oc2ccccc2)cc1 728785666 JKFYMZQLWOURIS-SDNWHVSQSA-N 315.372 5.078 30 20 DKED COc1cccc2cc(/C=C\C(=O)c3ccc(SC)cc3)oc12 206875038 KQRPCBLWXPIHFX-FLIBITNWSA-N 324.401 5.059 30 20 DKED Cc1cc(C)cc(CNc2ccccc2S[C@@H](C)CC#N)c1 487353242 HYJMCTKHCPBVAF-INIZCTEOSA-N 310.466 5.310 30 20 DKED CC(/C=C\c1ccncc1C#N)=C/c1ccccc1C(F)(F)F 504720038 GTRWELQFJZMYLH-IAHOLQHESA-N 314.310 5.089 30 20 DKED Cc1cc(C)cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c1 556197541 JTNUPBABADYTNA-GHTZIAJQSA-N 306.453 5.389 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)[C@H](C)c1ccccc1 559863342 RTUVWVCIGCSIOO-WFXMLNOXSA-N 306.453 5.203 30 20 DKED CCC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 733680662 BAMRQTMUVLFYOH-HZPDHXFCSA-N 324.424 5.001 30 20 DKED CC(C)CCCCCC(=O)[C@H](C#N)c1ccc2ccccc2n1 749023528 PLQJPMBLPQZWBZ-QGZVFWFLSA-N 308.425 5.018 30 20 DKED CCCCCCCCCCCC(=O)N1CC2(C1)CC(F)(F)C2 764996914 PWADRPHTQJBYOX-UHFFFAOYSA-N 315.448 5.165 30 20 DKED O=C(/C=C/c1csc2ccccc12)c1ccc(F)cc1F 303004452 ZCNKKLWZGCIRFK-VMPITWQZSA-N 300.329 5.076 30 20 DKED CSc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 340449322 UOTOQBQPHIHHOB-JXFKEZNVSA-N 324.493 5.494 30 20 DKED CCC(C)(C)OCc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1C 447588657 VRVBEMUZCREMQC-FUHWJXTLSA-N 314.473 5.195 30 20 DKED CC[C@@H](C)CCCCC(=O)Nc1ccccc1SCCC#N 612041946 IZPQLFZDUVIGJR-OAHLLOKOSA-N 318.486 5.237 30 20 DKED Cc1ccc2cc(C(=O)/C=C/c3cncc4ccccc34)oc2c1 754827807 BETGBWVGDOAAMT-CMDGGOBGSA-N 313.356 5.186 30 20 DKED C[C@H](N[C@@H](C)c1csc(C(F)(F)F)c1)c1cccc(C#N)c1 925186372 WLMBTFDIUVQRSJ-QWRGUYRKSA-N 324.371 5.050 30 20 DKED C=C(C)[C@H](N[C@H](CC)c1ccccc1O)c1ccc(F)c(F)c1 186446403 XWEJQKNIZUWXII-MJGOQNOKSA-N 317.379 5.029 30 20 DKED CC(C)c1ccoc1C(O)=Nc1cc(C(C)(C)C)sc1C#N 330557080 ZYMTXMVMMINEDH-UHFFFAOYSA-N 316.426 5.270 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCCC1(C)C 447591114 BUAUXVGAKGBPQC-GOSISDBHSA-N 313.485 5.693 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(C)C)C1 475557578 CTUIMHJNUYEJKE-QGZVFWFLSA-N 314.473 5.048 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1c(C)cc(C)cc1C 485006563 BSXUGRSYKVLUDB-UHFFFAOYSA-N 314.473 5.212 30 20 DKED C=CC[C@@H](N[C@@H]1CCCc2ccc(SC)cc21)c1ccncc1 842842360 XFKZNBZCGARJFI-WOJBJXKFSA-N 324.493 5.088 30 20 DKED C=CCN(Cc1cccs1)C(=O)Nc1cccc2ccccc12 141593785 WGYHPFJOUWBSQY-UHFFFAOYSA-N 322.433 5.121 30 20 DKED N#Cc1ccc(SCc2ccc3ccccc3n2)c(Cl)c1 465388437 NLMHVEUWVLGHMN-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C=C(C)[C@@H](NCc1cc(Cl)cs1)c1ccc(F)c(F)c1 487567156 COZOKMWDCPQVHK-OAHLLOKOSA-N 313.800 5.087 30 20 DKED CCCc1cccc(C(C)C)c1NC(=O)c1cccc(C#N)c1C 511370414 HRXLXAQZLASCOR-UHFFFAOYSA-N 320.436 5.195 30 20 DKED CCCCOc1ccc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 551787869 NQQPLXJRWCZKIS-SJORKVTESA-N 322.452 5.149 30 20 DKED CCC[C@H](Nc1cccc(OCCCC#N)c1)c1cc(C)ccn1 601272046 CNNUJAYOWBXGSI-IBGZPJMESA-N 323.440 5.026 30 20 DKED C[C@@H](Sc1ccc(C#N)cn1)c1ccc(Cl)cc1Cl 603946565 JYAYHXDTZGLYJC-SECBINFHSA-N 309.221 5.113 30 20 DKED C=CCC[C@H](NCc1ccc(OC(C)(C)C)cc1)c1ccco1 671756148 UKOXKHPPXGOHMZ-SFHVURJKSA-N 313.441 5.254 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc2ccccc2c1)c1ccncc1 749128811 MCHIULFMRKQWNC-HRAATJIYSA-N 302.421 5.203 30 20 DKED CC(C)(C#N)c1ccc(NC(=O)CCCC2CCCCC2)cc1 25440005 GZLPFOJSKGERSB-UHFFFAOYSA-N 312.457 5.177 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)cc1Cl)C(C)C 439450403 KSOPDGWTOGYPCB-LJQANCHMSA-N 312.844 5.007 30 20 DKED C=CCC(CC=C)C(=O)N1CCCC[C@H]1c1cccc(C)c1C 467526670 FBYILRDDDLREDJ-FQEVSTJZSA-N 311.469 5.125 30 20 DKED C[C@@H](N[C@H](c1ccc(F)cc1)C1CCCC1)c1cccc(C#N)c1 537296546 CUYWQDRCQQHZPV-VFNWGFHPSA-N 322.427 5.279 30 20 DKED C=CCC[C@H](Nc1ccc2c(cnn2C(C)C)c1)c1ccco1 671759124 IMLCJNPMFHCEES-KRWDZBQOSA-N 309.413 5.330 30 20 DKED Cc1ncccc1/C=C\C(=O)c1ccc(Oc2ccccc2)cc1 728785664 JKFYMZQLWOURIS-KAMYIIQDSA-N 315.372 5.078 30 20 DKED Cc1ccsc1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741471530 BCJXBPBBBKKTKG-WAYWQWQTSA-N 305.402 5.015 30 20 DKED COc1cc(C(=O)/C=C\c2ccsc2Cl)ccc1SC 790214514 DGPQIYNBEFDDHQ-HYXAFXHYSA-N 324.854 5.028 30 20 DKED C[C@@H](c1cccc(Cl)c1)[S@](=O)CCCCC1(C#N)CCC1 899396398 DPCDHGKYKWINMN-LHSJRXKWSA-N 323.889 5.014 30 20 DKED C=CCN(CC=C)C(=S)Nc1c(C(C)C)cccc1C(C)C 915994485 TUPIFAKPIYKUQB-UHFFFAOYSA-N 316.514 5.304 30 20 DKED C=CCC[C@@H](NCc1ncc(-c2cccs2)o1)c1ccccc1 180048444 UULRUHSEKIWIBN-MRXNPFEDSA-N 324.449 5.200 30 20 DKED N#CCCC[C@H](NCc1ccc(Cl)c(F)c1)c1ccccc1 353916630 QXIXEODOOBTYRI-SFHVURJKSA-N 316.807 5.004 30 20 DKED C=C(C)C[C@@H](C)C(=O)N(Cc1cccs1)c1ccc(F)cc1 464435790 GOKMEPGWKFZEFV-CQSZACIVSA-N 317.429 5.023 30 20 DKED C[C@@H](N[C@H](CC1CCC1)c1ccccc1)c1ccc(C#N)c(F)c1 495413723 FTNMLVTXKYBAKR-QVKFZJNVSA-N 322.427 5.279 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(F)c(OC)c1)c1ccccc1 536833621 PYOGDANMIQZJEW-HNAYVOBHSA-N 313.416 5.192 30 20 DKED Cc1ccc([C@@H](NCC(C)(C)CCC#N)c2ccccc2)cc1 554365187 AHOTWEHOLIFBBT-FQEVSTJZSA-N 306.453 5.004 30 20 DKED N#Cc1ccc(NC(CCC(F)(F)F)CCC(F)(F)F)cc1 596493109 GPVWMRUUOREOIK-UHFFFAOYSA-N 324.268 5.024 30 20 DKED Cc1ncccc1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 728786495 ZXCHVEWUXBJMNB-HJWRWDBZSA-N 323.392 5.154 30 20 DKED C=CCCC(CC)=NNc1nc(Cl)c(Cl)cc1Cl 750923803 WDRSWKDZCNZKHI-UHFFFAOYSA-N 306.624 5.186 30 20 DKED CC1(C#N)CCC(=NNc2c(Cl)cc(F)cc2Cl)CC1 834967920 ZIHOWMYEBCOMIJ-UHFFFAOYSA-N 314.191 5.004 30 20 DKED CCCCCCCCC(=O)[C@@H](C#N)c1ccc2ccccc2n1 916848788 HCFLIFUEZFOFCW-KRWDZBQOSA-N 308.425 5.162 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccccc1Cl 108355224 DNMPPJIXGMDQHA-ZDUSSCGKSA-N 316.857 5.204 30 20 DKED C[C@@H](Nc1cccc(CCC(F)(F)F)c1)c1cccc(C#N)c1 182571979 GOODCZYZDLVXAN-CYBMUJFWSA-N 318.342 5.226 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)CC2 427870572 VMMLVCBLWAGRPG-LHSJRXKWSA-N 322.427 5.159 30 20 DKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccccc1)c1ccccc1 435107125 RYYULDSZSLQTSJ-XLIONFOSSA-N 322.452 5.097 30 20 DKED N#CCSCCCSC(c1ccccc1)c1ccccc1 466623603 SUSCQRJCRBLAJZ-UHFFFAOYSA-N 313.491 5.156 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)CC(C)C 475556698 RWVRRWJXGJRYHG-UHFFFAOYSA-N 316.489 5.438 30 20 DKED CC(C)c1ccc([C@@H](NCc2ccc(C#N)cc2)C(C)C)cc1 512833375 KXNGZNYSXNCYKA-NRFANRHFSA-N 306.453 5.169 30 20 DKED N#Cc1c(Cl)cccc1SCc1ccc2ccccc2n1 540043007 OPEVRSXTSZGDCN-UHFFFAOYSA-N 310.809 5.052 30 20 DKED Cc1cccc(Oc2ccc(NC(=O)CCCCCC#N)cc2)c1 588147358 WLOYPTRIUMSKFY-UHFFFAOYSA-N 322.408 5.200 30 20 DKED Cc1cc(C#N)ccc1CN[C@@H](C)c1cccc(Cl)c1Cl 614407427 QJZGEVBMSCCUMX-LBPRGKRZSA-N 319.235 5.024 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1cc2ccccc2s1 444678346 WIJFMTAKFQLAAF-CQSZACIVSA-N 300.471 5.272 30 20 DKED N#CCCCOc1cccc(CNc2cccc3ccsc23)c1 533563167 QMDHYKKNHPQPII-UHFFFAOYSA-N 322.433 5.196 30 20 DKED CC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(C)cc1 614180044 UHIBDJHDCWRWTF-HXUWFJFHSA-N 306.453 5.037 30 20 DKED O=C(/C=C/C=C/c1ccccc1)c1cccc(-c2ccncc2)c1 741474252 WLCRQIXGPLWARQ-XFRMRLMGSA-N 311.384 5.201 30 20 DKED N#C[C@H](SC1=Nc2ccccc2CS1)C1CCCCC1 115186500 IYGVLNAHYAPDSW-HNNXBMFYSA-N 302.468 5.127 30 20 DKED C[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 324925875 VWZTWICBODEAGR-KRWDZBQOSA-N 312.416 5.076 30 20 DKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1Cl)c1ccccc1Cl 433172088 BZQRMULTOHDQMQ-RYUDHWBXSA-N 319.235 5.277 30 20 DKED C=CCC[C@@H](N[C@H](C)c1sccc1OC)c1ccccc1 471578774 RUBHDBOKZZMIFH-GDBMZVCRSA-N 301.455 5.115 30 20 DKED CC(C)(C#N)CCCN[C@H](Cc1ccccc1)c1ccccc1F 539360347 ZAPACYXEYHWWQB-HXUWFJFHSA-N 324.443 5.029 30 20 DKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2s1 805844171 GFWSACIEYQZGFC-ZDUSSCGKSA-N 314.454 5.079 30 20 DKED CSc1ccc(/C=C/C(=O)c2ccc(SC)cc2)cc1 33848455 RSFMOXYGJZKDCF-LFYBBSHMSA-N 300.448 5.027 30 20 DKED N#CCCCOc1cccc(/C=C\c2ccc3ccccc3n2)c1 207617517 BQVFVNUWDBFZIC-BENRWUELSA-N 314.388 5.088 30 20 DKED C[C@@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1cccc(C#N)c1 319660966 BTRBIXRWCPGSOZ-AUUYWEPGSA-N 310.416 5.135 30 20 DKED Cc1ccc(-c2cccnc2)cc1N[C@@H](C)c1ccc(C#N)cc1 479846470 IYIRGXRNMWDFSV-INIZCTEOSA-N 313.404 5.102 30 20 DKED CC(C)(CCC#N)CN1CCC[C@@H]1c1cccc2ccccc12 511759396 UGYDPNYZMIHZSM-HXUWFJFHSA-N 306.453 5.307 30 20 DKED O=C(/C=C/c1ccc(-c2c(F)cccc2F)o1)c1ccsc1 734367655 KXESAOPGONSWBT-GQCTYLIASA-N 316.328 5.182 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2ccccc2o1 90665429 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Cc1ccc([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)s1 795785868 DQZUJVWOMMEVBJ-RDTXWAMCSA-N 310.466 5.047 30 20 DKED CCC/C(C)=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 920221021 KCFADUKTTMPCQW-VISDOYDDSA-N 318.420 5.027 30 20 DKED C[C@H](S[C@@H](C)c1ncc(C(C)(C)C)o1)c1cccc(C#N)c1 190904178 BGELTEITYOYQRE-STQMWFEESA-N 314.454 5.399 30 20 DKED O=C1/C(=C\c2cccs2)CCc2nc(-c3ccccc3)sc21 207731878 FDIRQQRBYWURDB-QBFSEMIESA-N 323.442 5.084 30 20 DKED C[C@H](c1cccc(Cl)c1)[S@](=O)CCC1(C#N)CCCCC1 417181632 RTHDAOCYTUBWOV-SPLOXXLWSA-N 323.889 5.014 30 20 DKED CC(C)(C)c1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 474099031 UCMYLBYXRIMCGZ-QGZVFWFLSA-N 320.436 5.010 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(F)c(C#N)c1 507756662 IBUBGIZZOONERK-UHFFFAOYSA-N 324.399 5.196 30 20 DKED CCCCc1nc(-c2cn(CCC#N)c3ccccc23)cs1 513397553 VUNJZPZPGIEZGV-UHFFFAOYSA-N 309.438 5.021 30 20 DKED C=CC[C@H](C(=O)Nc1cc(C)c(F)cc1Cl)c1ccccc1 561814215 YOTGXYLUZPHYOQ-AWEZNQCLSA-N 317.791 5.086 30 20 DKED CC(C)c1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)[nH]2)cc1 742432198 WFRLZBKWOZMOGN-SEYXRHQNSA-N 316.404 5.096 30 20 DKED COc1cc(C)c([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1C 753688764 VDKFPTKWSWHTHB-FXAWDEMLSA-N 322.452 5.008 30 20 DKED C[C@@H](SCCC(Cl)(Cl)Cl)c1ccc(C#N)cc1 767869111 YATFKXQBNFIVAP-SECBINFHSA-N 308.661 5.113 30 20 DKED CC(C)(C)c1cnc(/C=C/C(=O)c2ccc(Cl)s2)s1 790599076 RXKNHKMLDFFRLL-QPJJXVBHSA-N 311.859 5.052 30 20 DKED CCCOc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 181574189 FTGBZRYQHLKTJH-LAUBAEHRSA-N 322.452 5.171 30 20 DKED C=CCC[C@@H](C(=O)Nc1cc(C)c(O)c(C)c1C)c1ccccc1 427810439 FLPNMSKMJMNDNZ-GOSISDBHSA-N 323.436 5.006 30 20 DKED C=CCC[C@H](C(=O)Nc1cc(C)c(O)c(C)c1C)c1ccccc1 427810440 FLPNMSKMJMNDNZ-SFHVURJKSA-N 323.436 5.006 30 20 DKED C=CCC[C@@H](NCc1ccc(C#N)cc1Cl)c1ccccc1 439434947 UABDMTCQCWMTFR-LJQANCHMSA-N 310.828 5.009 30 20 DKED Cc1cc(CN[C@H](C)c2ccc(F)c3ccccc23)ccc1C#N 567306779 JYLHRYDGZUGBHW-OAHLLOKOSA-N 318.395 5.010 30 20 DKED C[C@H](CCc1ccccc1F)N[C@H](CCCC#N)c1ccccc1 568116558 FWXCFEUHKAJVSP-DYESRHJHSA-N 324.443 5.172 30 20 DKED Cc1cc(Oc2ccccc2)ccc1NC(=O)CCCCCC#N 588157364 JGWXMTXGNWAKFV-UHFFFAOYSA-N 322.408 5.200 30 20 DKED C[C@@H](CC#N)C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1 597362028 JEHQBCZMZQHCBQ-LSDHHAIUSA-N 324.449 5.028 30 20 DKED Cc1cc(/C=C\C(=O)c2cccs2)ccc1Oc1cccnc1 732714293 WOMZVBJJVJFVDZ-VURMDHGXSA-N 321.401 5.140 30 20 DKED C=CCN(C(=O)Nc1ccc(S[C@@H](C)CC)cc1C)C(C)C 748446799 FMNFWXZLIYYEME-HNNXBMFYSA-N 320.502 5.314 30 20 DKED C=CCCCCC[C@H](C)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 793556284 WPUNMWSCXMUIJH-FFZOFVMBSA-N 319.464 5.160 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1cccc(C(C)=O)c1 918541200 ADXGXTBTWTVGFJ-UHFFFAOYSA-N 318.461 5.104 30 20 DKED CC(CCC1CCCCC1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033512 SMYWKZXHTBSEDJ-UHFFFAOYSA-N 322.836 5.187 30 20 DKED C[C@H](Nc1ccc(CC#N)cc1)c1cc(Cl)ccc1Cl 37071321 HHNNLYFPNGQQMK-NSHDSACASA-N 305.208 5.233 30 20 DKED C(#CC1(N2CCCCC2)CCCCC1)CCCc1ccccc1 98178619 QXQYZLIOUPTIRS-UHFFFAOYSA-N 309.497 5.202 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C)[C@@H]1C 191504862 LZNWYAGSGDMSRN-CVEARBPZSA-N 314.473 5.191 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)CCC 475546085 LHACRHLAMZKDTB-UHFFFAOYSA-N 302.462 5.239 30 20 DKED C[C@@H](SCc1ccccc1C(C)(C)C#N)c1ccc(C#N)cc1 486739135 SERUDBILMSJWHR-OAHLLOKOSA-N 320.461 5.354 30 20 DKED CC[C@H](C)[C@@H](NCc1cc(C#N)cs1)c1ccc(Cl)cc1 530879315 UXCVJHRJNDDUQQ-YVEFUNNKSA-N 318.873 5.150 30 20 DKED C[C@@H](NCc1ccc(-c2cccs2)cc1)c1ccc(C#N)cc1 618302253 PWQGGULZWDBVII-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C=C[C@H](CC(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 677600604 XWHDRGHXVCEQIW-OAHLLOKOSA-N 313.828 5.255 30 20 DKED O=C(/C=C/c1cccs1)c1ccc(SCC(F)F)cc1 741847634 QVPHQEZQKSVNIG-BQYQJAHWSA-N 310.390 5.001 30 20 DKED C=CCC[C@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ccccc1 756759005 HBZHKIKLOKIEBW-ACJLOTCBSA-N 317.379 5.029 30 20 DKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@@H]1c1cc(C)no1 822163268 GULKDIOIZLHNOJ-DOTOQJQBSA-N 320.477 5.033 30 20 DKED N#CCCSc1ccccc1NCc1cc(Cl)ccc1F 189645619 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N#CCCC[C@H](N[C@@H]1CCc2ccc(Cl)cc21)c1ccccc1 551212329 ZJTDQMFEIINTNC-VQTJNVASSA-N 324.855 5.352 30 20 DKED C=CCC[C@@H](NCc1cc2c(s1)CCCC2)c1ccco1 552040233 NZSUOAMVJFBIRF-MRXNPFEDSA-N 301.455 5.017 30 20 DKED CC[C@H](NCc1cc2ccccc2s1)c1ccc(C#N)cc1 556218658 YFSZKFMRDRGQQV-SFHVURJKSA-N 306.434 5.014 30 20 DKED CC[C@@H](c1ccc(Cl)cc1Cl)N1CCC(CC#N)CC1 578496419 CWFVNABLGOWGEX-INIZCTEOSA-N 311.256 5.070 30 20 DKED C[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)CC(C)(C)C 797569351 PKYPMOZNUAZOMN-QWHCGFSZSA-N 320.502 5.079 30 20 DKED Cc1ccc(-c2nc(/C=C3\C(=O)c4ccccc4[C@H]3C)co2)cc1 809156893 OPUIOJLTZAUUDK-AXLWCPOOSA-N 315.372 5.033 30 20 DKED CCC[C@H](Nc1ccc(CCC#N)cc1)c1ncccc1Cl 926887703 AWACZJKGVIBWGY-KRWDZBQOSA-N 313.832 5.144 30 20 DKED C=CCC(CC=C)C(=O)N1CCCC[C@@H]1c1cccc(C)c1C 467526671 FBYILRDDDLREDJ-HXUWFJFHSA-N 311.469 5.125 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cccc(F)c1F)c1ccc(F)c(F)c1 480680809 LOXVXOJBFRKJFL-VOJFVSQTSA-N 323.333 5.211 30 20 DKED Cc1ccccc1[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)C(C)C 512659998 KYBUEMIVEZVJFT-YWZLYKJASA-N 310.416 5.054 30 20 DKED CC(C)c1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)cc1 551810989 AEEWVYFDFPBHMP-INIZCTEOSA-N 304.437 5.022 30 20 DKED C[C@H](CCN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 574791037 HXRYSFKADPOHCT-NQIIRXRSSA-N 306.453 5.205 30 20 DKED C=CC[C@H](N[C@@H](C)[C@H](C)c1ccc(Cl)cc1)c1ccncc1 792989094 WMOILSHAQKEDBX-DOXZYTNZSA-N 314.860 5.134 30 20 DKED CC(=NNc1cccc(Cl)c1)c1sc(C(C)(C)C)nc1C 915109677 DQYPBUIDLJZOEZ-UHFFFAOYSA-N 321.877 5.239 30 20 DKED C[C@H](Sc1nc2cc(Cl)ccc2o1)c1ccc(C#N)cc1 303689694 LRDNYHKLCSQRBA-JTQLQIEISA-N 314.797 5.206 30 20 DKED CCCOc1ccc(Cl)cc1N[C@@H](C)c1ccc(C#N)cc1 314613315 VINQIINHZZDLOG-ZDUSSCGKSA-N 314.816 5.174 30 20 DKED CC(C)(c1ccc(NCc2ccc(C#N)s2)cc1)C(F)(F)F 428566882 NQPCDFMLCZWWOW-UHFFFAOYSA-N 324.371 5.072 30 20 DKED CCCc1ccc(CN[C@H](CCCC#N)c2ccccc2)s1 598644909 UPYOMBXEFLRIAW-LJQANCHMSA-N 312.482 5.225 30 20 DKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1csc(Cl)c1 761487556 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CCSc1ccc(C(=O)/C=C\c2ccc3cnccc3c2)cc1 782347743 MYBJOEDHVPEJOR-WMZJFQQLSA-N 319.429 5.243 30 20 DKED C=CCCC[C@@H](N[C@H]1CCCc2oc(C)nc21)c1ccccc1 926857041 ZZYNBMJXJUXDHT-MSOLQXFVSA-N 310.441 5.048 30 20 DKED C=CCC[C@@H](NCc1ncc(-c2ccccc2)o1)c1ccccc1 180045625 DHPGUNDGZBCDKJ-LJQANCHMSA-N 318.420 5.139 30 20 DKED C=C(C)[C@H](N[C@H](C)c1sccc1OC)c1ccc(F)c(F)c1 186450050 XQRCMAYZAUJPPN-BZNIZROVSA-N 323.408 5.003 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1OCC 189909236 AIFWTTFJDACDKL-UHFFFAOYSA-N 323.436 5.190 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H](C)c1cccc(Cl)c1 410358666 HPBMCEQERWHNLC-AWEZNQCLSA-N 313.828 5.201 30 20 DKED C=CCC[C@@H](C(=O)Nc1ccc(F)cc1Cl)c1ccccc1 487596748 KBWXSZRRAJVMCN-OAHLLOKOSA-N 317.791 5.168 30 20 DKED C[C@H](NCc1cccc(-c2ccccc2)c1)c1ccc(C#N)cc1 521830705 MYXJUTJXZNTZIY-KRWDZBQOSA-N 312.416 5.076 30 20 DKED COc1ccc(CN(CCCCC(C)(C)C#N)C(C)(C)C)cc1 588985131 OQLHDRVUICQKBY-UHFFFAOYSA-N 316.489 5.016 30 20 DKED C[C@H](N[C@H](C)c1cc(Cl)cc(Cl)c1)c1cccc(C#N)c1 610830407 QSQCFSLSTRJAMU-NWDGAFQWSA-N 319.235 5.277 30 20 DKED CCCCCCCC(=O)O[C@@H](c1ccccc1)c1cccnc1 728416318 KYBGUTBMWPWZKN-FQEVSTJZSA-N 311.425 5.075 30 20 DKED CC(C)(CCC#N)CNc1ccc(OC2CCCCC2)cc1 742370966 BYERFVBTYKXKGK-UHFFFAOYSA-N 300.446 5.140 30 20 DKED CC(C)CCOc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1 745225216 VWSNYXKHJSLBKG-MRXNPFEDSA-N 308.425 5.156 30 20 DKED C#CCCCCC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 773398551 CTUZMVCABYLVBK-GOSISDBHSA-N 319.448 5.067 30 20 DKED O=C(/C=C/c1ccc2cnccc2c1)c1cccc2ccccc12 782300551 GRMVSKLXKVFVRH-PKNBQFBNSA-N 309.368 5.284 30 20 DKED C=CCC[C@@H](N[C@H]1CCc2nc(Cl)ccc21)c1ccccc1 806149312 RJLLGEXRSAQTKU-SJORKVTESA-N 312.844 5.019 30 20 DKED C[C@H](Nc1ccc(CCC(F)(F)F)cc1)c1cccc(C#N)c1 182333071 JTOYCLDKMUCUIE-ZDUSSCGKSA-N 318.342 5.226 30 20 DKED CCC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1 340448704 JBVOJRXZPWENMZ-SFTDATJTSA-N 306.453 5.553 30 20 DKED N#CCCC[C@H](NCc1c(F)cccc1Cl)c1ccccc1 433021147 VXIUCPSLSCNESX-SFHVURJKSA-N 316.807 5.004 30 20 DKED CC(C)(C#N)CCCN1CCC[C@H]1c1cccc2ccccc12 472444287 QECCNDNQTBPISH-FQEVSTJZSA-N 306.453 5.307 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)s1 531696083 HJPUMEUUGZNTRU-SMDDNHRTSA-N 304.846 5.075 30 20 DKED N#CCCCCN[C@@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 531960759 JFVGBEBZUXAKDD-DLBZAZTESA-N 324.390 5.015 30 20 DKED C[C@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1cccc(C#N)c1 539496861 NFGAMXWXWYRXNU-IFXJQAMLSA-N 310.416 5.135 30 20 DKED CC(C)C[C@H](NCc1ccc(C#N)s1)c1ccc(Cl)cc1 540613677 LZPJIGKWMPPQAY-KRWDZBQOSA-N 318.873 5.150 30 20 DKED C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1SCCC#N 542553602 GNSBOVOGVSVAOQ-AWEZNQCLSA-N 318.486 5.093 30 20 DKED N#CCCC[C@H](NCc1cc2ccccc2s1)c1ccccc1 577236864 WBJZKFAMAOFGRH-IBGZPJMESA-N 320.461 5.426 30 20 DKED Cc1c(C(=O)/C=C/c2cccc3cnccc23)oc2ccccc12 782887237 JTPOJLCEAOBBFS-MDZDMXLPSA-N 313.356 5.186 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1c[nH]c2cc(F)ccc12 794934692 MBYXVAWJNSVTDG-FPYGCLRLSA-N 315.294 5.141 30 20 DKED Cc1cc2cc(C(=O)/C=C\c3cn(C(C)C)nc3C)oc2cc1C 798370352 KTLMGZPVCKBMKP-SREVYHEPSA-N 322.408 5.032 30 20 DKED CCSc1ccc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 179235991 JOIABDVERJPUJN-GJZGRUSLSA-N 310.466 5.082 30 20 DKED Cc1nc(-c2cccc(N[C@H](C)c3cccc(C#N)c3)c2)cs1 192995677 DAJSPKOQSNYOIE-CYBMUJFWSA-N 319.433 5.163 30 20 DKED Cc1ccc2c(c1)[C@@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 340430930 AIKZQFRWVDZYON-VXKWHMMOSA-N 318.464 5.397 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 481585072 HPQYOLIKUNWMPJ-VOJFVSQTSA-N 323.333 5.211 30 20 DKED C=C[C@@H](CC(=O)N(CC)c1ccccc1Cl)c1ccccc1 550764920 UIQBBQDTWUWGSE-HNNXBMFYSA-N 313.828 5.053 30 20 DKED C=CC[C@H]1CCN(C(=O)Nc2c(C(C)C)cccc2C(C)C)C1 626190584 NCIMUDIBBRRBRQ-INIZCTEOSA-N 314.473 5.363 30 20 DKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(C)cc1C 732624914 GOIMKTGRLVGWFV-UHFFFAOYSA-N 316.514 5.069 30 20 DKED CCC[C@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748618314 HFSMZWGJJKJTET-JXFKEZNVSA-N 320.436 5.107 30 20 DKED CC(CCCC(F)(F)F)=NNc1ccc(C(F)(F)F)cc1 774395821 UQQWCTWWIWRSQB-UHFFFAOYSA-N 312.257 5.226 30 20 DKED Cc1cc(-c2ccccc2)ccc1NC(=O)CCCCCC#N 805161815 CRSWSVBBEAGGHB-UHFFFAOYSA-N 306.409 5.075 30 20 DKED CC[C@@H](NCc1cccc(C#N)c1)c1ccc(Cl)cc1Cl 37748834 HWXJUURWRQULFI-QGZVFWFLSA-N 319.235 5.106 30 20 DKED CCCCCCCCCCCc1cnc2ccc(Cl)cc2n1 100158779 SGEIZCNSYPFSHO-UHFFFAOYSA-N 318.892 6.357 30 20 DKED CC(C)CC[C@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1 236623925 VIQQQVLRPXLUNW-SFHVURJKSA-N 316.832 5.072 30 20 DKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCC(C)(C)C#N 287691671 XCOZBQGZGUOMFB-IVZQSRNASA-N 319.514 5.124 30 20 DKED C=CCC[C@H](NC(=O)c1cccc(C(F)F)c1)c1ccccc1 435283447 XVPBOPLHNRXODV-KRWDZBQOSA-N 315.363 5.062 30 20 DKED C=CCN(CC=C)C(=O)Nc1c(C)cc(Cl)c2ccccc12 462852270 DRWVPWZOJKXTIL-UHFFFAOYSA-N 314.816 5.008 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 539610763 IITVQAVILIKLBH-QRWLVFNGSA-N 308.400 5.055 30 20 DKED C=CCC[C@H](NCc1coc(-c2ccc(C)cc2)n1)c1ccco1 560529043 IKTWQAGBFSMRHL-SFHVURJKSA-N 322.408 5.040 30 20 DKED CC(C)Sc1cccc(Cl)c1CNCC(C)(C)CCC#N 574839257 IJEDZKUQAVDHHL-UHFFFAOYSA-N 324.921 5.260 30 20 DKED CC[C@@H](C)Sc1ccc(NC(=O)CCCCCC#N)c(C)c1 588154983 UQZBJQNFWHQDOC-OAHLLOKOSA-N 318.486 5.298 30 20 DKED CCCCCC[C@@H](CC)C(=O)[C@@H](C#N)c1nc2ccccc2o1 735205834 HGZXIGXIOWNKFI-HUUCEWRRSA-N 312.413 5.001 30 20 DKED C=CC[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 766022025 VUCHPARTRIZNHF-CXAGYDPISA-N 320.358 5.068 30 20 DKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1coc2ccccc12 925599899 DGLYKXBGXOLXMF-DNVCBOLYSA-N 304.393 5.128 30 20 DKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(C)cc1 195656632 MWGXEPHFAZMHHB-HXUWFJFHSA-N 308.425 5.241 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)CC(C)C 476088853 HYUZPFHYLBJICB-MRXNPFEDSA-N 301.474 5.549 30 20 DKED Cc1ccccc1C(=O)/C=C/c1cnc(-c2cccs2)s1 751513106 NURIHCCXDFYURI-CMDGGOBGSA-N 311.431 5.076 30 20 DKED Cc1cc2cc(C(=O)/C=C\c3nc(Cl)cs3)oc2cc1C 759086117 ZKOYBQLPOPWWDZ-ARJAWSKDSA-N 317.797 5.056 30 20 DKED CCCCCCCC[C@H](C)C(=O)Nc1cc(C)cc(C(=O)O)c1 1776786148 RZEKIHMMEMECDW-HNNXBMFYSA-N 319.445 5.018 30 20 DKED N#Cc1ccc(CNc2ccc(-c3ccccc3)cc2F)c(F)c1 25715101 SYXAMJWJHIWEBH-UHFFFAOYSA-N 320.342 5.116 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1sccc1C)c1ccc(F)c(F)c1 480659199 CVNHPDCDJQTTOG-LRDDRELGSA-N 307.409 5.303 30 20 DKED CSc1ccc(Cl)cc1N[C@@H](C)c1cccc(C#N)c1 540833622 OMJGAVUCENDMLI-NSHDSACASA-N 302.830 5.107 30 20 DKED CC(C)C[C@H](NC(=O)CCCCCC#N)c1ccc(Cl)cc1 588382399 ZNHPWAZOLJOSGY-KRWDZBQOSA-N 320.864 5.017 30 20 DKED Cc1cccc(Oc2ccccc2NC(=O)CCCCCC#N)c1 588816908 RNNCYIGBJLQOQV-UHFFFAOYSA-N 322.408 5.200 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(F)c(Cl)c1 760262303 JHJURYIIDQZOTC-ALCCZGGFSA-N 321.804 5.099 30 20 DKED CCCCCCCCC(=O)N1CCCCC[C@@H]1c1ccncc1 915869808 HNNJFOZNUAWSDO-LJQANCHMSA-N 316.489 5.276 30 20 DKED CCCCCCCC(=O)Nc1cccc(-c2nccs2)c1 918645054 PPFUEHRTEYBWQY-UHFFFAOYSA-N 302.443 5.109 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1)c1ncc(-c2ccccc2)o1 78056142 AVMIMFDWZWREQL-CYBMUJFWSA-N 306.390 5.067 30 20 DKED C[C@@H](SC1=Nc2ccccc2CS1)c1ccc(C#N)cc1 118174126 LBDZSLJPOZABED-GFCCVEGCSA-N 310.447 5.287 30 20 DKED CCC[C@@](C)(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 483467268 BILSGJTZOBQQNQ-RDTXWAMCSA-N 318.486 5.093 30 20 DKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2)c(C)c1 499732852 QMSYWPNYGXSUCU-CQSZACIVSA-N 324.449 5.010 30 20 DKED C[C@H](N[C@@H](C)c1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1 531951388 MMQFRZBBRKYEPM-RYUDHWBXSA-N 319.235 5.277 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccoc1)c1ccc(C(F)(F)F)cc1 540149040 LJYGTFHFXZCRMB-SUMWQHHRSA-N 323.358 5.657 30 20 DKED CCCCOc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)cc1 551787868 NQQPLXJRWCZKIS-IRXDYDNUSA-N 322.452 5.149 30 20 DKED CC[C@@H](CN[C@@H](CCCC#N)c1ccccc1)c1ccccc1 560563617 BJWRWYYRKWIYPJ-RXVVDRJESA-N 306.453 5.205 30 20 DKED C[C@H](N[C@H](C)c1csc2ccccc12)c1ccc(C#N)cc1 743475613 SZEWQDWHRFRKMG-UONOGXRCSA-N 306.434 5.185 30 20 DKED N#CC1(/C(O)=N/[C@@H]2CCC[C@@H](c3ccccc3)C2)CCCCC1 330202917 ZYYNBOWNOPMSOD-QZTJIDSGSA-N 310.441 5.143 30 20 DKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cccc2ccccc12 439461355 ZZGHEKJOHSVTEY-AWEZNQCLSA-N 320.823 5.216 30 20 DKED C[C@@H](N[C@H](c1cccc(F)c1)C(C)(C)C)c1cccc(C#N)c1 539496856 NFGAMXWXWYRXNU-AUUYWEPGSA-N 310.416 5.135 30 20 DKED C=C(CC)CS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 579964980 ANUCPCPZIMYMIG-OAHLLOKOSA-N 305.487 5.145 30 20 DKED Cc1ccc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)s1 730085319 OAZVKNWVDAYXOB-MDZDMXLPSA-N 311.431 5.076 30 20 DKED CC(/C=C/C1=C(C)CCCC1(C)C)=NNc1ccc(Cl)nn1 751396956 LUJSDZBBUSJNDN-OUXDSOEMSA-N 318.852 5.001 30 20 DKED C[C@@H](N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 21799133 RPUJFOAUDJVGNT-VXGBXAGGSA-N 319.235 5.277 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(CC)cc1 189901526 XFXZTXIRESEDNJ-UHFFFAOYSA-N 321.464 5.282 30 20 DKED C[C@@H]1CC[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 340450317 XCKMQWNCMOBDBP-ZPMCFJSWSA-N 318.464 5.650 30 20 DKED CC(C)C[C@H](NCc1ccc(C#N)cc1)c1ccc(Cl)cc1 462726500 IYXKZBCCUZGIRT-IBGZPJMESA-N 312.844 5.089 30 20 DKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 505028881 JPFRZXFJDYMHMQ-OXQOHEQNSA-N 320.436 5.030 30 20 DKED O=C(/C=C/c1ccc2oncc2c1)c1cc2cc(Cl)ccc2o1 821030834 CRPCWGGXBCIQTO-DAFODLJHSA-N 323.735 5.124 30 20 DKED Cc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3)c2)o1 210406906 YTVMNAXYNRXAQI-QXMHVHEDSA-N 318.372 5.063 30 20 DKED CC[C@H](N[C@H](C)c1cccc(OC(C)C)c1)c1ccc(C#N)cc1 447538012 AHYYJWZHQFADQS-IERDGZPVSA-N 322.452 5.147 30 20 DKED Cc1ccc([C@H](NCC(C)(C)CCC#N)c2ccccc2)cc1 554365188 AHOTWEHOLIFBBT-HXUWFJFHSA-N 306.453 5.004 30 20 DKED C=CC[C@H]1CCN(C(=O)Nc2c(CCC)cccc2C(C)C)C1 626532588 IEOWZZJKCAECBT-INIZCTEOSA-N 314.473 5.192 30 20 DKED CC[C@@H](NCc1cc(C#N)ccc1F)c1cccc2ccccc12 783253909 LQCXYIHFTOZDNT-OAQYLSRUSA-N 318.395 5.091 30 20 DKED CC(C)(CC(=O)[C@@H](C#N)c1nc2ccccc2o1)C1CCCCC1 796651908 BGVYRIDOFOMWTK-OAHLLOKOSA-N 324.424 5.001 30 20 DKED CSc1ccc(/C=C\C(=O)c2c(F)cccc2Cl)cc1 809159511 QRLJXMPQRQVULA-YFHOEESVSA-N 306.789 5.097 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1csc(C(F)(F)F)c1 924785617 OTYPECAAZWEMHN-MNOVXSKESA-N 324.371 5.050 30 20 DKED CC(C)(C#N)CCCN[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 180067391 XTOIRYQYVYBZDU-MRXNPFEDSA-N 324.390 5.076 30 20 DKED Cc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1-c1ccncc1 427857254 IFISRULZCPKXPR-INIZCTEOSA-N 313.404 5.102 30 20 DKED CCC(CC)[C@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 534169818 WFWBCFXVNFXXOU-KBPBESRZSA-N 318.486 5.092 30 20 DKED N#Cc1cc(Cl)ccc1SCc1ccc2ccccc2n1 610654651 AATBMQAJYSYAKI-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H](C)CC 191417041 XUEVHFMNCWDZEN-HNNXBMFYSA-N 302.462 5.048 30 20 DKED CCC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccsc1 340447181 PFEJFBYZNMPECX-OALUTQOASA-N 312.482 5.614 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H]1CCSc2ccccc21 410359153 KJZBLCFVLMNLKL-QGZVFWFLSA-N 323.461 5.023 30 20 DKED C=CCC(C)(C)C(=O)N1CCC(c2cccc3ccccc23)CC1 433239311 KEBQRVNLVOCICD-UHFFFAOYSA-N 321.464 5.148 30 20 DKED CC(C)(C#N)CCCn1ccc(-c2cc(Cl)ccc2Cl)n1 433605940 SZUUTVQNMHXLFS-UHFFFAOYSA-N 322.239 5.187 30 20 DKED CC[C@H](Nc1ccc(N2CCCC2)cc1C)c1ccc(C#N)cc1 447582279 YQNJQJAURPSNDW-FQEVSTJZSA-N 319.452 5.030 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@@H]1CCC[C@@H](C#N)C1 463299337 DUYSNCGMSGVOFN-NVXWUHKLSA-N 302.487 5.131 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 464444860 ZJMJBXKZLRITBQ-CYBMUJFWSA-N 315.363 5.173 30 20 DKED N#Cc1ccc(CSCc2cccc(C(F)F)c2)cc1F 479589982 LTAYSACTHZIOFY-UHFFFAOYSA-N 307.340 5.068 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1 537950264 OUMHMEOVEAKKAJ-JTSKRJEESA-N 314.432 5.535 30 20 DKED Cc1ccc([C@@H](Nc2cccc(OCCCC#N)c2)C2CCC2)o1 541778270 RYCFAVOENBKFEX-FQEVSTJZSA-N 324.424 5.224 30 20 DKED O=C1/C(=C/c2csc(-c3ccccc3)n2)CCc2sccc21 726890199 DSTLVQQOFXXWLX-JLHYYAGUSA-N 323.442 5.084 30 20 DKED CC(C)[C@@H]1/C(=C/c2scnc2C2CC2)C(=O)c2ccccc21 782354394 LPQHGHZPDUJHTI-KAKTVLCNSA-N 309.434 5.040 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C)cc1 340448676 ISMMMNOSAWONJF-SFTDATJTSA-N 306.453 5.471 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@](C)(CC)C1 475552374 LVHAYJICSIVLRB-FQEVSTJZSA-N 314.473 5.192 30 20 DKED C[C@H](CCCC(F)(F)F)N[C@@H]1CCCCc2cc(C#N)ccc21 481995078 ZYUILXXWLCRILG-CXAGYDPISA-N 324.390 5.036 30 20 DKED Cc1ccc(CCNc2ccccc2S[C@H](C)CC#N)cc1 486055510 ZNXMZMZOPDOKFE-MRXNPFEDSA-N 310.466 5.044 30 20 DKED C=CCC[C@@H](NCc1cc(-c2ccccc2)no1)c1ccccc1 539291034 CALUKXIOUWHKJD-HXUWFJFHSA-N 318.420 5.139 30 20 DKED CC(C)[C@@H]1C[C@@H](NC2(c3cccc(C#N)c3)CC2)c2ccccc21 576486429 NVCCATHOAFVHEY-LEWJYISDSA-N 316.448 5.022 30 20 DKED CCCCCCCCC(=O)Nc1c(F)cccc1N1CCCC1 731462713 XQWJGDRXYRSRIP-UHFFFAOYSA-N 320.452 5.115 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747198194 UKPFVNYMBQOOLI-ZIAGYGMSSA-N 306.475 5.049 30 20 DKED FC(F)(F)c1ccccc1ON=Cc1cc2ccccc2s1 754711920 DBELAJKSZAEAIG-UHFFFAOYSA-N 321.323 5.333 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1csc2ccccc12 776739076 LPVMAZKGIQKCOH-OLZOCXBDSA-N 324.424 5.324 30 20 DKED C=CC[C@@H](CC)N[C@@H](C)c1ccc(SC(F)F)c(OC)c1 798937430 QRHCNBKUWLOFJX-WCQYABFASA-N 315.429 5.015 30 20 DKED CCCCCCCC(C)=NNc1ccc(Cl)c(C(=O)O)c1 1776033339 KDAKKGJUHIMUHR-UHFFFAOYSA-N 310.825 5.187 30 20 DKED C[C@H](c1ccc(Oc2ccccc2)cc1)N1CCC(C)(C#N)CC1 445422310 MERJZLUYFSRCRL-QGZVFWFLSA-N 320.436 5.166 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C(C)(C)C)C1 455249663 RAVOCRPAGJDDAO-UHFFFAOYSA-N 314.473 5.048 30 20 DKED Cc1c([C@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)oc2ccccc12 477850772 CTFCLZDZQBVMGG-KGLIPLIRSA-N 322.383 5.164 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1 512659676 JECHBTBVCMLGMV-QRWLVFNGSA-N 308.400 5.055 30 20 DKED C[C@H](CCc1ccccc1F)N[C@@H](CCCC#N)c1ccccc1 568116560 FWXCFEUHKAJVSP-UTKZUKDTSA-N 324.443 5.172 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 649956062 BOFPFUQNTJCWAV-JTDSTZFVSA-N 309.453 5.079 30 20 DKED CCCCCC[C@H](C)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 747194165 VQZAUNNWWZKZSP-KBPBESRZSA-N 306.475 5.049 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccc(C)c(F)c1 918723388 QLLRXLBWPNDIJF-UHFFFAOYSA-N 324.509 5.513 30 20 DKED O=C1/C(=C/c2ccsc2)CCc2nc(-c3ccccc3)sc21 60241334 ZTEKILQYPZDEOU-GXDHUFHOSA-N 323.442 5.084 30 20 DKED N#CCC[C@@H](Nc1nc(-c2ccccc2)cs1)c1ccccc1 301772164 GCDRSVFQFUFQSM-QGZVFWFLSA-N 319.433 5.267 30 20 DKED CC[C@@H](N[C@H](c1ccccc1)C1CCC1)c1ccc(C#N)cc1 447531395 PTKQGFWOVSUZRY-NHCUHLMSSA-N 304.437 5.140 30 20 DKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cccs3)s2)cc1 734303743 YEMFHECUCGZUIL-HJWRWDBZSA-N 311.431 5.076 30 20 DKED O=C(/C=C/c1cccc(F)c1)c1cc(Cl)sc1Cl 744868953 LYZWJLHJYXCZBI-SNAWJCMRSA-N 301.169 5.090 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)cc1 796966538 AYUJQJNTDWDQHX-KHPPLWFESA-N 323.392 5.154 30 20 DKED C=CCN(C(=O)c1ccc(-c2ccc(Cl)cc2)s1)C(C)C 915153731 UWTUQLAYWDSBIV-UHFFFAOYSA-N 319.857 5.105 30 20 DKED CC(C)c1occc1/C(O)=N/[C@H](C)c1nc(C(C)(C)C)cs1 331069759 BVOKTQPXFOQIDK-LLVKDONJSA-N 320.458 5.223 30 20 DKED C[C@@H](CCCC(F)(F)F)N[C@@H](CCCC#N)c1ccccc1 340445989 MLIVRNCPMRZAIS-HOCLYGCPSA-N 312.379 5.132 30 20 DKED CC(C)C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 537400346 XCMPREVWTRZBNH-YWZLYKJASA-N 310.416 5.135 30 20 DKED CCC[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc(C)cs1 733676532 ASRVIMLBKBLVPD-HOTGVXAUSA-N 318.486 5.015 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc(Cl)s2)s1 736433171 MOVXPRGXNJXNLV-SNAWJCMRSA-N 311.859 5.052 30 20 DKED CC(C)(C=NN(Cc1ccccc1)c1ccccc1)CCC#N 755465417 IFUPMJJEILSXRS-UHFFFAOYSA-N 305.425 5.009 30 20 DKED C#CCCCCC(=O)Nc1cc(Cl)ccc1-c1ccc(C)o1 794199988 REQUFQGDGRWDPE-UHFFFAOYSA-N 315.800 5.041 30 20 DKED N#Cc1ccc(CN[C@H](CC2CCCC2)c2ccccc2)s1 538426261 CNXJYNYBEQNVFE-LJQANCHMSA-N 310.466 5.031 30 20 DKED CC(C)C[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccs1 539608473 MRPBJDJDILUNOJ-SUMWQHHRSA-N 316.445 5.197 30 20 DKED CC(C)(C#N)CCCCN1CC2(CC=CC2)[C@@H]1c1ccccc1 592186037 ABGUCVOIRHBREA-IBGZPJMESA-N 308.469 5.100 30 20 DKED CC(C)CC1(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)CCCC1 756300918 RZMPGIKPKGRHQE-AWEZNQCLSA-N 318.486 5.049 30 20 DKED CC(C)c1ncc(/C=C/C(=O)c2ccc3cc(O)ccc3c2)s1 758434480 SDGIXGULNHLXQH-BQYQJAHWSA-N 323.417 5.021 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nccc2ccccc12 792093584 XTRAUXDJXOCFQK-QAPCUYQASA-N 308.425 5.018 30 20 DKED O=C(/C=C/c1cccc(O)c1)c1ccc(-c2ccc(F)cc2)s1 844255903 VKWOGHXMGSQBPF-RUDMXATFSA-N 324.376 5.156 30 20 DKED C=CCC1(C(=O)Nc2cc(-c3nc(C)co3)ccc2C)CCCC1 410576108 VLESDKBCJNMWPY-UHFFFAOYSA-N 324.424 5.033 30 20 DKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 574027229 HLSMESWSOVEXQU-NHYWBVRUSA-N 316.857 5.001 30 20 DKED CC(C)(C#N)c1ccc(CN[C@@H](c2ccccc2)C2CCC2)cc1 614174360 YRHKOVJWJDASEW-NRFANRHFSA-N 318.464 5.119 30 20 DKED CCCCCC[C@H](CC)C(=O)[C@H](C#N)c1ccc2ccccc2n1 735203180 CHFJKZNATMAATO-FUHWJXTLSA-N 322.452 5.408 30 20 DKED CCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 744016900 VNKJBLJTUKYUQN-WBVHZDCISA-N 308.425 5.018 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccs1 189886305 SVUSYXUJUDXMQW-UHFFFAOYSA-N 313.466 5.171 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@@H](C)c1ccc(C#N)cc1 463919871 NRNJRMNDBSBLHK-INIZCTEOSA-N 324.493 5.681 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](CC)C(C)C 476120693 LJJFVONVSREHQU-MRXNPFEDSA-N 301.474 5.549 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(C)cc1 505023160 JYRHBRBTGDNSPM-QGZVFWFLSA-N 322.452 5.339 30 20 DKED CC(C)(C#N)CCC[S@@](=O)c1ccc(C2CCCCC2)cc1 531341250 AGEVTKOJZFKRHP-JOCHJYFZSA-N 317.498 5.172 30 20 DKED CSc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 535837784 XVZAVRZZPMEFFR-UHFFFAOYSA-N 322.477 5.225 30 20 DKED Cc1cc(Sc2ccccc2)ccc1NC[C@@H](C#N)CCC#N 564864063 QGJQCKZATDCRMP-MRXNPFEDSA-N 321.449 5.002 30 20 DKED C[C@@H](Nc1ccc(F)cc1OC(C)(C)C)c1cccc(C#N)c1 600847100 GXAMZPUIUFQSPW-CYBMUJFWSA-N 312.388 5.048 30 20 DKED CCCCCCCCC(=O)N1CCCCC[C@H]1c1ccco1 736525843 JEJGWHOTMDRZCK-KRWDZBQOSA-N 305.462 5.474 30 20 DKED C[C@@H](Nc1ccc(F)cc1OCC#N)c1cccc2ccccc12 760217719 ZPMMLSKYCXOOJS-CQSZACIVSA-N 320.367 5.054 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1cnc(C2CC2)s1 761792641 FKWGVMGPYRFGPY-UHFFFAOYSA-N 319.433 5.193 30 20 DKED N#Cc1ccnc(SCc2sc3ccccc3c2Cl)c1 71918547 KWLNXKVOEDFJGD-UHFFFAOYSA-N 316.838 5.114 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC(C)(C)C)cc1 156835145 LQZQEPLBHOZCJY-CVEARBPZSA-N 322.452 5.147 30 20 DKED C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCC(C)(C)C#N 287691677 XCOZBQGZGUOMFB-QRQCRPRQSA-N 319.514 5.124 30 20 DKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1 358344683 XDYFMXUIXNESCI-OALUTQOASA-N 312.844 5.426 30 20 DKED CC(C)(C#N)CCCCN(Cc1ccco1)Cc1cccs1 444597752 OWEVGUQJPQTKIO-UHFFFAOYSA-N 316.470 5.063 30 20 DKED N#C[C@@H]1CCC[C@H](Nc2cccc(COC3CCCCC3)c2)C1 463287672 KIKSMALOUIONIE-AEFFLSMTSA-N 312.457 5.030 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C)cc1 475582929 UXFVXTGXRKCSJR-UHFFFAOYSA-N 322.452 5.169 30 20 DKED N#Cc1ccccc1CSCc1cc(Cl)cc2cccnc12 498111288 YSWRXOTWAMFTOT-UHFFFAOYSA-N 324.836 5.193 30 20 DKED CCSc1ccc([C@@H](C)N[C@H](CC)c2ccc(C#N)cc2)cc1 569432989 ZLIYYZKYDKRNCR-FOIQADDNSA-N 324.493 5.472 30 20 DKED C=CCCCCCN(C)Cc1csc(-c2ccsc2)n1 606902666 KWYJAACJNYNKOK-UHFFFAOYSA-N 306.500 5.050 30 20 DKED Cc1cc2cc([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)oc2cc1C 610829876 QMECMJAAGWSTNI-JKSUJKDBSA-N 318.420 5.333 30 20 DKED CSc1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 619622876 LQFDNDCLDINDSO-HNNXBMFYSA-N 324.493 5.060 30 20 DKED Cc1cc(/C=C\C(=O)c2ccccc2)ccc1Oc1cccnc1 732713616 IFMUAKWFBHDXDD-LUAWRHEFSA-N 315.372 5.078 30 20 DKED Cc1ccsc1/C=C/C(=O)c1cc(Cl)sc1Cl 744869343 XAIUHBYAXZVFLP-NSCUHMNNSA-N 303.235 5.321 30 20 DKED C[C@H](NCCCCC#N)c1ccc(-c2ccccc2Cl)s1 482446241 BXDAYEOOZWWZOJ-ZDUSSCGKSA-N 318.873 5.413 30 20 DKED C=CCCc1ccccc1NC(=O)C[C@H](C=C)c1ccccc1 410347792 DHSQPKWYJGTZFM-KRWDZBQOSA-N 305.421 5.104 30 20 DKED CC[C@H](Nc1ccc2nc(C3CC3)oc2c1)c1ccc(C#N)cc1 447601019 OMHUQCXZZUHKJI-KRWDZBQOSA-N 317.392 5.140 30 20 DKED CC(C)(C#N)CCCSCC1CCC(C(F)(F)F)CC1 471922591 VKSYMMUATJPOGV-UHFFFAOYSA-N 307.425 5.418 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2[nH]ccc2s1 477004076 WHGGGAHQOLYNPZ-UHFFFAOYSA-N 324.449 5.334 30 20 DKED Cc1cc(C)cc(CNc2ccccc2S[C@H](C)CC#N)c1 487353253 HYJMCTKHCPBVAF-MRXNPFEDSA-N 310.466 5.310 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1ccc(-c2cccs2)cc1 559888990 XOEJPJINSXBYPL-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CSc1cc(Cl)ccc1N[C@@H](C)c1cccc(C#N)c1 600852023 KGWKQGCSCJKORX-NSHDSACASA-N 302.830 5.107 30 20 DKED N#CCOc1ccc(CSc2c(Cl)cccc2Cl)cc1 729241868 GPPUAYGZQAAUOA-UHFFFAOYSA-N 324.232 5.188 30 20 DKED CCCCCCCCC(=O)N1CCC[C@H]1c1ccc(F)cc1 887738701 FYTNCILURIZYCP-SFHVURJKSA-N 305.437 5.240 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccsc1 91412084 LKDSDEHDMQKEOL-OAHLLOKOSA-N 318.445 5.138 30 20 DKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1 358340376 KUUPEDBUDSFKRD-RBUKOAKNSA-N 312.844 5.426 30 20 DKED CCCCn1c(SCCCCC(C)(C)C#N)nc(C)c1C 436206033 VHCWUVXAIIXWGI-UHFFFAOYSA-N 307.507 5.112 30 20 DKED CC(/C=C\c1ccc(C#N)cn1)=C\c1ccccc1C(F)(F)F 443442419 CRMNHQRDHLDVJZ-WLPHGBIISA-N 314.310 5.089 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 467118446 VXZAZMHPORZNBG-DLBZAZTESA-N 322.452 5.401 30 20 DKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc2ccccc2c1 512632249 YFQITNTZCNYBPD-HUUCEWRRSA-N 318.395 5.262 30 20 DKED C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1[C@H](C)CC 518826240 VILBHRCBCDPKDV-HUUCEWRRSA-N 305.487 5.227 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2c(s1)CCCC2 539048179 BOCHFUWWJUYQLX-QAPCUYQASA-N 324.493 5.323 30 20 DKED Cc1c(N[C@@H](C)c2cccc(C#N)c2)cccc1C(F)(F)F 600851470 ZYTXLFJDLMMCOU-LBPRGKRZSA-N 304.315 5.059 30 20 DKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccccc1Cl 741840255 LUMYIAFALXQQLP-VOTSOKGWSA-N 300.716 5.121 30 20 DKED O=C(/C=C/c1sccc1Cl)c1c(F)cccc1Cl 809159533 RCTHCOPLHCQPPR-SNAWJCMRSA-N 301.169 5.090 30 20 DKED Cc1cccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)c1 916153510 SAMQWRUSLSSWQH-KHPPLWFESA-N 305.402 5.015 30 20 DKED C=CCOc1ccc(CN[C@@H](c2ccccc2)C(C)(C)C)cc1 319862929 RKBJFDDMASXWGQ-FQEVSTJZSA-N 309.453 5.128 30 20 DKED CC[C@H](NCc1csc2ccccc12)c1ccc(C#N)cc1 447549010 IYKASYBXWSZEIO-SFHVURJKSA-N 306.434 5.014 30 20 DKED CC[C@H](N[C@H](C)c1ccccc1SC)c1ccc(C#N)cc1 503878691 YYURRVZFFPWYJZ-KDOFPFPSSA-N 310.466 5.082 30 20 DKED CC[C@@H](Nc1ccc(C)c(OC(F)F)c1)c1ccc(C#N)cc1 575473910 MZVWRNWYGZPDKX-MRXNPFEDSA-N 316.351 5.031 30 20 DKED C=CCCCCCN(C)C(=O)Nc1cccc(O[C@H](C)CC)c1 578472948 WGPHWGRVKQQTRH-MRXNPFEDSA-N 318.461 5.074 30 20 DKED C[C@H](NCCCCC#N)c1ccc(O[C@H](C)c2ccccc2)cc1 595009867 DRKWLKHBCIQAHU-ZWKOTPCHSA-N 322.452 5.171 30 20 DKED COCc1ccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1 741840416 TZZFCARGBMYFHA-TWGQIWQCSA-N 321.203 5.036 30 20 DKED N#Cc1ccc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cc1 746345713 JJDNROLDEINPMI-YPKPFQOOSA-N 309.368 5.121 30 20 DKED CC(C)(C)c1cnc(/C=C\C(=O)c2c(F)cccc2Cl)s1 809159821 XIXLFJYDTNWSJZ-FPLPWBNLSA-N 323.820 5.129 30 20 DKED C[C@@H](Nc1ccc(OC2CCCCC2)cc1)c1cccc(C#N)c1 863996203 QXFVOMZBRILXKV-MRXNPFEDSA-N 320.436 5.443 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1ccc(F)c(C(=O)O)c1 1776064988 PFWOQKSHTIJTHM-ZDUSSCGKSA-N 322.424 5.308 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1 182159285 OHVQHFUZZHSMFN-HRAATJIYSA-N 322.452 5.003 30 20 DKED C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1nc(C(C)(C)C)cs1 301300675 ZTXDDWGBHZPUFZ-SNVBAGLBSA-N 319.861 5.139 30 20 DKED N#CCCC[C@@H](NCC/C=C\c1ccccc1)c1ccccc1 451067472 XCASCRCYLHICPQ-YDTSGJJXSA-N 304.437 5.115 30 20 DKED C=CCCC[C@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 540326083 IASCICZOXHQYEJ-ROUUACIJSA-N 324.468 5.056 30 20 DKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1ccc(C#N)cc1 551353665 KUYVZVNKRYHAIB-GFCCVEGCSA-N 319.235 5.058 30 20 DKED C[C@@H](CCc1ccccc1)N[C@H](CCCC#N)c1ccccc1 559866091 UNDFQTWDWAXFMI-GHTZIAJQSA-N 306.453 5.032 30 20 DKED Cc1c(CSC(C)C)cccc1N[C@H](C#N)Cc1ccccc1 610294715 ZKAPZDARUREGCQ-IBGZPJMESA-N 324.493 5.183 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C\c1csc(-c3ccsc3)n1)C2 730948984 NOCSTZHQZSJDIS-ZSOIEALJSA-N 323.442 5.002 30 20 DKED Cc1ccsc1C(=O)/C=C\c1csc(-c2cccs2)n1 733749645 RNOSQNQCRYOBHG-PLNGDYQASA-N 317.460 5.138 30 20 DKED CC(C)OCc1cccc(N=Cc2c(O)ccc3ccccc23)c1 920479130 KVCNUKHKICPLOH-UHFFFAOYSA-N 319.404 5.221 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)[C@H]1C 191504849 LZNWYAGSGDMSRN-JKSUJKDBSA-N 314.473 5.191 30 20 DKED CC[C@H](NCc1ccc(C#N)cc1Cl)c1cccc(Cl)c1 439426754 BYCIOQHAYKFZTO-KRWDZBQOSA-N 319.235 5.106 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 466310503 YDXCVSGGMDSDBR-JGUBBDCWSA-N 317.498 5.135 30 20 DKED C/C=C\c1ccc(N[C@@H](CCC#N)c2ccc(OC)cc2)cc1 562055557 FATBVXDQDVYCGU-BOYDRYHPSA-N 306.409 5.185 30 20 DKED C=CC[C@@H](N[C@@H](C)c1ccc(OCC(C)C)cc1)c1ccncc1 766018156 GETHOKUVJQRLBW-LAUBAEHRSA-N 324.468 5.084 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2[nH]1 926481565 UUQRBMFIKVNZHD-APWZRJJASA-N 317.436 5.254 30 20 DKED N#Cc1ccccc1SCc1csc(-c2ccsc2)n1 173722139 LHLOKLOFVAUCTM-UHFFFAOYSA-N 314.460 5.036 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccccc1C 191466649 SCXGODLOCOCMDB-UHFFFAOYSA-N 308.425 5.491 30 20 DKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C(C)C)cc1 1776783958 BTQMHTXZEAJJJP-IBGZPJMESA-N 319.489 5.103 30 20 DKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc2ccccc2c1 69124495 WMGSYDKRJJSJFT-XYOKQWHBSA-N 309.368 5.284 30 20 DKED C[C@H](SCc1cc(F)cc2cccnc12)c1ccc(C#N)cc1 345155338 ULSUIIIFGBXIKL-ZDUSSCGKSA-N 322.408 5.240 30 20 DKED CC[C@@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1 447522960 RNUZBWDZKUECSK-OPAMFIHVSA-N 314.432 5.513 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1CCC 466340722 WXTKPDUUNDODTH-UHFFFAOYSA-N 311.425 5.336 30 20 DKED C=CCC[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccco1 513692069 YEMFQHPTJSOZDV-CVEARBPZSA-N 317.429 5.253 30 20 DKED C[C@@H](N[C@@H](C#N)c1ccc(Cl)cc1)c1cc2ccccc2o1 585719291 MCODBDUCIFBYGX-WBMJQRKESA-N 310.784 5.002 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(SC(C)(C)C)cc1 729568675 ZIKDDYFLDUMIMV-UHFFFAOYSA-N 306.475 5.007 30 20 DKED C=CCCCCCN(C)Cn1ccc(=S)c2ccccc21 739887293 MLFUPHNGKGIFHS-UHFFFAOYSA-N 300.471 5.006 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(CC)cc1 794996882 WYPCQAHFSOXPGA-UHFFFAOYSA-N 324.493 5.024 30 20 DKED C=CCC[C@H](N[C@H]1CCc2nc(Cl)ccc21)c1ccccc1 806149308 RJLLGEXRSAQTKU-IRXDYDNUSA-N 312.844 5.019 30 20 DKED C=CCN(C)C(=O)Nc1ccc(SC2CCCCC2)cc1C 429363785 PSRFQUZJESPZCK-UHFFFAOYSA-N 318.486 5.070 30 20 DKED CCc1cccc(CNc2ccccc2SC[C@@H](C)C#N)c1 469126785 UKIALCOEWUVPIA-HNNXBMFYSA-N 310.466 5.113 30 20 DKED CSc1ccccc1[C@@H](C)NCc1ccc(C(C)(C)C#N)cc1 619722657 ABLCMWPHKWDSCO-OAHLLOKOSA-N 324.493 5.060 30 20 DKED Cc1ncccc1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 728786456 YCCJIBQIZJDABS-TWGQIWQCSA-N 323.392 5.154 30 20 DKED C=CC[C@@H](C)NCc1sc(Sc2ccccc2)nc1Cl 735085952 KLVVNRNKARIZNV-LLVKDONJSA-N 324.902 5.002 30 20 DKED CCCCCC[C@](C)(CC)C(=O)Nc1ccc(CC#N)cc1 742490683 XSISHYQIHOJHLZ-IBGZPJMESA-N 300.446 5.078 30 20 DKED Cc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)s1 745990514 RMYPZUPZKXJTPC-HJWRWDBZSA-N 305.402 5.015 30 20 DKED CCCCCCCCCCC(C)(C)C(=O)N1CCC(C#N)CC1 755792441 UDSPXEXPMHUBJO-UHFFFAOYSA-N 320.521 5.306 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccsc1 789720446 LDUMNIBOBPXAFX-MDZDMXLPSA-N 311.450 5.252 30 20 DKED C[C@H](Nc1cccc(SC(F)(F)F)c1)c1cccc(C#N)c1 864021438 LIQLQBLYINBHHE-NSHDSACASA-N 322.355 5.343 30 20 DKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccccc1 33372062 CARWTLHYUZGUDZ-SEYXRHQNSA-N 305.402 5.015 30 20 DKED N#CCC[C@@H](NCc1cc(Cl)ccc1Cl)c1ccccc1 338220581 ZOXARDNUZBPEHW-QGZVFWFLSA-N 319.235 5.128 30 20 DKED C=CCC[C@@H](N[C@@H](CC)c1ccc(C#N)cc1)c1ccccc1 447589610 YOCMKPLJPRKMAC-LEWJYISDSA-N 304.437 5.306 30 20 DKED CCOc1cccc2cc([C@H](C)Nc3ccc(F)cc3C#N)oc12 462928770 KMLNZSFTGPGFBZ-LBPRGKRZSA-N 324.355 5.015 30 20 DKED C[C@H](NCCCCC#N)c1ccc(SC2CCCC2)cc1 482436152 ISENGBNPSZSNNW-HNNXBMFYSA-N 302.487 5.066 30 20 DKED CC(C)C[C@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 520924076 HTDIEEZYBDRLMT-LSDHHAIUSA-N 318.486 5.092 30 20 DKED CC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)s1 537407763 ZUJDUJPDIABUGI-IINYFYTJSA-N 322.836 5.214 30 20 DKED C[C@H](NCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541091130 ZYTIQSYIGSZEKG-HNNXBMFYSA-N 318.445 5.138 30 20 DKED CC[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)s1 618802370 JBHWOGTVGPIAGP-LSDHHAIUSA-N 316.857 5.001 30 20 DKED O=C(/C=C/c1ccc(-c2c(F)cccc2F)o1)c1cccs1 734366503 UTAHACZGRLIGEI-SOFGYWHQSA-N 316.328 5.182 30 20 DKED Cc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1F 741471954 DDLGFDVXQPDQNK-BQYQJAHWSA-N 317.363 5.092 30 20 DKED CC(/C=C\C1=C(C)CCCC1(C)C)=NNc1ccc(Cl)nn1 751396953 LUJSDZBBUSJNDN-GBSZGTARSA-N 318.852 5.001 30 20 DKED CC(C)C[C@H](NCc1cc(C#N)cs1)c1ccc(Cl)cc1 236645805 OXRKCBCBZCEILJ-KRWDZBQOSA-N 318.873 5.150 30 20 DKED C[C@H](S[C@H](C)c1cccc(C#N)c1)c1cccc([N+](=O)[O-])c1 443159503 AUIWOPDHKKVXFE-OLZOCXBDSA-N 312.394 5.022 30 20 DKED COc1ccccc1[C@@H](CC(C)C)NCCCCC(C)(C)C#N 444675935 OSEJJBPXOLBLMG-GOSISDBHSA-N 316.489 5.092 30 20 DKED CC[C@@H](NCC(C)(C)CCC#N)c1ccc2cc(OC)ccc2c1 580360960 GZWMLWFYAHIQTI-HXUWFJFHSA-N 324.468 5.219 30 20 DKED CC[C@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1 618572656 BNJDGOMBEMAUEM-FQEVSTJZSA-N 322.452 5.437 30 20 DKED COc1ccc2oc(C(=O)/C=C/c3sccc3C)c(C)c2c1 729150821 MWWZJKXUUFINIP-FNORWQNLSA-N 312.390 5.016 30 20 DKED CC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc(C)ccc1C 858377060 UVLGZZFICQLNLB-UTKZUKDTSA-N 322.452 5.008 30 20 DKED C[C@H](C#N)CSc1ccccc1NCCCCC(F)(F)F 151920643 XEXRAWCSFSSKQG-GFCCVEGCSA-N 316.392 5.083 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1 189897672 WXHQFIPJRKLDPR-UHFFFAOYSA-N 307.437 5.110 30 20 DKED CCCCCCCCc1ccc(-c2cc3ccccc3o2)cc1 222669021 UXYGOQDNMZCMNV-UHFFFAOYSA-N 306.449 7.003 30 20 DKED N#CCC[C@@H](NCc1c(Cl)oc2ccccc12)c1ccccc1 341518368 XFZMRWOZNKDIAF-QGZVFWFLSA-N 324.811 5.221 30 20 DKED CCCCCCCCCC(=O)N(C)[C@@H](C)c1sc(C)nc1C 730202248 JFZZFDWPCAYHKA-HNNXBMFYSA-N 324.534 5.420 30 20 DKED C#CC[C@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccccc1 773117378 VPIQOZUNDLOYTP-KDOFPFPSSA-N 317.354 5.121 30 20 DKED C=CC[C@H](N[C@H](CC)c1sccc1Cl)c1ccncc1 883190253 YOHYFMZZONDGCD-CABCVRRESA-N 306.862 5.155 30 20 DKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)C1CCCCC1 916286484 IHPAVUWUSJLOBN-UHFFFAOYSA-N 319.758 5.122 30 20 DKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc2ccccc2[nH]1 925755376 NKGVRPKBMCQFER-HNNXBMFYSA-N 319.408 5.024 30 20 DKED C=C(C)[C@@H](N[C@H](CC)c1ccccc1O)c1ccc(F)c(F)c1 186446369 XWEJQKNIZUWXII-IEBWSBKVSA-N 317.379 5.029 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H](C)C1 191453195 XEAOFPGWKNLRGS-HZPDHXFCSA-N 314.473 5.048 30 20 DKED CC[C@H](N[C@H](C)c1cc2cccc(F)c2o1)c1ccc(C#N)cc1 447596095 PNMQBKOPFOGSKK-ACJLOTCBSA-N 322.383 5.245 30 20 DKED C=CCCCCNC(=O)Nc1c(CC=C)cccc1C(C)C 475550106 NTEICODQOPIJRA-UHFFFAOYSA-N 300.446 5.016 30 20 DKED CC(C)(C#N)CCSCc1csc(-c2ccccc2F)n1 554705912 CSDCERIPISGJHB-UHFFFAOYSA-N 320.458 5.122 30 20 DKED O=C(/C=C\c1cccc(F)c1F)c1cc(Cl)sc1Cl 730729105 DVWAWIWCZBFQOQ-PLNGDYQASA-N 319.159 5.229 30 20 DKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccc(Cl)s1 741840053 DFBZOEVVOHTXFZ-IHWYPQMZSA-N 306.745 5.183 30 20 DKED CCCCCCCCCN(C)C(=O)Nc1scnc1C1CC1 762977624 QQTWAYBHTNWYGL-UHFFFAOYSA-N 323.506 5.235 30 20 DKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1csc(Cl)c1 789146594 ADSGATGDSIQOKR-ARJAWSKDSA-N 321.810 5.014 30 20 DKED CSc1ccc(C(=O)/C=C\c2ncc(C(C)(C)C)s2)cc1 790603920 PMINEXNTBIHGJH-KTKRTIGZSA-N 317.479 5.059 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCc1ccccc1Cl 109002260 NTLFTQFFQVVJHQ-CYBMUJFWSA-N 316.857 5.346 30 20 DKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)c1cccc(C#N)c1 181725023 HTYDPMYPTXUOKR-ZIAGYGMSSA-N 306.434 5.185 30 20 DKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc(Cl)c1 417375579 ZGTVMEFLTMRFRK-ZBEGNZNMSA-N 316.857 5.001 30 20 DKED CC(C)(C#N)CCSCc1cc(-c2ccccc2Cl)on1 419474718 LSXJVGYXFXPELX-UHFFFAOYSA-N 320.845 5.168 30 20 DKED C=CCC[C@H](NCc1ccn(C(CC)CC)n1)c1ccccc1 537157591 NVJLRKSQIIIDNP-FQEVSTJZSA-N 311.473 5.041 30 20 DKED CC(C)(C#N)CCN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 537362546 GOJGBJNMLVYAJH-OAHLLOKOSA-N 311.256 5.070 30 20 DKED CC(CSC(C)(C)C)=NNc1nc(-c2ccccc2)cs1 729635241 JUTRENHRBRMTFK-UHFFFAOYSA-N 319.499 5.130 30 20 DKED O=C(/C=C\c1ccc(F)nc1)c1cc2c(ccc3ccccc32)o1 777465780 HZESVVSYJURNNV-YVMONPNESA-N 317.319 5.016 30 20 DKED C[C@H]1/C(=C\c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 809156332 LCPLSGZHVAODIW-BTAWCLGRSA-N 323.442 5.255 30 20 DKED O=C(/C=C\c1csc2ccccc12)c1cc(F)ccc1F 810231563 FVARYIMNDRTBNB-YVMONPNESA-N 300.329 5.076 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(Cl)nc1)c1ccccc1 181508184 NJWJVGOARZAMSQ-PBHICJAKSA-N 300.833 5.093 30 20 DKED COc1ccc(C)cc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 340457868 WLFMPAREOADLEZ-XLIONFOSSA-N 322.452 5.089 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccsc1C 476093559 WYPHAPFHMHXKCL-UHFFFAOYSA-N 313.466 5.090 30 20 DKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)c1ccc(C#N)c(F)c1 525955992 LGKLNVCLRMOOII-CHWSQXEVSA-N 324.424 5.324 30 20 DKED Cc1cc(C)c(CN[C@H](CCCC#N)c2ccccc2)cc1C 570620408 RKPAIKFDPDDVMT-OAQYLSRUSA-N 306.453 5.137 30 20 DKED C[C@@H](CCc1ccc(F)cc1)N[C@H](CCCC#N)c1ccccc1 577271093 UYYBSGOVDNEYLC-LAUBAEHRSA-N 324.443 5.172 30 20 DKED CCC[C@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748618317 HFSMZWGJJKJTET-OXJNMPFZSA-N 320.436 5.107 30 20 DKED CCC/C(C)=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 920322879 BZABHIBBFLJUOE-DKGMDFAASA-N 324.449 5.041 30 20 DKED Cc1nc(C(F)(F)F)c(CSCCCC(C)(C)C#N)s1 184527505 WTSBQMLURNDGIQ-UHFFFAOYSA-N 322.421 5.034 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(C)c1 189900881 LPBGGLBAGHYFCH-UHFFFAOYSA-N 311.400 5.238 30 20 DKED N#CCCC[C@@H](NCCCCc1ccccc1)c1ccccc1 433019198 MAMIWRCEKWOWHE-OAQYLSRUSA-N 306.453 5.034 30 20 DKED C[C@@H](SCc1nc2ccccc2s1)c1cccc(C#N)c1 443141741 MNSXJVFDBXRFIL-GFCCVEGCSA-N 310.447 5.162 30 20 DKED CC(=C/c1ccccc1C(F)(F)F)/C=C/c1ccc(C#N)cn1 443442412 CRMNHQRDHLDVJZ-DEOSACLMSA-N 314.310 5.089 30 20 DKED Cc1c(CSC(C)C)cccc1NCc1ccc(C#N)cc1 462171691 PZTWBANQRWBLFK-UHFFFAOYSA-N 310.466 5.120 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O)cc1C 475556965 VKAXJIJKDRCPMO-UHFFFAOYSA-N 324.424 5.197 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(C)cc1 476165384 SWXKFQRWHDYASI-UHFFFAOYSA-N 321.464 5.418 30 20 DKED Cc1cccc(C)c1CNc1ccccc1S[C@@H](C)CC#N 523127676 XQZVUEGAYIUEJY-INIZCTEOSA-N 310.466 5.310 30 20 DKED CC(C)[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 538393604 BNFHARBHEGXQGP-AUUYWEPGSA-N 312.844 5.260 30 20 DKED C#CC[C@@H](N[C@H](C)c1oc2ccccc2c1C)c1ccccc1 773115131 LRLTXZHZBPCVHO-VQIMIIECSA-N 303.405 5.156 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1cccc2ccccc12 782301359 LKKIUDHKLHZTSC-KHPPLWFESA-N 305.402 5.070 30 20 DKED Cc1nc(SCC2(C#N)CCCC2)n(C2CCCCC2)c1C 806586353 XJEAVVOBBZHPQB-UHFFFAOYSA-N 317.502 5.181 30 20 DKED Cc1ccccc1C(=O)/C=C\c1csc(-c2ccccc2)n1 916155834 FLILYEMYGAIKSA-QXMHVHEDSA-N 305.402 5.015 30 20 DKED C[C@@H](C=NNc1ccc(Cl)c(C(=O)O)c1)CC1CCCCC1 1776033613 IMBDEEXBEIRXTQ-GFCCVEGCSA-N 322.836 5.042 30 20 DKED Cc1c([C@@H](C)N[C@H](C)c2cccc(C#N)c2)oc2ccccc12 178176806 JQDTVNLYJCSVIM-HUUCEWRRSA-N 304.393 5.025 30 20 DKED CC[C@@H](Nc1cccc(COCC2CC2)c1)c1ccc(C#N)cc1 447579095 IYXPVLXIMOMEIX-OAQYLSRUSA-N 320.436 5.048 30 20 DKED CC(C)(C)OCCCCSCc1ccc(C#N)cc1Cl 473780009 HMLGVOWCHVZAPT-UHFFFAOYSA-N 311.878 5.040 30 20 DKED Cc1ncccc1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 728786493 ZXCHVEWUXBJMNB-CMDGGOBGSA-N 323.392 5.154 30 20 DKED CCCCCCCCCCC(=O)N1CCC[C@H]1c1ccncc1 915698569 HAAHALKBBBNPEE-IBGZPJMESA-N 316.489 5.276 30 20 DKED C=CCN(C(=O)Nc1ccc(SC2CCCC2)cc1)C(C)C 916707906 ATCGXSJDNKTFHM-UHFFFAOYSA-N 318.486 5.150 30 20 DKED Cc1cccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)c1 210709554 ARLPSQPZPDNRKB-WAYWQWQTSA-N 311.431 5.076 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(C3CCC3)c2)n1 546678072 HZBPSRISHIWLJU-MRXNPFEDSA-N 324.449 5.024 30 20 DKED C=CCCCCCN(C)[C@H](C)c1nc2ccccc2n1C(F)F 579767774 YIXDAILXDLQHBS-CQSZACIVSA-N 321.415 5.171 30 20 DKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(-c2ccccc2)cc1 237477153 JXUZZCWHSJQVEW-QGZVFWFLSA-N 312.416 5.076 30 20 DKED C=C(C)[C@H](N[C@@H](C)CCCC(F)(F)F)c1ccc(F)c(F)c1 480669016 NXADLOAJXOAQQM-NHYWBVRUSA-N 321.333 5.293 30 20 DKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1cccc(C)c1)c1ccccc1 535367143 DLQTZGPHHXSCCA-WIYYLYMNSA-N 319.448 5.018 30 20 DKED C[C@@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1ccc(C#N)cc1 540596817 JFWHSXLOZHVJSF-CHWSQXEVSA-N 324.811 5.370 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(F)c2ccccc12 561787726 OWADIFZDZDNAAY-OAHLLOKOSA-N 312.432 5.350 30 20 DKED C=CCC[C@@H](NCc1csc(C(F)(F)F)c1)c1ccco1 624261063 GYTMUJBNBXVXFV-GFCCVEGCSA-N 315.360 5.157 30 20 DKED CO[C@@H](C)c1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 726893448 ZYCWCVRSACDQPN-JTQLQIEISA-N 324.207 5.157 30 20 DKED Cc1ccsc1C(=O)/C=C/c1cccc(-c2cccnc2)c1 768490099 MQMMZZPJKUDBOX-BQYQJAHWSA-N 305.402 5.015 30 20 DKED COc1cc(C(=O)/C=C/c2cscc2Cl)ccc1SC 771860948 TYLXFXPPIMZXIX-HWKANZROSA-N 324.854 5.028 30 20 DKED N#Cc1ccc(C(=O)/C=C/c2ccc(C(F)F)cc2)c(Cl)c1 794949959 RPWYPOWXXUYBSH-XBXARRHUSA-N 317.722 5.045 30 20 DKED C[C@@H](Nc1ccc2oc3ccccc3c2c1)c1cccc(C#N)c1 324273571 ZBEVUNYITZFAKK-CQSZACIVSA-N 312.372 5.631 30 20 DKED C[C@H](S[C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C#N)c1 443162713 SWLPEMAVCUHMMW-STQMWFEESA-N 312.394 5.022 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1cccc(Cl)c1 447542047 HZAXFSMKABBRBN-MOPGFXCFSA-N 312.844 5.404 30 20 DKED C[C@H](Nc1ccc(CC#N)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 474937501 VOAAOSJVHZBMFQ-TUKIKUTGSA-N 316.857 5.072 30 20 DKED C=C[C@@H]1CCCCN1C(=O)Nc1c(C(C)C)cccc1C(C)C 486780014 PWAGPIHZJLAOSW-MRXNPFEDSA-N 314.473 5.506 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C1CCCC1)c1cccc(C#N)c1 539500196 UBTSMRXQQYMODX-IERDGZPVSA-N 304.437 5.140 30 20 DKED CC(C)C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccs1 619755878 XDMKFONYAUVVJJ-MRXNPFEDSA-N 318.873 5.150 30 20 DKED COc1c(Cl)cc(N[C@H](C)c2ccc(C#N)cc2)cc1Cl 777671488 NVGSXSMIOBWURD-SNVBAGLBSA-N 321.207 5.047 30 20 DKED COc1cc(C(=O)/C=C\c2cc(Cl)cs2)ccc1SC 782325775 CRWVXUQOIMMYCI-PLNGDYQASA-N 324.854 5.028 30 20 DKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc2cnccc2c1 782342626 QLHGBGGFFLRNEL-UJFYRASASA-N 323.442 5.057 30 20 DKED C=CCCc1ccccc1NC(=O)CCCSC(C)(C)C 800158034 MEBWQZYTWVONRR-UHFFFAOYSA-N 305.487 5.056 30 20 DKED C=CCCc1ccccc1NC(=O)[C@@H](CC=C)c1ccccc1 410347015 XZAUXGUZGGIZRH-IBGZPJMESA-N 305.421 5.104 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1cccs1 417348782 JORKPFPOBJHUHR-GDAAHCPNSA-N 324.493 5.265 30 20 DKED N#CCC[C@H](Nc1ccc2ccc(Cl)cc2n1)c1ccccc1 480447681 VXJLBOJVINSVPM-KRWDZBQOSA-N 321.811 5.345 30 20 DKED N#Cc1ccccc1-c1ccc(CN[C@@H]2CCc3ccccc32)cc1 538113910 QSSODUREFNDHTO-HSZRJFAPSA-N 324.427 5.002 30 20 DKED C=CCCO[C@H](C)c1nc(-c2ccc(-c3ccccc3)cc2)no1 580969760 FQYVRTKFQPBYFX-OAHLLOKOSA-N 320.392 5.057 30 20 DKED N#Cc1ccc(/C=C/c2ccc(-c3ccc(Cl)cc3)o2)nc1 603893992 OAANYCCFHLZYEC-BQYQJAHWSA-N 306.752 5.037 30 20 DKED CCCCCC[C@H](C)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 744015247 KSICKBYUZGCBFX-RDJZCZTQSA-N 308.425 5.018 30 20 DKED C[C@H](c1cccc(Cl)c1)[S@@](=O)CCCCC1(C#N)CCC1 899396403 DPCDHGKYKWINMN-SZNDQCEHSA-N 323.889 5.014 30 20 DKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1cccc2ccccc12 921261876 WBMPGNMACYFKCN-CSKARUKUSA-N 308.764 5.095 30 20 DKED C[C@H](Nc1ccc(OC2CCCC2)cc1)c1ccc(C#N)cc1 97393646 BYBLCGXPLYVUCC-HNNXBMFYSA-N 306.409 5.053 30 20 DKED N#CCC[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 130608486 CGQHTYAUWVDFNU-HXUWFJFHSA-N 316.404 5.081 30 20 DKED OC(=Nc1ccccc1-c1cn[nH]c1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 329550547 CQVQYPNTYWJJIB-OWCLPIDISA-N 323.440 5.271 30 20 DKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(C2CC2)c1 340308472 FHGRQGRDNQXTNL-KKSFZXQISA-N 304.437 5.260 30 20 DKED C=CCC[C@H](NCc1ncc(C(C)(C)C)s1)c1ccccc1 447899135 QPSLXQHUADYYFO-INIZCTEOSA-N 314.498 5.238 30 20 DKED N#Cc1ccc2c(c1)[C@H](N[C@@H](CC1CCC1)c1ccccc1)CC2 564433759 VYGYIXOAIDJVMT-YADHBBJMSA-N 316.448 5.067 30 20 DKED C=CCOc1ccc(CN[C@@H](CC(C)C)c2cccs2)cc1 616029131 NVTPAEDIBULVDJ-SFHVURJKSA-N 315.482 5.190 30 20 DKED CC(C)(c1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1)C(F)(F)F 618577830 LOXHIDDRLUYIDF-WFASDCNBSA-N 310.363 5.021 30 20 DKED C=CCC[C@@H](N[C@@H]1CCc2ccc(Cl)nc21)c1ccccc1 788673805 YHGLOMYPOIAHTQ-IAGOWNOFSA-N 312.844 5.019 30 20 DKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC)cc1 340429789 DTTGFIVHWRFMCK-LEWJYISDSA-N 322.452 5.171 30 20 DKED C[C@H](Oc1ccc([C@@H](C)NCCCCC#N)cc1)c1ccccc1 595009864 DRKWLKHBCIQAHU-MSOLQXFVSA-N 322.452 5.171 30 20 DKED Cc1cccc(/C=C/C(=O)c2sccc2Br)c1C 731156784 LXWRBNZHERDLIS-VOTSOKGWSA-N 321.239 5.024 30 20 DKED COc1ccc2cc([C@@H](C)Nc3ccc(CC#N)cc3)ccc2c1 78991396 DTZKOFRQWAVYDS-OAHLLOKOSA-N 316.404 5.088 30 20 DKED Cc1cc(C)cc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1 321918369 ANEDEEQDQDRCPO-QGZVFWFLSA-N 308.425 5.159 30 20 DKED N#CCCC[C@@H](NCc1ccc(C2CC2)cc1)c1ccccc1 459598519 WTWLDXKUICFONE-OAQYLSRUSA-N 304.437 5.089 30 20 DKED C=CCSc1ccccc1C(=O)Nc1ccc(F)cc1Cl 485745612 AYJGLCOESCEEAU-UHFFFAOYSA-N 321.804 5.010 30 20 DKED CC(C)(C#N)CCCNC1(c2cccc(Cl)c2)CCCC1 537122319 OACJCFOQOKKKDG-UHFFFAOYSA-N 304.865 5.029 30 20 DKED C[C@H](N[C@@H](c1cccc(F)c1)C(C)(C)C)c1cccc(C#N)c1 539496864 NFGAMXWXWYRXNU-LIRRHRJNSA-N 310.416 5.135 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCCCc1ccsc1 541168142 FNFIKQXEGGAEIE-AWEZNQCLSA-N 316.495 5.045 30 20 DKED N#Cc1ccc(SCc2ccc3ncccc3c2)c(Cl)c1 547434692 MPWWQNPRZLRFKC-UHFFFAOYSA-N 310.809 5.052 30 20 DKED CC[C@@H](Nc1ccc2cnn(C(C)C)c2c1)c1ccc(C#N)cc1 575867723 UCMCBIFETOMDNU-LJQANCHMSA-N 318.424 5.052 30 20 DKED C[C@@H](S[C@H](C)c1ccc(F)cc1F)c1ccc(C#N)cc1 609825728 PWZKLXZNAGNWBA-VXGBXAGGSA-N 303.377 5.392 30 20 DKED C=C(CN[C@@H](C)[C@@H](C)c1nc2ccccc2s1)c1ccccc1 675783600 MBOAAGDVPGMTIF-CVEARBPZSA-N 322.477 5.091 30 20 DKED C#CC[C@H](N[C@@H](C)c1cc2ccccc2s1)c1ccccc1 783258405 HVZFNDMSIAGLQU-YJBOKZPZSA-N 305.446 5.317 30 20 DKED N#CCCC[C@@H](N[C@H]1CCSc2ccccc21)c1ccccc1 340428909 CCRFRKVAAORIPZ-MOPGFXCFSA-N 322.477 5.248 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2ccccc2)cc1C 597359189 KNEBJGCECLKSAI-UHFFFAOYSA-N 324.424 5.217 30 20 DKED CCc1c([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)oc2ccccc12 611438284 CQOFIUSBGBTHGB-LSDHHAIUSA-N 318.420 5.279 30 20 DKED O=C(/C=C/c1cccc(-c2cccnc2)c1)c1c[nH]c2ccccc12 768496288 SOGBIPPKPXZIHV-ZHACJKMWSA-N 324.383 5.126 30 20 DKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cccs1 33372053 WLMGZTKXNRAXNJ-KTKRTIGZSA-N 311.431 5.076 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1cccc(Cl)c1Cl 444683348 GAGYIDRTDFZYJL-GFCCVEGCSA-N 313.272 5.364 30 20 DKED N#C[C@H]1CCC[C@@H](Nc2ccccc2SC2CCCC2)C1 463288679 NQANDYIXSRNJBX-LSDHHAIUSA-N 300.471 5.216 30 20 DKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc2ccccc12 618806915 SKYPMXGNFAZVLM-QRQCRPRQSA-N 312.416 5.050 30 20 DKED O=C(/C=C\c1nccc2ccccc12)c1ccc2ccccc2c1 740764164 MZKSOUDVJFFEHQ-QXMHVHEDSA-N 309.368 5.284 30 20 DKED N#Cc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cc1 747188033 GEAYNJFVCMRPSS-KHPPLWFESA-N 315.397 5.183 30 20 DKED CCCCCCCCC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 914509164 DVKCGUGPSKEJBT-KRWDZBQOSA-N 314.473 5.218 30 20 DKED N#CCC[C@@H](Nc1ccnc2cc(Cl)ccc12)c1ccccc1 301785574 LJQYDZGRENGYLU-QGZVFWFLSA-N 321.811 5.345 30 20 DKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1ccccc1)C1CC1 481664650 HGMWYHNXXXSQNX-VXKWHMMOSA-N 316.448 5.067 30 20 DKED C[C@H](NCc1ccc(C2CCCC2)cc1)c1ccc(C#N)cc1 576069597 UANZVMZYLSRFSA-INIZCTEOSA-N 304.437 5.067 30 20 DKED Cc1nc(-c2ccccc2N[C@@H](C)c2cccc(C#N)c2)cs1 600853788 FGWWPFRFOJKPAA-ZDUSSCGKSA-N 319.433 5.163 30 20 DKED O=C(/C=C\c1csc(-c2cccs2)n1)C1CCCCC1 728438945 CSMVPRYLGIFREX-HJWRWDBZSA-N 303.452 5.034 30 20 DKED CCOc1c(Cl)cc(NCCCC(C)(C)C#N)cc1Cl 767639429 COGQVVZNUMVMJK-UHFFFAOYSA-N 315.244 5.134 30 20 DKED Cc1noc(C)c1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 916131928 NQZFQXCIENNIBK-HJWRWDBZSA-N 317.344 5.087 30 20 DKED N#CCCSc1ccccc1NCc1ccc(F)cc1Cl 184335390 HHGYTDPRVPGQDB-UHFFFAOYSA-N 320.820 5.097 30 20 DKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1cccc(C#N)c1 538396673 XVESLENQHQLYGT-JLTOFOAXSA-N 324.855 5.404 30 20 DKED CC(C)(C#N)CCCCSC1=Nc2ccccc2CS1 767047255 PIUHRVKNSLOKDO-UHFFFAOYSA-N 304.484 5.374 30 20 DKED Cc1ccsc1C(=O)/C=C/c1ncc(-c2ccccc2)s1 770571834 JSFGRNDYJHGTAF-BQYQJAHWSA-N 311.431 5.076 30 20 DKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(F)ccc1F 90665048 WYROQJWSMBVVCE-RTBURBONSA-N 314.379 5.051 30 20 DKED C[C@@H](Sc1ccc(C#N)cc1)c1ccc(OC(F)F)cc1 108964825 PYZPPSXYYJUWNA-LLVKDONJSA-N 305.349 5.013 30 20 DKED C[C@@H](C#N)Oc1ccccc1N[C@H](C)c1ccc2ccccc2c1 182260523 WCPAKKPIBRAXSP-JKSUJKDBSA-N 316.404 5.304 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C1(C)CC1 191420532 ZVGHEBNECZJJHY-OAHLLOKOSA-N 314.473 5.191 30 20 DKED C[C@H](CSCCCCC#N)c1ccc(C(F)(F)F)cc1 409880035 NNMRWWAAWZTUMV-GFCCVEGCSA-N 301.377 5.236 30 20 DKED CC[C@@H](N[C@@H](c1ccccc1)C1CCC1)c1ccc(C#N)cc1 447531496 PTKQGFWOVSUZRY-RTWAWAEBSA-N 304.437 5.140 30 20 DKED CCSc1ccc(Cl)cc1NCc1ccc(C#N)cc1F 609221113 UOPGHZYLQBFARY-UHFFFAOYSA-N 320.820 5.075 30 20 DKED CCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nccc2ccccc12 792093582 XTRAUXDJXOCFQK-MAUKXSAKSA-N 308.425 5.018 30 20 DKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1nccc2ccccc12 792106443 QRUPHTHWHTWYPZ-QAPCUYQASA-N 308.425 5.018 30 20 DKED C=CCC[C@H](Nc1ccc(OC)c(OC(C)C)c1)c1ccco1 796935348 CMQCTFKXQFFBPE-INIZCTEOSA-N 315.413 5.195 30 20 DKED C[C@@H](Nc1ccc(COC(C)(C)C)cc1)c1ccc(C#N)cc1 83988659 IFCOIEKGJLNKFV-OAHLLOKOSA-N 308.425 5.046 30 20 DKED CC(C)COc1ccc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)cc1 325107324 AXCXPRUHPUORAZ-IAGOWNOFSA-N 322.452 5.005 30 20 DKED CC(C)(C#N)CCSc1ccc(Cl)c(C(F)(F)F)c1 463042349 JLUJWIOBQOQFRL-UHFFFAOYSA-N 307.768 5.391 30 20 DKED CC(C)c1ccc(C[S@](=O)CCC(C)(C)C#N)c(C(C)C)c1 616181883 JAVYMSCYCMUEGQ-JOCHJYFZSA-N 319.514 5.122 30 20 DKED CCCCCCCCC(=O)N[C@H](c1ccccc1)c1cccnc1 728492700 VGQQRSAWOWLHNX-OAQYLSRUSA-N 324.468 5.038 30 20 DKED CCCCCCCC(=O)Nc1ccc(Oc2ccncc2)cc1 747680446 KZMYLNSGSQWFAA-UHFFFAOYSA-N 312.413 5.173 30 20 DKED CC(C)(C#N)c1ccc(CNc2ccc3ccccc3c2)cc1 774280439 ZZZILRVYJLZMQK-UHFFFAOYSA-N 300.405 5.253 30 20 DKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1C(C)C 1776787045 LQKQJWGDPKWPAA-GOSISDBHSA-N 319.489 5.103 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccn1C(C)C 188059868 NLOGVWMPEQQAFY-UHFFFAOYSA-N 310.441 5.173 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC 340441714 DFSSQVSAKGNQEQ-WOJBJXKFSA-N 322.452 5.171 30 20 DKED Cc1cccc(C(C)C)c1NC(=O)C[C@@H](CC#N)c1ccccc1 356264302 CMMQJMPRGIYBOS-GOSISDBHSA-N 320.436 5.145 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C[C@H]1C 425667069 ZOQBDSNTSJCUNA-HZPDHXFCSA-N 314.473 5.191 30 20 DKED CSc1ccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)cc1 439466538 HPLNZXYEYDPYOY-OAHLLOKOSA-N 324.493 5.060 30 20 DKED C[C@H](SCc1cc(F)cc2cccnc12)c1cccc(C#N)c1 443156884 WXUANENHGLLHQL-ZDUSSCGKSA-N 322.408 5.240 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCCC)C1CC1 475549680 UDQLVTYGDQPNNR-UHFFFAOYSA-N 314.473 5.335 30 20 DKED CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1 732971726 ZPTPNHJJPIWXJH-GOSISDBHSA-N 323.427 5.379 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C)CC1 191418889 KYNMJASNZASVIN-INIZCTEOSA-N 314.473 5.192 30 20 DKED Cc1cccc(C(C)C)c1NC(=O)C[C@H](CC#N)c1ccccc1 356264303 CMMQJMPRGIYBOS-SFHVURJKSA-N 320.436 5.145 30 20 DKED C=C(C)C[C@H](C)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 428419493 FHELTKZBJKPHNL-LBPRGKRZSA-N 313.363 5.067 30 20 DKED CC(C)(C#N)CCCSCc1nc(-c2ccccc2)cs1 435901865 JMNISXZQRCMDDK-UHFFFAOYSA-N 316.495 5.373 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@@H](C#N)C1CCCCC1 522840942 CNIUHDOYHHPQKR-INIZCTEOSA-N 306.837 5.012 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1cc(F)c(Cl)cc1Cl 558243963 NAAKSICQOKINNN-JTQLQIEISA-N 317.235 5.113 30 20 DKED CC(=NOCc1ccc(Cl)s1)c1cc2ccccc2o1 727437879 TWLHTNPKBDCVOL-UHFFFAOYSA-N 305.786 5.089 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)o1)[C@H]1CCC[C@H](C)C1 742370818 OZPONGAMMRFTGR-HZUJVAHNSA-N 322.452 5.117 30 20 DKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1coc2ccccc12 789141614 FXSWLDUYMHOQES-BQYQJAHWSA-N 321.357 5.045 30 20 DKED Cc1cc(N[C@H](C)c2ccc(OCC#N)cc2)cc(C)c1Cl 799729749 QLACQEVBFAAPBP-CQSZACIVSA-N 314.816 5.032 30 20 DKED FC(F)(F)[C@H]1CCC[C@@H](C=NNc2cccc3ncccc23)C1 853290302 VTYRRZSTSLZKIL-OLZOCXBDSA-N 321.346 5.001 30 20 DKED CCCCCC(CCCCC)=NNc1ccccc1C(=O)O 1776030127 DSDKMTPQGCBTPI-UHFFFAOYSA-N 304.434 5.313 30 20 DKED C=C(C)[C@H](N[C@H](CC)c1cccs1)c1ccc(F)c(F)c1 480698734 MXWZGOLWGURQQT-WBVHZDCISA-N 307.409 5.384 30 20 DKED C[C@H](NCc1cccc(C#N)c1)c1cccc(-c2ccccc2)c1 480797165 SHBVAYCYCMBHCI-KRWDZBQOSA-N 312.416 5.076 30 20 DKED C=CCCC[C@@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1 540326080 IASCICZOXHQYEJ-MSOLQXFVSA-N 324.468 5.056 30 20 DKED C=CC[C@H](C)N[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 542493479 BCMNNIPKRSXZKO-YCRPNKLZSA-N 320.411 5.018 30 20 DKED CCCC1CCC(N(C(=O)CCCCCC#N)C(C)C)CC1 588922935 QROSBCASWNUABC-UHFFFAOYSA-N 306.494 5.056 30 20 DKED N#C[C@@H](Cc1ccccc1)SCc1cccc2ccccc12 604502222 JRYFEMMRYUFLEV-LJQANCHMSA-N 303.430 5.208 30 20 DKED CC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(Cl)cc1 619746701 IXRLLXDQJSSJEU-QGZVFWFLSA-N 319.235 5.106 30 20 DKED CC(C)[C@H]1/C(=C\c2scnc2C2CC2)C(=O)c2ccccc21 782354395 LPQHGHZPDUJHTI-NQUDRAQSSA-N 309.434 5.040 30 20 DKED CCOc1cccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1 815635546 FDRVTAPPFBTLGU-UWJYYQICSA-N 322.452 5.171 30 20 DKED Cc1cc(F)ccc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 815635888 LOAVIZUHXKFEIV-JXFKEZNVSA-N 310.416 5.220 30 20 DKED CCC[C@@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 154329454 JGXXMIALUOWSSO-LSDHHAIUSA-N 318.486 5.092 30 20 DKED C[C@@H](C/C(O)=N/[C@@H]1CCC(O)=N[C@H]1C(C)(C)C)C1CCCCC1 329290435 QOQQBNACOKWCND-JCKWVBRZSA-N 322.493 5.083 30 20 DKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C(C)C)cc1 515109404 QSKCXAIGDKDZLZ-UHFFFAOYSA-N 308.425 5.030 30 20 DKED CSc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(C#N)cc1)CCC2 519829952 VRPUIJZJWWUNGL-JLTOFOAXSA-N 322.477 5.008 30 20 DKED O=C(O)c1cccc(NN=C2CCCCCCCCCCC2)c1 6673771 MHAUQBYBUBMQNX-UHFFFAOYSA-N 316.445 5.457 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccccc2o1 189897386 BPXIKQRUMGDHMH-UHFFFAOYSA-N 319.404 5.537 30 20 DKED Cc1nc(-c2cccc(N[C@H](C)c3ccc(C#N)cc3)c2)cs1 192780008 XOLACMLPKQIBFO-CYBMUJFWSA-N 319.433 5.163 30 20 DKED CC(C)(C)C[C@@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1 236627352 BURQFQCNXAXCRB-QGZVFWFLSA-N 316.832 5.072 30 20 DKED Cc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 280050413 WDIGEFOPZJGQNL-UHFFFAOYSA-N 320.436 5.172 30 20 DKED Cc1c([C@@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)oc2ccccc12 477850776 CTFCLZDZQBVMGG-ZIAGYGMSSA-N 322.383 5.164 30 20 DKED C[C@@H](N[C@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 541176031 OTBOZNDPBIFHNC-HZPDHXFCSA-N 316.404 5.230 30 20 DKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(-c2ccccc2)s1 554365989 FCURKLLWHAGIAX-OAHLLOKOSA-N 312.482 5.396 30 20 DKED CC[C@@H](N[C@H]1CC(C)(C)c2ccccc21)c1ccc(C#N)cc1 582645795 WRKKZRLZEBYXRE-UXHICEINSA-N 304.437 5.022 30 20 DKED C=CCn1c(C)cc(C(=O)CS[C@H](C)c2cccs2)c1C 737402964 ROYAJFKHKJDCTQ-CQSZACIVSA-N 319.495 5.030 30 20 DKED Cc1ccsc1C(=O)/C=C\c1cccc(-c2ccccn2)c1 747692730 JKNHXWLQPJHWGH-HJWRWDBZSA-N 305.402 5.015 30 20 DKED COc1ccc2cc(N[C@H](C)c3ccc(C#N)cc3F)ccc2c1 797024276 ZHMJISLHRPYAJW-CYBMUJFWSA-N 320.367 5.032 30 20 DKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1ccc(C)s1 800576163 BZLLGHQBXGFVPX-CQSZACIVSA-N 314.454 5.058 30 20 DKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1 1776697252 CHNUHOLBGCNXSZ-YRBHFNIASA-N 322.404 5.103 30 20 DKED N#CCC[C@H](Nc1ccnc2cc(Cl)ccc12)c1ccccc1 301785572 LJQYDZGRENGYLU-KRWDZBQOSA-N 321.811 5.345 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1cc(C)oc1C)c1ccc(F)c(F)c1 447590336 BUMAFBMDSBKSDZ-SGTLLEGYSA-N 305.368 5.143 30 20 DKED CC[C@@H](N[C@H](C)c1ccccc1SC)c1ccc(C#N)cc1 503878693 YYURRVZFFPWYJZ-RDTXWAMCSA-N 310.466 5.082 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C)c1cccc(C#N)c1 538407103 IVBAMARMAUAXHE-WZBLMQSHSA-N 324.855 5.260 30 20 DKED C=CC[C@@H](C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 548278835 RMKJIDMMMXYVAL-CYBMUJFWSA-N 320.219 5.292 30 20 DKED C[C@@H](Nc1ccccc1SCCC#N)c1ccccc1F 600846443 GCYOQJRINAIXLS-CYBMUJFWSA-N 300.402 5.005 30 20 DKED FC(F)(F)C1CCC(C=NNc2ccc(Cl)cc2)CC1 767352577 XABXGQGMBWTECX-UHFFFAOYSA-N 304.743 5.106 30 20 DKED CC[C@H](N[C@H](CC)c1cc(F)ccc1F)c1ccc(C#N)cc1 447588545 URPWUNGCFZYAGD-RBUKOAKNSA-N 314.379 5.028 30 20 DKED CCSc1ccccc1[C@@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618807750 WHLOPGPBXMESGG-AUUYWEPGSA-N 322.477 5.008 30 20 DKED CSc1ccc(C(=O)/C=C\c2cc3cc(F)ccc3o2)cc1 741849437 XXXJAQQTRCCESR-YVMONPNESA-N 312.365 5.190 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(F)c1 340445488 DURTTYOKKKKNHK-PMACEKPBSA-N 310.416 5.302 30 20 DKED C=C[C@@H](CC(=O)Nc1c(Cl)ccc(C)c1C)c1ccccc1 434031167 LVDBUAWZLBNNLA-HNNXBMFYSA-N 313.828 5.255 30 20 DKED C[C@@H](S[C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C#N)c1 443162710 SWLPEMAVCUHMMW-CHWSQXEVSA-N 312.394 5.022 30 20 DKED N#CCCCCN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 476989153 ITSXQOZCXSJUSE-UHFFFAOYSA-N 323.267 5.166 30 20 DKED CC[C@H](CSc1ccc(Cl)cc1)NCC(C)(C)CCC#N 554364775 NBCCYBBKIYMREE-OAHLLOKOSA-N 324.921 5.130 30 20 DKED Cc1ccc(CNc2ccccc2S[C@H](C)CC#N)cc1F 600559209 YYKGLKXBCIJDFP-CQSZACIVSA-N 314.429 5.141 30 20 DKED CCCCC[C@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)C(C)C 756300950 SWHNWEPZYJUSQR-LSDHHAIUSA-N 320.502 5.295 30 20 DKED C[C@@H](SCC1CCC(C#N)CC1)c1ncc(C(C)(C)C)o1 902568668 XBDHSWNXPPDFSQ-IYXRBSQSSA-N 306.475 5.096 30 20 DKED Clc1ccc(C=NNc2nccc3sccc23)c(Cl)c1 915978744 FPLOKNWHNMLHBX-UHFFFAOYSA-N 322.220 5.049 30 20 DKED COc1ccc(C)cc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 340457872 WLFMPAREOADLEZ-YLJYHZDGSA-N 322.452 5.089 30 20 DKED COc1ccccc1-c1ccc([C@H](C)N(C)CCCCC#N)cc1 610216352 VOOHHXUZGWCXFU-KRWDZBQOSA-N 322.452 5.049 30 20 DKED O=C1C(=Cc2sc3ccccc3c2Cl)C(=O)c2ccccc21 747003828 OWUSXRWBCKUFSR-UHFFFAOYSA-N 324.788 5.017 30 20 DKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 414136154 IQHFITHHOPQZHN-UWJYYQICSA-N 322.452 5.089 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1sccc1Cl 453080652 FPSYADKPUJJQMG-NSHDSACASA-N 322.886 5.408 30 20 DKED CC[C@H](N[C@@H]1CC(C)(C)c2ccccc21)c1ccc(C#N)cc1 582645796 WRKKZRLZEBYXRE-VQTJNVASSA-N 304.437 5.022 30 20 DKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc2ccccc2o1 727955219 WCPBRWHKVJFPOX-CABCVRRESA-N 312.413 5.001 30 20 DKED O=C(/C=C\c1cccc(F)c1)c1ccc(SC(F)F)cc1 734981827 USZTUIZIBGRNPW-WTKPLQERSA-N 308.324 5.037 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc(F)c(Cl)c2)s1 736434880 YIMBZUIEZSXQCI-FNORWQNLSA-N 323.820 5.129 30 20 DKED C=CCN(C(=O)Nc1cccc(CSC(C)C)c1C)C(C)C 743206258 YSGAOGFQKJQHMW-UHFFFAOYSA-N 320.502 5.065 30 20 DKED Cc1cccc2c1[C@@H](C)/C(=C\c1cnc(-c3ccco3)s1)C2=O 789149532 ZJHRBFWSSZPONE-DGGAMASNSA-N 321.401 5.095 30 20 DKED CC(/C=C\C(=O)c1cncs1)=C/c1ccccc1C(F)(F)F 799891667 AUSBSLCFFPQYIU-NJMVCRMVSA-N 323.339 5.004 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1sccc1OC)c1ccc(F)c(F)c1 186450013 XQRCMAYZAUJPPN-BDJLRTHQSA-N 323.408 5.003 30 20 DKED CC(C)c1ccc([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 192995246 KIIISJIOQNVSBW-IAGOWNOFSA-N 322.452 5.124 30 20 DKED N#CCCC[C@H](NCc1cccc(C(F)F)c1)c1ccccc1 433022112 TVPMCZCPVHQGOV-SFHVURJKSA-N 314.379 5.149 30 20 DKED CC(C)(C#N)CCCCN1CCCC[C@H]1c1ccc(F)cc1 444648089 MOJBRISFODRBSK-SFHVURJKSA-N 302.437 5.073 30 20 DKED CC(C)(C#N)CCCOc1ccc(Cl)c(C(F)(F)F)c1 476467969 QGLDTBAPPPKUOY-UHFFFAOYSA-N 305.727 5.068 30 20 DKED CC(C)(C)C[C@@H](NC(=O)CCCCC#N)c1ccc(Cl)cc1 593984019 OJDMHWSIZOFVPE-MRXNPFEDSA-N 320.864 5.017 30 20 DKED Cc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1 727264087 MFLROCGYAOGZAY-QXMHVHEDSA-N 305.402 5.015 30 20 DKED CC(C)CC1(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)CCCC1 756300919 RZMPGIKPKGRHQE-CQSZACIVSA-N 318.486 5.049 30 20 DKED C=CCC[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)c1ccccc1 756759019 HBZHKIKLOKIEBW-UGSOOPFHSA-N 317.379 5.029 30 20 DKED O=C(/C=C/c1scnc1C1CC1)c1ccc(-c2ccccc2)o1 782341207 IGNGGGYAXZEUIX-DHZHZOJOSA-N 321.401 5.177 30 20 DKED C[C@@H](OC(=O)CCCCC#N)c1ccccc1-c1ccccc1 847636865 UWTHGNBXBGJLPS-MRXNPFEDSA-N 307.393 5.042 30 20 DKED CCCCCCCC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 886732006 UABFIBQWDUQGTM-AWEZNQCLSA-N 318.486 5.176 30 20 DKED CCCCCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 913897906 GAEQFWWGTVYJRC-QGZVFWFLSA-N 307.865 5.364 30 20 DKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(Cl)cc1Cl 235193005 WMLPZYGMHLSUMV-GFCCVEGCSA-N 313.272 5.364 30 20 DKED CC(C)[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1 315134035 CHRKXMLOTVSWJK-IFXJQAMLSA-N 312.844 5.260 30 20 DKED C[C@@H](SCc1ccc2ccccc2n1)c1cccc(C#N)c1 443134518 PMIHGEWKJXISQQ-CQSZACIVSA-N 304.418 5.101 30 20 DKED CC(C)(C#N)CCCSCc1csc(Br)c1 480362372 IUWSRRGUAGPMSL-UHFFFAOYSA-N 318.305 5.074 30 20 DKED N#CCCCCSCc1ccc(Br)cc1Cl 480380692 ACKCFKXTDNTTAB-UHFFFAOYSA-N 318.667 5.030 30 20 DKED C=CCOc1cccc(CN[C@H](c2ccccc2)C(C)(C)C)c1 520206899 YMUUGIVVDUXRHH-HXUWFJFHSA-N 309.453 5.128 30 20 DKED CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(Cl)s1 539497256 SAWCEEASBPFZQV-SMDDNHRTSA-N 304.846 5.075 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc2c(c1)CCCC2 557273497 LLGGZMGNUFBHIT-HTAPYJJXSA-N 318.464 5.261 30 20 DKED Cc1ccc2cc(CN[C@@H](CCCC#N)c3ccccc3)[nH]c2c1 594944342 NYONDXNRUVYSPE-FQEVSTJZSA-N 317.436 5.001 30 20 DKED C[C@@H](Nc1ccccc1OC1CCCC1)c1cccc(C#N)c1 611482535 YWOURQNFTCBVDA-OAHLLOKOSA-N 306.409 5.053 30 20 DKED CCc1c([C@H](C)NCc2ccc(C#N)cc2)oc2ccc(C)cc12 776154109 NEGAMSNTCFWEHW-HNNXBMFYSA-N 318.420 5.026 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)C(C)C 276393288 IWYPXWUMHBYZGZ-OAHLLOKOSA-N 302.462 5.047 30 20 DKED N#C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)C1CCCCC1 522629551 SQMPSEVMIXCFAZ-RTBURBONSA-N 324.493 5.094 30 20 DKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Cl)cc(Cl)c1 531951386 MMQFRZBBRKYEPM-NEPJUHHUSA-N 319.235 5.277 30 20 DKED C=CCC[C@H](NCc1cccc(-c2ccccn2)c1)c1ccco1 573824661 MGUKBOIVJVTBOT-FQEVSTJZSA-N 318.420 5.139 30 20 DKED C=CCN(C(=O)Nc1c(C)cc(Cl)c2ccccc12)C(C)C 765351009 SSOXBNHKCLHQHE-UHFFFAOYSA-N 316.832 5.230 30 20 DKED O=C(/C=C\c1scnc1C1CC1)c1ccc2ccccc2c1 782301337 LKJHYTSZQJHSEF-KTKRTIGZSA-N 305.402 5.070 30 20 DKED C[C@@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1cccc(C#N)c1 925186370 WLMBTFDIUVQRSJ-GHMZBOCLSA-N 324.371 5.050 30 20 DKED C[C@@H](Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 36919539 JJFJGYIMURIUAF-LLVKDONJSA-N 304.365 5.046 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)c1ccccc1 189891402 BNHVSHNFKLGIRK-KRWDZBQOSA-N 321.464 5.671 30 20 DKED Cc1nc(-c2ccc(N[C@H](C)c3cccc(C#N)c3)cc2)cs1 192948283 QZVRSKSDAPOBKX-CYBMUJFWSA-N 319.433 5.163 30 20 DKED Cc1ccccc1[C@H](CC(F)(F)F)NC1CCC(C)(C#N)CC1 449290229 WQXYVXAZOJHUSN-WIHSUSGWSA-N 324.390 5.051 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)CC(C)C 476088852 HYUZPFHYLBJICB-INIZCTEOSA-N 301.474 5.549 30 20 DKED C[C@H](N[C@H](c1ccccc1)C1CCCC1)c1cccc(C#N)c1 539500195 UBTSMRXQQYMODX-HRAATJIYSA-N 304.437 5.140 30 20 DKED C=CCCC[C@H](C)NC(=O)N(c1ccccc1)c1ccccc1 541123858 YDXQVQNJBWABNL-KRWDZBQOSA-N 308.425 5.279 30 20 DKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H](c1ccccc1)C1CCC1 611391879 CQEBHJFRZIWCQS-FCHUYYIVSA-N 316.448 5.067 30 20 DKED Cc1cc(/C=C/C(=O)c2ccsc2)ccc1Oc1cccnc1 732714132 MWCJFUBIOLOONQ-GQCTYLIASA-N 321.401 5.140 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@H]1c1ccc(O)cc1 744334435 MUNZXECTGRFDPQ-IBGZPJMESA-N 317.473 5.196 30 20 DKED Cc1ccsc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745990538 SUVXHNPCCMUUML-SREVYHEPSA-N 305.402 5.015 30 20 DKED CCCCCCCCC(=O)Nc1ccccc1C(F)(F)F 106451398 PDPNDMUEXLAZMB-UHFFFAOYSA-N 301.352 5.395 30 20 DKED C[C@@H](N[C@@H]1CCCc2sc(Cl)cc21)c1ccc(C#N)cc1 127688188 RQRNZBVHOQENKF-IAQYHMDHSA-N 316.857 5.001 30 20 DKED C=CCC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccccc1 512659674 JECHBTBVCMLGMV-FOIQADDNSA-N 308.400 5.055 30 20 DKED Cc1c([C@H](NCCCC(C)(C)C#N)C(C)C)oc2ccccc12 537057846 XCAFXPZZHOLWAK-GOSISDBHSA-N 312.457 5.358 30 20 DKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccsc2)cc1 741466677 AORCPYSXGVAGRH-FLIBITNWSA-N 320.413 5.320 30 20 DKED CCCCC[C@@](C)(CC)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 781505702 AMOCGSVUJZYNNE-KBXCAEBGSA-N 320.502 5.439 30 20 DKED N#CCC[C@@H](NCc1csc2ccccc12)c1ccccc1 130483548 JBEFCPLACCBJGP-GOSISDBHSA-N 306.434 5.036 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)[C@H]1CCCC(C)(C)C1 330180351 NHSACXMXSVLJCR-HNNXBMFYSA-N 311.429 5.190 30 20 DKED C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1cccc2ccccc12 464646803 ZJXHFIHIHUYBGT-JXFKEZNVSA-N 307.437 5.106 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)CC(C)(C)C 476091905 PNDVAEUCPDINJD-HNNXBMFYSA-N 301.474 5.549 30 20 DKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)[C@@H]1C[C@H]1c1ccccc1 559863026 NCWXECGQORJKSF-MQGJPIDWSA-N 318.464 5.203 30 20 DKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCC(C)(C)C 609376558 CPCBFWDWMIHOAV-CQSZACIVSA-N 318.486 5.093 30 20 DKED CCCCc1nc(CS[C@@H](C)c2ccc(C#N)cc2)cs1 609825481 AGMWVWPSJRXDJG-ZDUSSCGKSA-N 316.495 5.352 30 20 DKED CCC[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1 315888537 PFQCGTIMBDDKSF-AUUYWEPGSA-N 312.844 5.404 30 20 DKED C=C(C)CN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 471175907 IWHMHRORSLXXHR-QGZVFWFLSA-N 310.441 5.178 30 20 DKED CC(C)(C#N)CCCN1Cc2ccccc2C[C@H]1c1ccccc1 472227082 UXSUWSWGOHDWBY-NRFANRHFSA-N 318.464 5.116 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(F)cc1Cl 485007917 HEXPTDCPMWNRDG-UHFFFAOYSA-N 324.827 5.079 30 20 DKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(SC)c1 485028522 AFGNIRCXHBCYMS-UHFFFAOYSA-N 318.486 5.009 30 20 DKED C[C@@H](N[C@H](C)c1cccc2ccccc12)c1ccc(C#N)cc1F 512640901 BGZMSMSMOMDROX-HUUCEWRRSA-N 318.395 5.262 30 20 DKED Cc1cc(N2CCCC[C@@H]2C)ccc1NCC(C)(C)CCC#N 537718526 QRXAYNSEAJJWNZ-KRWDZBQOSA-N 313.489 5.116 30 20 DKED O=C(/C=C\c1c(F)cccc1F)c1cc(Cl)sc1Cl 744866081 PBIZJKSPTZDIGY-PLNGDYQASA-N 319.159 5.229 30 20 DKED C[C@H](CC1CCCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303582623 RNNLWHOXNKSHFB-OAHLLOKOSA-N 312.457 5.033 30 20 DKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(F)c1 340445489 DURTTYOKKKKNHK-UXHICEINSA-N 310.416 5.302 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC(C)(C)C 475568725 FGLSQCXHVRDYFP-UHFFFAOYSA-N 302.462 5.096 30 20 DKED C[C@@H](SCCCC(C)(C)C#N)c1ccc(OC(F)F)cc1 480387671 LEJUBZABIXXKFS-GFCCVEGCSA-N 313.413 5.412 30 20 DKED CSc1ccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 516987448 RRJGVQFIPFBNSC-JLTOFOAXSA-N 322.477 5.008 30 20 DKED CCC(CC)[C@@H](NCc1ccc(F)cc1C#N)c1cccs1 540381760 XYROUSUZZAEXFD-GOSISDBHSA-N 316.445 5.026 30 20 DKED C=CC[C@H](C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 548278836 RMKJIDMMMXYVAL-ZDUSSCGKSA-N 320.219 5.292 30 20 DKED C=CCC(C)(C)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 550034434 LYACDAOFJULOQM-MRXNPFEDSA-N 322.452 5.401 30 20 DKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cc2ccccc2o1 584486579 KXNZGIRZTKVOMQ-AUUYWEPGSA-N 316.404 5.033 30 20 DKED C=CCN(Cc1ccc(Cl)s1)C(=O)C=C1CCC(C)CC1 734101593 QSPCDBOZAVEBLO-UHFFFAOYSA-N 323.889 5.053 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@@H]1c1csc(C)n1 772577060 WAVUKSGKVHIEDX-QGZVFWFLSA-N 322.518 5.256 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1ccc(OC)cc1 918723774 XLZKTCBSZWXSTK-UHFFFAOYSA-N 322.518 5.074 30 20 DKED Cc1c([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)oc2ccccc12 124610048 SMZOGNYOIUCIIH-GJZGRUSLSA-N 304.393 5.025 30 20 DKED C[C@@H](NCc1ccc(-c2ccccc2)s1)c1ccc(C#N)cc1 319640498 CBZQMCWHLUDNLZ-OAHLLOKOSA-N 318.445 5.138 30 20 DKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc(Cl)c1 417375577 ZGTVMEFLTMRFRK-BZNIZROVSA-N 316.857 5.001 30 20 DKED C[C@@H](NCCCC#N)c1ccc(-c2ccccc2Cl)s1 541568528 VFPHWLDJCHQOAP-GFCCVEGCSA-N 304.846 5.023 30 20 DKED C[C@@H](SCc1coc(-c2ccccc2)n1)c1ccc(C#N)cc1 609825471 ZISHZLUQGLPXAM-CQSZACIVSA-N 320.417 5.208 30 20 DKED Cc1ccc(C2CC(=NNc3ncc(Cl)cc3Cl)C2)cc1 729817349 ZODIATXDTJHQIV-UHFFFAOYSA-N 320.223 5.042 30 20 DKED CCCCCC(C)(C)C(=O)[C@H](C#N)c1nc2ccccc2s1 753389623 GKPPYBBRFCDSDZ-ZDUSSCGKSA-N 314.454 5.079 30 20 DKED C#CC[C@@H](N[C@@H](CC)c1ccc(Cl)s1)c1ccccc1 773114752 JMENAINIQTYAMC-LSDHHAIUSA-N 303.858 5.207 30 20 DKED CCCCCCCN[C@@H](C)c1sc(-c2cccnc2)nc1C 776747540 ZODWZCWMIIPWAO-AWEZNQCLSA-N 317.502 5.135 30 20 DKED C[C@H](c1ccccc1)c1ccc(OC(=O)CCCCCC#N)cc1 805875949 CJQOSSMDZPTUJQ-QGZVFWFLSA-N 321.420 5.218 30 20 DKED Cc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(O)c1C 815635340 ATXJFENZLHLXPD-XLIONFOSSA-N 322.452 5.095 30 20 DKED C[C@H](Nc1ccc2c(c1)Cc1ccccc1-2)c1cccc(C#N)c1 324236297 WTIIOLHYDRHGNT-HNNXBMFYSA-N 310.400 5.303 30 20 DKED C=CCCSCc1csc(-c2ccc(OCC)cc2)n1 523520521 VDSGIHLBNVXUDV-UHFFFAOYSA-N 305.468 5.018 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C\c2cc(C#N)cs2)cc1 748440936 SYPRWVYLQFDRCQ-FPLPWBNLSA-N 313.447 5.016 30 20 DKED C=C(C)[C@@H](N[C@@H](C)c1ccc(CC)o1)c1ccc(F)c(F)c1 480691475 BVKLICGZAMZAIZ-KPZWWZAWSA-N 305.368 5.088 30 20 DKED N#Cc1ccc(/C=C\c2ccc(-c3ccccc3Cl)o2)nc1 515420360 JVWUDMQWFKBDDT-FPLPWBNLSA-N 306.752 5.037 30 20 DKED C[C@@H](NCc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 541090978 XQSHXRJRDHKTDT-QGZVFWFLSA-N 312.416 5.076 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1nc(C)sc1C)c1ccccc1 678602222 BBSMOMZFPMSBGF-SUMWQHHRSA-N 300.471 5.118 30 20 DKED C=CC[C@@H](N[C@H](C)c1cccc(CC(C)C)c1)c1ccncc1 796772224 PQSMCOTVDDIMLC-DYESRHJHSA-N 308.469 5.248 30 20 DKED C=CCN(C(=O)Nc1ccccc1Oc1ccc(C)cc1)C(C)C 916707860 YTNVPAIARJTSKE-UHFFFAOYSA-N 324.424 5.216 30 20 DKED C=CCC[C@H](N[C@H]1CCCc2nc(C)sc21)c1ccccc1 90580703 WCPHPRNTFLOWOR-WMZOPIPTSA-N 312.482 5.126 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1cccc(C#N)c1)CC2 427854781 BNHXDXNWTOECBD-VFNWGFHPSA-N 304.437 5.020 30 20 DKED C=CCC[C@@H](NCc1cccc(C(F)F)c1)c1ccccc1 470775876 ASWCUWQWTCGVHE-GOSISDBHSA-N 301.380 5.421 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)C(C)C 568180220 KANWOVZDFLPSJJ-UHFFFAOYSA-N 302.462 5.191 30 20 DKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cc2ccccc2s1 568936763 WRJYOHZFYRHISA-UGSOOPFHSA-N 318.445 5.111 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1ccc(CF)cc1 777541692 QDQMNFUSXAWLGN-CQSZACIVSA-N 314.429 5.020 30 20 DKED N#C[C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 463290675 TWULLXWMBLHUPS-YSGRDPCXSA-N 324.855 5.101 30 20 DKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Cl)s1 475038509 KWEPQPRWOOTZFW-NSHDSACASA-N 322.886 5.265 30 20 DKED Cc1ccc(-c2nc(CSCCCC(C)(C)C#N)cs2)o1 480410029 LLYQUSBXTAIWHG-UHFFFAOYSA-N 320.483 5.275 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1sccc1C)c1ccc(F)c(F)c1 480659200 CVNHPDCDJQTTOG-MLGOLLRUSA-N 307.409 5.303 30 20 DKED C[C@@H](Sc1cc(C#N)ccn1)c1ccc(Cl)cc1Cl 603947768 YJURSUXBLNXBHI-SECBINFHSA-N 309.221 5.113 30 20 DKED C[C@@H](NCc1ccc(-c2ccsc2)cc1)c1cccc(C#N)c1 618302218 CWNKBOOQVWLDSL-OAHLLOKOSA-N 318.445 5.138 30 20 DKED Cn1cc(C(=O)/C=C/c2ccc(C(F)F)cc2)c2ccccc21 794934474 LIWBVBXIDILKBI-DHZHZOJOSA-N 311.331 5.012 30 20 DKED Cc1ccc(-c2ccccc2NCc2cccc(C#N)c2)s1 864018130 MBZMVAYMMOUYEA-UHFFFAOYSA-N 304.418 5.207 30 20 DKED C=CCC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1)c1ccccc1 182159261 OHVQHFUZZHSMFN-IERDGZPVSA-N 322.452 5.003 30 20 DKED CSc1ccccc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 340447320 PQZJLDPRLAITFA-APWZRJJASA-N 324.493 5.494 30 20 DKED CN(CC(C)(C)CCC#N)C1c2ccccc2-c2ccccc21 536694860 AWPJMDVBFNTNCV-UHFFFAOYSA-N 304.437 5.018 30 20 DKED C[C@@H](Nc1cccc(C(F)F)c1Cl)c1cccc(C#N)c1 542680091 HEXJUYKIRVPXHD-SNVBAGLBSA-N 306.743 5.322 30 20 DKED CC(C)C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccs1 561139587 DXFPTKPCURMCDJ-RBUKOAKNSA-N 324.493 5.374 30 20 DKED CC[C@@H](N[C@H](CC1CC1)c1ccccc1)c1ccc(C#N)cc1 618573935 QVBWBZAIHFBYCY-NHCUHLMSSA-N 304.437 5.140 30 20 DKED CC(=NNc1ccc(C)cn1)c1cc2c(ccc3ccccc32)o1 727259357 AYDSUJMOUCNEDO-UHFFFAOYSA-N 315.376 5.126 30 20 DKED CC(C)(CCC#N)CNc1ccc([C@@H](F)C(F)(F)F)cc1 883369413 QGPHQSYJSYXZAO-CYBMUJFWSA-N 302.315 5.001 30 20 DKED C=CCN(C(=O)Nc1ccccc1Oc1cccc(C)c1)C(C)C 916707863 ZAZDBZUXBWVTQM-UHFFFAOYSA-N 324.424 5.216 30 20 DKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)c1cccc(C#N)c1 181724972 HTYDPMYPTXUOKR-KBPBESRZSA-N 306.434 5.185 30 20 DKED N=C(O)[C@@H]1CCC[C@@H](/C(O)=N/C2CCC3(CCCCC3)CC2)C1 329940597 GHDROZQVMGSGGI-HUUCEWRRSA-N 320.477 5.178 30 20 DKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1cccc(Cl)c1 444600859 WUKJPZTVJCVRGI-QGZVFWFLSA-N 304.865 5.197 30 20 DKED C[C@@H](S[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(C#N)cc1 609825622 IYCFESUOUKUAKI-CHWSQXEVSA-N 312.394 5.022 30 20 DKED C(=NN(c1ccccc1)c1ccccc1)c1csc(C2CC2)n1 920357867 XHZRJZMIZSNKGQ-UHFFFAOYSA-N 319.433 5.193 30 20 DKED CC(O)=Nc1cccc(/C(O)=N/[C@@H]2CCCCC23CCCC3)c1 329732985 JGVTURRTHXOFQR-QGZVFWFLSA-N 314.429 5.102 30 20 DKED CCN(Cc1ccc(C(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 461393986 DFLYLDKBLHPMQO-AWEZNQCLSA-N 314.379 5.079 30 20 DKED C=C(C)[C@H](NCc1cc2ccccc2o1)c1ccc(F)c(F)c1 479401088 DDIYAEQDFCAOKT-IBGZPJMESA-N 313.347 5.118 30 20 DKED C=C(C)[C@@H](N[C@H](C)c1ccc(C)s1)c1ccc(F)c(F)c1 480672724 ZVQNVMPREKCPBX-SJKOYZFVSA-N 307.409 5.303 30 20 DKED CC[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(Cl)c1 594925191 MKPAXRZAFOVQRK-LJQANCHMSA-N 324.855 5.136 30 20 DKED Cc1ncsc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 742431220 FCLULHYBIPLZMT-CLFYSBASSA-N 319.385 5.247 30 20 DKED C[C@@H]1/C(=C\c2csc(-c3cccs3)n2)C(=O)c2ccccc21 809158239 ZEELTWOAIKZFKW-ZRRZQRFHSA-N 323.442 5.255 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2ccccc2o1 90665431 FPROJCJMDUVDPD-MAUKXSAKSA-N 304.393 5.128 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(CC)c1C 188069588 GGYVMKUCWDBQLY-UHFFFAOYSA-N 324.468 5.229 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(Cl)cn1)c1ccccc1 480214651 PFDWJJNMRQXUKH-KBXCAEBGSA-N 300.833 5.093 30 20 DKED C[C@@H](CCCC(F)(F)F)N[C@H]1CCCCc2cc(C#N)ccc21 481995080 ZYUILXXWLCRILG-GUYCJALGSA-N 324.390 5.036 30 20 DKED N#CCc1ccc(N[C@H]2CCc3c(Cl)cc(Cl)cc32)cc1 507806502 FILPGKRWVPFLBE-KRWDZBQOSA-N 317.219 5.159 30 20 DKED C=CCCC(=O)N(CCC)[C@H](C)c1ccc(Cl)c(Cl)c1 523272918 MEKAJOVHEPXABP-GFCCVEGCSA-N 314.256 5.259 30 20 DKED Cc1cc(F)ccc1-c1ccc(CNc2ccc(CC#N)cc2)o1 546073440 LWEOURNKBHZBFO-UHFFFAOYSA-N 320.367 5.072 30 20 DKED Cc1ccc(C)c([C@H](C)N[C@H](CCCC#N)c2ccccc2)c1 581622059 RRGJIBNLWVUBBT-GHTZIAJQSA-N 306.453 5.389 30 20 DKED C[C@H](CC#N)Sc1ccccc1NCCCCC(F)(F)F 151924774 MPHBVOPCGDJHOL-GFCCVEGCSA-N 316.392 5.225 30 20 DKED Cc1csc(-c2ccc(NC3CCC(C)(C#N)CC3)cc2)n1 449050382 OOAPYHUGTYYUII-UHFFFAOYSA-N 311.454 5.003 30 20 DKED CC(C)(C)c1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 483042410 CPZHNXPTJHGPEH-UHFFFAOYSA-N 320.436 5.038 30 20 DKED CCCOc1ccccc1-c1nc(-c2ccc(C#N)cc2)cs1 518003262 OXHHOTGQOHNJBQ-UHFFFAOYSA-N 320.417 5.138 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1sc(CC)nc1C)c1ccccc1 540150309 IBVDHOVEJWHYSI-WMLDXEAASA-N 314.498 5.372 30 20 DKED CC(C)=CCC/C(C)=C/C=NNc1cccc(C(F)(F)F)n1 739422720 XREUGOBRWQPRFZ-MQFSGWNHSA-N 311.351 5.191 30 20 DKED C[C@H](Nc1ccc(F)cc1OCC#N)c1cccc2ccccc12 760217718 ZPMMLSKYCXOOJS-AWEZNQCLSA-N 320.367 5.054 30 20 DKED C[C@H](SCc1nc(Cl)ccc1Cl)c1ccc(C#N)cc1 764940751 OLWJXXNJBLBELG-JTQLQIEISA-N 323.248 5.254 30 20 DKED CCCCCCCC(=O)N1CCC(=Cc2cccc(F)c2)CC1 917381095 OATTXSPBOINANB-UHFFFAOYSA-N 317.448 5.192 30 20 DKED CC(C)c1cccc(NCc2cccc(OCCCC#N)c2)c1 236792882 ULZLADGGRVQDPX-UHFFFAOYSA-N 308.425 5.105 30 20 DKED CSc1ccccc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 417354937 AELAIHCEEAKYJY-IFXJQAMLSA-N 322.477 5.008 30 20 DKED CC[C@H](N[C@@H](CC(C)C)c1cccs1)c1ccc(C#N)cc1 447527680 FRZJYGCVYJVFLN-ROUUACIJSA-N 312.482 5.448 30 20 DKED N#Cc1ccccc1CSCc1ccc(Cl)c2cccnc12 498130843 BZRAAXAOKUTWOZ-UHFFFAOYSA-N 324.836 5.193 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 523024948 FVXFRKMUEADBCT-HNNXBMFYSA-N 320.502 5.316 30 20 DKED C[C@@H](N[C@H](C)c1ccc(F)c2ccccc12)c1ccc(C#N)cc1 551007070 CRPVYCZTKWRYNZ-HUUCEWRRSA-N 318.395 5.262 30 20 DKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842941910 UIRJQRYNSMDMRV-MLGOLLRUSA-N 324.449 5.024 30 20 DKED C[C@@H](CC#N)Sc1ccccc1NCc1ccccc1CF 901383184 HZMQIYOAIDAFIJ-AWEZNQCLSA-N 314.429 5.162 30 20 DKED CC(C)(C)[C@H](NCCCCC#N)c1cccc(C(F)(F)F)c1 181971192 RWISDMGFBQMLMR-OAHLLOKOSA-N 312.379 5.076 30 20 DKED CCCCCCCC(=O)c1ccc(OCc2cc(C)no2)cc1 247899807 IGXOEVXZVHQDDK-UHFFFAOYSA-N 315.413 5.105 30 20 DKED Cc1nc(C(C)C)ccc1CN[C@@H](CCCC#N)c1ccccc1 339239464 WYNLDDBTMFZKEK-NRFANRHFSA-N 321.468 5.038 30 20 DKED C=C(C)COc1cccc(NC(=O)N(CCCCC)C(C)C)c1 438129064 PTKAVUOXMNYFGT-UHFFFAOYSA-N 318.461 5.074 30 20 DKED C=CCCc1ccccc1NC(=O)N1CCC[C@]2(CC=CCC2)C1 505001014 NEZGETUYRYHZIX-OAQYLSRUSA-N 324.468 5.159 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccc(SC2CCCC2)cc1 591490735 WULNWDGIDGGMKV-UHFFFAOYSA-N 318.486 5.151 30 20 DKED CC[C@H](Nc1ccc(N2CCCCC2)cc1)c1ccc(C#N)cc1 774270337 DNBINYRRRHIULQ-NRFANRHFSA-N 319.452 5.112 30 20 DKED CCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nccc2ccccc12 792092059 OJWSIVHFQYSMGF-GHTZIAJQSA-N 322.452 5.408 30 20 DKED Cc1cc(OC(=O)CCCCCC#N)c(C(C)C)cc1Cl 805847384 AIDJVQTZJLGYSP-UHFFFAOYSA-N 307.821 5.151 30 20 DKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(C(C)C)c1 1776784690 HXYZIIHKHBJUER-IBGZPJMESA-N 319.489 5.103 30 20 DKED CC(C)c1ccc(NC(=O)c2sccc2C#N)c(C(C)C)c1 216092404 HZLRIOAYVAYDKD-UHFFFAOYSA-N 312.438 5.119 30 20 DKED CC(C)(C#N)CCCCSCc1cccc(OC(F)F)c1 435890267 YRYRGXWOBNVDOJ-UHFFFAOYSA-N 313.413 5.241 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCC(C)(C)C1 475556778 SOCXYPYCOVGMRO-INIZCTEOSA-N 314.473 5.239 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 480676056 ASFVMZGJYMWSHL-VOJFVSQTSA-N 323.333 5.211 30 20 DKED C=CCC[C@H](C(=O)Nc1ccc(F)cc1Cl)c1ccccc1 487596747 KBWXSZRRAJVMCN-HNNXBMFYSA-N 317.791 5.168 30 20 DKED Cc1cc(CN[C@@H](C)c2cc(Cl)ccc2Cl)ccc1C#N 488165833 IKOOFBHYILRJQZ-LBPRGKRZSA-N 319.235 5.024 30 20 DKED CC(C)(C)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 737502289 GELFSGBGDSJSQY-IBGZPJMESA-N 320.436 5.107 30 20 DKED Cc1ccc(C(=O)/C=C/c2cccc(-c3cccnc3)c2)s1 768492407 GNBRZYJXLJVSQI-CMDGGOBGSA-N 305.402 5.015 30 20 DKED C=CCC[C@@H](N[C@H]1CCCc2nc(C)sc21)c1ccccc1 90580706 WCPHPRNTFLOWOR-AEFFLSMTSA-N 312.482 5.126 30 20 DKED CC[C@@H](N[C@H](CC)c1cccc(Cl)c1)c1ccc(C#N)cc1 447542053 HZAXFSMKABBRBN-RTBURBONSA-N 312.844 5.404 30 20 DKED CC[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(Cl)s1 618802337 JBHWOGTVGPIAGP-CABCVRRESA-N 316.857 5.001 30 20 DKED Cc1ncsc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 742431224 FCLULHYBIPLZMT-VQHVLOKHSA-N 319.385 5.247 30 20 DKED N#CCC1CCN(Cc2c3ccccc3cc3ccccc23)CC1 781927435 PTDSVAIRLFFTPJ-UHFFFAOYSA-N 314.432 5.119 30 20 DKED CCCCCCC[C@@H](N[C@@H]1CCn2ccnc21)c1ccccc1 834835951 JYYOUKFMTCJHGO-RTBURBONSA-N 311.473 5.019 30 20 DKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(F)cc1 170991785 OFEFNUXCKXYOGS-UONOGXRCSA-N 314.429 5.251 30 20 DKED C[C@@H](Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 324231493 VGNPMRMBCQOVQX-MRXNPFEDSA-N 314.388 5.524 30 20 DKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccc2ccccc12 480874500 XVFPAPMNZKAXLB-CQSZACIVSA-N 320.823 5.216 30 20 DKED C[C@H](SCc1ccccc1OC(F)F)c1ccc(C#N)cc1 522840032 YFLDLVMLOIHCGE-LBPRGKRZSA-N 319.376 5.154 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 523024949 FVXFRKMUEADBCT-OAHLLOKOSA-N 320.502 5.316 30 20 DKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCC(C)(C)C#N)C1 538487958 HCIJCINELOXKON-CJNGLKHVSA-N 324.390 5.028 30 20 DKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(C(F)F)c1Cl 544629980 CGWREPWTPBNMNO-SNVBAGLBSA-N 316.779 5.144 30 20 DKED C[C@H](Nc1ccc(SC(C)(C)C)cc1)c1cc(C#N)ccn1 902937329 JGFBYFOKRXQAHP-ZDUSSCGKSA-N 311.454 5.017 30 20 DKED N#CCCc1ccc(N[C@@H]2CC3(CCC3)Oc3ccccc32)cc1 903298778 ZJLZRBCAKUCHQV-LJQANCHMSA-N 318.420 5.001 30 20 DKED CC(C)Oc1ccccc1/C=C\C(=O)c1ccc(Cl)s1 916135863 XSTGMMLXBAFZHM-FPLPWBNLSA-N 306.814 5.085 30 20 DKED C=CCOc1ccc(CN[C@H](C)c2ccc(C)cc2)cc1Cl 303236228 ZUNLIOQOARLTLF-OAHLLOKOSA-N 315.844 5.064 30 20 DKED Cc1ccc2cc([C@@H](C)N[C@H](CCC#N)c3ccccc3)oc2c1 426014786 DLBKWJCFBKOLQP-VQIMIIECSA-N 318.420 5.437 30 20 DKED CCC(CC)[C@@H](NCc1ccc(CC#N)cc1)c1cccs1 541325507 AHDSOKYVNHKUNN-LJQANCHMSA-N 312.482 5.081 30 20 DKED CC[C@H](N[C@H](CC)c1ccc(C#N)cc1)c1ccc(Cl)cc1 579552698 WTZVMJIGVXVMNI-MOPGFXCFSA-N 312.844 5.404 30 20 DKED C=CCCCCCN(C)C(=O)Nc1ccc(O[C@@H](C)CC)cc1 606942084 NORJEXZLQKGHCI-INIZCTEOSA-N 318.461 5.074 30 20 DKED O=C(/C=C/c1nccs1)c1ccc(SC2CCCC2)cc1 735229288 XWPMLZNDVKIQCX-MDZDMXLPSA-N 315.463 5.074 30 20 DKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cccs2)cc1 741465986 ZZOAHNQCEIXFLY-RAXLEYEMSA-N 320.413 5.320 30 20 DKED CCCCCC[C@@](C)(CC)C(=O)Nc1ccc(CC#N)cc1 742490687 XSISHYQIHOJHLZ-LJQANCHMSA-N 300.446 5.078 30 20 DKED CCCCCCCC(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 746340321 FSCYFCRIFFQIJJ-KRWDZBQOSA-N 324.468 5.286 30 20 DKED CC(=NNc1cccc(Cl)c1)c1sc(C(C)C)nc1C 751131970 XHWZFCFHLCIRIT-UHFFFAOYSA-N 307.850 5.064 30 20 DKED Cc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 920063003 PAXZRHAMPFWBLH-SREVYHEPSA-N 311.431 5.076 30 20 DKED CC(C)c1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)CC2 427870578 VMMLVCBLWAGRPG-SZNDQCEHSA-N 322.427 5.159 30 20 DKED Cc1c([C@@H](C)NCc2ccc(Cl)cc2C#N)oc2ccccc12 481073070 OPJOYFFRZCAFQN-CYBMUJFWSA-N 324.811 5.117 30 20 DKED O=C(/C=C\c1cnc(C2CCC2)s1)c1ccc(Cl)s1 760264266 MQBHGQQPXLCBNP-PLNGDYQASA-N 309.843 5.022 30 20 DKED CC(C)(C)Sc1ccc(NCc2ccc(C#N)s2)cc1 770557068 FYFNFKWUACMORZ-UHFFFAOYSA-N 302.468 5.122 30 20 DKED COc1c(Cl)cc(N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 777671487 NVGSXSMIOBWURD-JTQLQIEISA-N 321.207 5.047 30 20 DKED Cc1c([C@H](C)OC(=O)CCCCCC#N)sc2ccccc12 805918656 APRNMTBJYUASIB-AWEZNQCLSA-N 315.438 5.288 30 20 DKED COc1cc(/C=C/C(=O)c2ccc(Cl)s2)ccc1SC 49487609 JNNLMWPHTQBHCY-HWKANZROSA-N 324.854 5.028 30 20 DKED Cc1coc(-c2ccc(C)c(N[C@H](C)c3ccc(C#N)cc3)c2)n1 160033582 OFXQMNCTKBDDGC-OAHLLOKOSA-N 317.392 5.003 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc2ccccc2s1 181724989 HTYDPMYPTXUOKR-KGLIPLIRSA-N 306.434 5.185 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Cl)ccc1Cl 427871671 IIVXNJPQSBCNHK-NEPJUHHUSA-N 319.235 5.277 30 20 DKED CC(C)(C#N)CCCCSC1CCC(C(F)(F)F)CC1 451045974 ZAHTXFXGDAAMJK-UHFFFAOYSA-N 307.425 5.561 30 20 DKED C=CCCN(C)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471419610 PISCKQGFSFMNDS-UHFFFAOYSA-N 314.816 5.047 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C1CCCC1)c1ccc(C#N)cc1F 512630014 LENDNXRROQSOBD-VFNWGFHPSA-N 322.427 5.279 30 20 DKED N#Cc1ccc(CNc2ccc(C3CC3)cc2)c(C(F)(F)F)c1 589316817 SRDRNVXJXBABRL-UHFFFAOYSA-N 316.326 5.067 30 20 DKED Cc1ccccc1[C@H](NCc1ccc(C#N)o1)[C@H]1CCC[C@@H](C)C1 742370819 OZPONGAMMRFTGR-LDBYXDLTSA-N 322.452 5.117 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1ccccc1SC(C)(C)C 815626952 PJZJHJYYCJSRFY-HNNXBMFYSA-N 318.530 5.558 30 20 DKED CC(C)c1ccc([C@@H](C)NN=Cc2c(F)cccc2Cl)cc1 917553171 XTDHOZIEPIWDJQ-CYBMUJFWSA-N 318.823 5.287 30 20 DKED CC(C)c1ccc(Sc2ccc(NC(=O)[C@H](C)C#N)cc2)cc1 609920973 WAQDRJPADJTLHU-CQSZACIVSA-N 324.449 5.059 30 20 DKED CCCCCC[C@@H](C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1 741900871 XKEQDYHKSLKUEF-SJORKVTESA-N 314.473 5.074 30 20 DKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc2scnc2c1 750949718 ICWJHZTYMKLVLG-UHFFFAOYSA-N 323.204 5.059 30 20 DKED C[C@H](Nc1ccc(CC#N)cc1)c1ccc(Cl)cc1Cl 37071473 YHABTAIVRYTOPD-NSHDSACASA-N 305.208 5.233 30 20 DKED N#Cc1ccc(CN[C@H]2CCCc3c2sc2ccccc32)s1 421887015 SGMHJNLPKZLKQO-INIZCTEOSA-N 324.474 5.002 30 20 DKED N#CCCC[C@H](NCc1ccc2ccccc2c1)c1ccccc1 556908491 RPGJWLONWPLWCG-QFIPXVFZSA-N 314.432 5.365 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(CSC)CC1 593139726 OSPMWIWKFCZYJT-UHFFFAOYSA-N 317.498 5.010 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@H](C#N)c2ccccc2)cc1 595415366 PNSDMXQCIQPUOA-DNVCBOLYSA-N 310.466 5.103 30 20 DKED CC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(C)cc1 614180038 UHIBDJHDCWRWTF-FQEVSTJZSA-N 306.453 5.037 30 20 DKED Cc1cccc2c1C/C(=C\c1cnc(-c3cccs3)s1)C2=O 751514805 WJBJHNHJMANHKR-XYOKQWHBSA-N 323.442 5.002 30 20 DKED CC(C)(C#N)c1ccccc1CSC1=Nc2ccccc2C1 768386074 JBJGXESSXMBACB-UHFFFAOYSA-N 306.434 5.007 30 20 DKED CCCC[C@@H](CC)CC(CC)=NNc1ccccc1C(=O)O 1776032148 PDYHXWYDQUMSMM-CQSZACIVSA-N 304.434 5.169 30 20 DKED CC[C@@H](Nc1ccc(N2CCCC2)cc1C)c1ccc(C#N)cc1 447582281 YQNJQJAURPSNDW-HXUWFJFHSA-N 319.452 5.030 30 20 DKED CC1(C#N)CCC(Nc2cccc(CCC(F)(F)F)c2)CC1 449042988 UZXQIKCGPHXQGM-UHFFFAOYSA-N 310.363 5.066 30 20 DKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H](CC1CC1)c1ccccc1 553873776 QLSWXFSVCGIJFP-YADHBBJMSA-N 316.448 5.067 30 20 DKED N#CCCC[C@H](N[C@H]1CC[C@H](c2ccccc2)C1)c1ccccc1 559861905 DLTUDCRLALAWPB-FKBYEOEOSA-N 318.464 5.347 30 20 DKED C=CCC[C@H](NCc1oc2ccc(F)cc2c1C)c1ccco1 560530678 REYSKTZJEBBEMD-INIZCTEOSA-N 313.372 5.270 30 20 DKED C=C[C@@H](CC(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 677600603 XWHDRGHXVCEQIW-HNNXBMFYSA-N 313.828 5.255 30 20 DKED C=CC[C@H](N[C@H](C)c1cccc2ccccc12)c1ccncc1 749130083 WDKGQLSDNQGGHQ-IERDGZPVSA-N 302.421 5.203 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccncc1 766022860 YDBSZLIZXSXINC-YVEFUNNKSA-N 321.251 5.356 30 20 DKED C=CCOc1ccc(CN[C@H](CC)c2cccc(Cl)c2)cc1 315457201 NLBPSTZCFCAPHF-LJQANCHMSA-N 315.844 5.146 30 20 DKED C=CCCc1ccccc1NC(=O)c1oc2ccc(F)cc2c1C 410362777 VPMPDPTWWFFGCH-UHFFFAOYSA-N 323.367 5.251 30 20 DKED CC(C)c1ccc([C@H](N[C@H]2CC[C@H](C#N)C2)c2cccs2)cc1 442647979 LLEGDUPFAHNLCW-QSFXBCCZSA-N 324.493 5.243 30 20 DKED CCN(Cc1ccc(F)cc1C#N)[C@H](C)c1cc2ccccc2o1 489544513 CNJVPJNAZXXTRW-CQSZACIVSA-N 322.383 5.027 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1 550827521 MLLRHSCYQAPXNZ-DNVCBOLYSA-N 312.844 5.426 30 20 DKED C=C(C)CN(CC)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 670054997 ASLYFFJSIBWGFL-UHFFFAOYSA-N 308.853 5.067 30 20 DKED CC[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2o1 734080625 XTVJBMNGFVWDGQ-CVEARBPZSA-N 324.424 5.001 30 20 DKED Cc1ccccc1C1CC(=NNc2ncc(Cl)cc2Cl)C1 743426532 IGQAOORDQQTIKP-UHFFFAOYSA-N 320.223 5.042 30 20 DKED CC(C)c1ccc([C@@H](C)Nc2ccc(F)cc2OCC#N)cc1 783697140 XNFJXYHLHBWLLL-CQSZACIVSA-N 312.388 5.025 30 20 DKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C#N)c1 903000650 LXJUOBHZHODRCO-NHCUHLMSSA-N 317.436 5.034 30 20 DKED CCCCCCCCCC(=O)N1CCC[C@@H]1c1ccsc1 915628597 FPUBDEHHIBMMKZ-QGZVFWFLSA-N 307.503 5.552 30 20 DKED CC[C@@H](NCc1csc2ccccc12)c1ccc(C#N)cc1 447549009 IYKASYBXWSZEIO-GOSISDBHSA-N 306.434 5.014 30 20 DKED C[C@H](NC1CCC(C)(C#N)CC1)c1ccc(F)c2ccccc12 449331283 YBEGUGBTHYWGKI-BQTBQCLESA-N 310.416 5.102 30 20 DKED C=CCCCCCS[C@H](C)C(=O)Nc1c(C)cccc1C 485580058 PRONBPVUTSVWLS-MRXNPFEDSA-N 305.487 5.110 30 20 DKED C=CCC[C@H](C(=O)Nc1cccc([C@H](C)OC)c1)c1ccccc1 488339195 MVGCIQRKHZXFGG-JXFKEZNVSA-N 323.436 5.083 30 20 DKED C=CCC[C@@H](C(=O)Nc1cccc([C@H](C)OC)c1)c1ccccc1 488339197 MVGCIQRKHZXFGG-OXJNMPFZSA-N 323.436 5.083 30 20 DKED CC(C)c1ccccc1NCc1cccc(OCCCC#N)c1 533219374 AFJREUDVQKENKR-UHFFFAOYSA-N 308.425 5.105 30 20 DKED Cc1csc(-c2cccc(N[C@@H](C)c3cccc(C#N)c3)c2)n1 540833677 QRDMUVZEYQMGBZ-AWEZNQCLSA-N 319.433 5.163 30 20 DKED C[C@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1cccc(C#N)c1 925186374 WLMBTFDIUVQRSJ-WDEREUQCSA-N 324.371 5.050 30 20 DKED N#Cc1ccccc1-c1ccc(CSCc2nccs2)cc1 446965185 KYBSTOLDWYZVSS-UHFFFAOYSA-N 322.458 5.115 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1CC 475578155 MMUPHGJMFFUXTC-DOTOQJQBSA-N 314.473 5.191 30 20 DKED Cc1ccccc1[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 479765899 KQESMCAJTDJCNL-GDBMZVCRSA-N 310.466 5.420 30 20 DKED C=C(C)[C@H](N[C@@H](C)c1ccc(F)cc1)c1ccc(F)c(F)c1 480658609 LALWNSISXZUARL-SGTLLEGYSA-N 305.343 5.072 30 20 DKED CC(C)(CCC#N)CNc1ccccc1COCc1ccccc1 539925248 UXBAGBXFAONWIV-UHFFFAOYSA-N 322.452 5.145 30 20 DKED N#C[C@@H](Cc1ccccc1)Sc1c(Cl)cccc1Cl 603451587 GNCHWFSAYDHMSJ-GFCCVEGCSA-N 308.233 5.220 30 20 DKED CCOc1ccccc1[C@@H](CC)N[C@@H](CC)c1ccc(C#N)cc1 447546767 YQYABJQJDYXAIH-VQTJNVASSA-N 322.452 5.149 30 20 DKED CC#CCCCC(=O)N1CCCC[C@H]1c1ccc(C(C)C)cc1 466238095 BLSPUIBHUTWEDI-FQEVSTJZSA-N 311.469 5.057 30 20 DKED C[C@H](N[C@H](CCCC#N)c1ccccc1)[C@H](C)c1ccccc1 559863339 RTUVWVCIGCSIOO-BBTUJRGHSA-N 306.453 5.203 30 20 DKED C[C@H](SCc1csc(C(C)(C)C)n1)c1ccc(C#N)cc1 609825718 PKRZBEKZFXWZNX-LBPRGKRZSA-N 316.495 5.307 30 20 DKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1coc2ccccc12 761477936 BXANHXIEZRPBBV-FPLPWBNLSA-N 323.348 5.078 30 20 DKED CC(/C=C/C(=O)c1cncs1)=C\c1ccccc1C(F)(F)F 799891665 AUSBSLCFFPQYIU-HRCSPUOPSA-N 323.339 5.004 30 20 DKED CC(CCCCC#N)=NNc1cc(C)c2ccc(C)c(C)c2n1 841613882 IBKBTEUNFRZBKW-UHFFFAOYSA-N 308.429 5.032 30 20 DKED C=CC[C@H](C)NCc1sc(Sc2ccccc2)nc1Cl 735085953 KLVVNRNKARIZNV-NSHDSACASA-N 324.902 5.002 30 20 DKED C=CCN(C(=O)Nc1ccc(-c2ccccc2)c(C)c1)C(C)C 762943693 YGRCHZGTEZZZTQ-UHFFFAOYSA-N 308.425 5.090 30 20 DKED CC[C@H](NCc1cc(C#N)ccc1F)c1cccc2ccccc12 783253908 LQCXYIHFTOZDNT-NRFANRHFSA-N 318.395 5.091 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccccc1Cl 799900139 GZIVRDPGYVSOLE-UHFFFAOYSA-N 316.857 5.268 30 20 DKED C=C1CCC(c2nc(-c3ccsc3C(F)(F)F)no2)CC1 904920989 ZVFUCJRIMJQOEU-UHFFFAOYSA-N 314.332 5.031 30 20 DKED CCCCCCCSc1nnc(-c2c[nH]c3ccccc23)o1 915790923 QHLALNANNGJMOD-UHFFFAOYSA-N 315.442 5.280 30 20 DKED C/C(=C\C(C)(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 185727518 SNNDFRFZUMQELS-FNDVETGQSA-N 316.470 5.012 30 20 DKED N#Cc1ccc(/C=C/c2ccc(-c3ccccc3Cl)o2)nc1 195673929 JVWUDMQWFKBDDT-BQYQJAHWSA-N 306.752 5.037 30 20 DKED CC(C)[C@H]1C[C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc21 447539385 ADOABYMEPJYDPZ-RVHYNSKXSA-N 304.437 5.093 30 20 DKED CCCCCCCC(=O)O[C@H](c1ccccc1)c1ccccn1 912909202 JBDPBBSDCQAUQV-HXUWFJFHSA-N 311.425 5.075 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCCC1(F)F 935606872 VWCMDVYPCDRXCE-OAHLLOKOSA-N 321.411 5.303 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cscc1C 475572413 YEELOHPVFHEXNM-UHFFFAOYSA-N 314.454 5.552 30 20 DKED N#Cc1c(Cl)cccc1SCc1ccc2ncccc2c1 547434812 XPZHEVBIEZQOOU-UHFFFAOYSA-N 310.809 5.052 30 20 DKED C[C@@H](N[C@H](C)c1cc2cc(Cl)ccc2o1)c1cccc(C#N)c1 611438791 SNRWHGKYZUVEMD-CHWSQXEVSA-N 324.811 5.370 30 20 DKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 747193617 KTXUGNKRJYJXOF-CABCVRRESA-N 318.486 5.049 30 20 DKED CC(C)c1ncc(/C=C\C(=O)c2ccc3cc(O)ccc3c2)s1 758434484 SDGIXGULNHLXQH-FPLPWBNLSA-N 323.417 5.021 30 20 DKED C=CC[C@@H](N[C@@H](C)c1cc2ccccc2s1)c1ccncc1 783243796 CAFGKMORMMDEOO-WMLDXEAASA-N 308.450 5.264 30 20 DKED CCCCCC(CCCCC)=NNc1ccc(C(=O)O)c(F)c1 1776074362 WIHNUKFRQCWGCA-UHFFFAOYSA-N 322.424 5.452 30 20 DKED Cc1cc(N[C@@H](CCC#N)c2ccccc2)c2cc(F)ccc2n1 301814536 ZMXSBBWBNREAHA-SFHVURJKSA-N 319.383 5.139 30 20 DKED CCc1ccccc1CNc1ccccc1SC[C@@H](C)C#N 438324826 FZHIIOBIOYSOBI-HNNXBMFYSA-N 310.466 5.113 30 20 DKED CC[C@H](N[C@H](CC(C)C)c1cccs1)c1ccc(C#N)cc1 447527683 FRZJYGCVYJVFLN-ZWKOTPCHSA-N 312.482 5.448 30 20 DKED C=CCOc1cccc(CN[C@H](C)c2cccc3ccccc23)c1 521823123 INHOUNFLNQUKNY-QGZVFWFLSA-N 317.432 5.255 30 20 DKED N#CCCC[C@@H](NCc1ccc(C2CCC2)cc1)c1ccccc1 555586902 KLPBKAIXIBNEAX-JOCHJYFZSA-N 318.464 5.479 30 20 DKED C=CC[C@@H](N[C@H](C)c1ccccc1SCC)c1ccncc1 766022987 YVEDNZQOMBYQIA-CRAIPNDOSA-N 312.482 5.162 30 20 DKED O=C(/C=C\c1nccc2ccccc12)c1cc2ccccc2s1 780189046 SQPIZOMDTLHRGM-KTKRTIGZSA-N 315.397 5.346 30 20 DKED CC(C)Oc1cccc(/C=C/C(=O)c2ccc(Cl)s2)c1 83194480 NDYZKAMVIPGBAF-VOTSOKGWSA-N 306.814 5.085 30 20 DKED C[C@@H](N[C@H](c1ccc(F)cc1)C(C)(C)C)c1ccc(C#N)cc1 195614546 AAGPACDQCUUSMF-AUUYWEPGSA-N 310.416 5.135 30 20 DKED C[C@@H](N[C@@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)cc1F 512655054 REYSRZBGIPKWHX-KUHUBIRLSA-N 310.416 5.135 30 20 DKED CC(C)Oc1c(Cl)cccc1N[C@@H](C)c1cccc(C#N)c1 611473266 UCOPDSXFECCNJJ-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED CCC[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc(C)cs1 733676531 ASRVIMLBKBLVPD-CVEARBPZSA-N 318.486 5.015 30 20 DKED Cc1c(C(=O)/C=C\c2ccc3ncccc3c2)oc2ccccc12 747139368 KZTROJDZWRQWKU-LUAWRHEFSA-N 313.356 5.186 30 20 DKED CCCCCC[C@@H](C)C(=O)[C@H](C#N)c1nccc2ccccc12 792091608 LUJJAFHJSJMHKI-CRAIPNDOSA-N 308.425 5.018 30 20 DKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/C(=O)c1cncs1 806573292 HTEWWQQYGRLQMC-VLHCFCLRSA-N 323.339 5.004 30 20 DKED CC(C)(C#N)[C@@H]1CCCC1=NNc1ccc(Cl)c(Cl)c1 814796850 SOJHWAKQBAYFIV-LLVKDONJSA-N 310.228 5.111 30 20 DKED O=C(/C=C\c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1F 916127505 AMZPQFFLHMFMCT-KXFIGUGUSA-N 313.130 5.168 30 20 DKED Cc1ccccc1[C@@H](Sc1cc(C#N)ccn1)c1ccccc1 71918223 JOGGGYYKMDBRMB-FQEVSTJZSA-N 316.429 5.143 30 20 DKED CC(C)(C#N)CCCSCc1csc(-c2ccsc2)n1 161667538 RKSYAJXQNPDHMT-UHFFFAOYSA-N 322.524 5.435 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)CC1(C)CCCCC1 330171022 DZTOUURUXNEEBC-UHFFFAOYSA-N 311.429 5.334 30 20 DKED N#CCC[C@@H](N[C@H]1CCCc2c(Cl)cccc21)c1ccccc1 349756915 JABNFHCRAVQXSZ-UXHICEINSA-N 324.855 5.352 30 20 DKED C[C@H](C#N)CSc1ccccc1NCc1cc2ccccc2o1 486431249 CPOOSCBBADLKGT-CQSZACIVSA-N 322.433 5.297 30 20 DKED C=CCC[C@@H](N[C@@H]1CCSc2c(F)cccc21)c1ccco1 513692073 YEMFQHPTJSOZDV-HZPDHXFCSA-N 317.429 5.253 30 20 DKED C[C@H]1CCC[C@H](C(=O)Nc2sc(-c3ccccc3)cc2C#N)C1 525559418 PMOVGJWBAFDSLV-ZFWWWQNUSA-N 324.449 5.052 30 20 DKED C[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1cc2ccccc2o1 594517002 UAEVNPDACOGRDQ-HNNXBMFYSA-N 316.404 5.034 30 20 DKED N#CCCC[C@H](N[C@H]1CCCc2ccc(F)cc21)c1ccccc1 340445563 FIAQUKZPQAPTLP-SFTDATJTSA-N 322.427 5.228 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1CC(C)(C)C1 459523216 IVUKUBIJKUAVQD-UHFFFAOYSA-N 314.473 5.191 30 20 DKED CCCC[C@H](CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 463772498 ATEDEYBTGGIUBA-CABCVRRESA-N 318.486 5.236 30 20 DKED C=C(C)[C@@H](CC(=O)Nc1c(C(C)C)cccc1C(C)C)OCC 533676625 JGDPWTWLGWRKPA-GOSISDBHSA-N 317.473 5.243 30 20 DKED CC(C)C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccccc1 537400345 XCMPREVWTRZBNH-QRWLVFNGSA-N 310.416 5.135 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1cc(Cl)sc1Cl 562039988 UPSFPIVFQWIZQY-VIFPVBQESA-N 305.274 5.035 30 20 DKED CC[C@H](N[C@H]1CCc2sc(Cl)cc21)c1ccc(C#N)cc1 579412990 DSZASJNKJFYKSW-GJZGRUSLSA-N 316.857 5.001 30 20 DKED C=CCCCCCN(C)C(=O)c1ccccc1SC(C)C 606815782 BRKUHWVMANTXNS-UHFFFAOYSA-N 305.487 5.006 30 20 DKED CC(C)Oc1ccccc1/C=C/C(=O)c1ccc(Cl)s1 916135861 XSTGMMLXBAFZHM-BQYQJAHWSA-N 306.814 5.085 30 20 DKED CCCC[C@H](CC)CC(CC)=NNc1ccc(C(=O)O)c(F)c1 1776077197 YYTHFSQGPYIVLJ-ZDUSSCGKSA-N 322.424 5.308 30 20 DKED Cc1cccc(NN=C(/N=N/c2ccccc2)c2ccccc2)c1 1857788264 TXSUIVPRHHQNTM-CUNNEBFQSA-N 314.392 5.553 30 20 DKED C[C@@H](Nc1ccc2oc3ccccc3c2c1)c1ccc(C#N)cc1 324243190 ZMHSFXJEDLUQQA-CQSZACIVSA-N 312.372 5.631 30 20 DKED Cc1oc2ccccc2c1CN[C@@H](CCCC#N)c1ccccc1 353916221 PANQGKOHJFWVRN-FQEVSTJZSA-N 318.420 5.266 30 20 DKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1ccc2ccccc2n1 727952513 JVETUBVXEWMUBQ-FUHWJXTLSA-N 322.452 5.408 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 747193620 KTXUGNKRJYJXOF-LSDHHAIUSA-N 318.486 5.049 30 20 DKED C[C@@H](Nc1cccc(C(F)F)c1Cl)c1ccc(C#N)c(F)c1 757661015 MCIQMEIEYCSKMC-SECBINFHSA-N 324.733 5.461 30 20 DKED Cc1ccc(C=NOc2ccccc2C(F)(F)F)cc1Cl 766454318 XIOMUWKGCDCWOE-UHFFFAOYSA-N 313.706 5.080 30 20 DKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1nc2ccccc2s1 784821394 PXZQYTOVSQREJA-KBPBESRZSA-N 314.454 5.079 30 20 DKED CCCCCCCCCN(C)C(=S)Nc1cccc(C)c1 918722878 MONXGOHBMHKOGR-UHFFFAOYSA-N 306.519 5.374 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H](C)C1 191482221 MKQYORSGHCJEBL-MRXNPFEDSA-N 314.473 5.192 30 20 DKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc2ccccc12 192943646 BXTLHJWEYUGYIJ-CVEARBPZSA-N 300.405 5.123 30 20 DKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C)c1 340450383 XYMNLQJLESLAAS-SFTDATJTSA-N 306.453 5.471 30 20 DKED CC[C@@H](N[C@@H](c1ccc(C)cc1)C1CC1)c1ccc(C#N)cc1 447547864 DUIJIQROAOQQJB-RTWAWAEBSA-N 304.437 5.059 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1CC 475578158 MMUPHGJMFFUXTC-WBVHZDCISA-N 314.473 5.191 30 20 DKED C=C(C)CN(CC)C(=O)Nc1ccccc1SC1CCCC1 520592151 XVWFNTFQOOVCQI-UHFFFAOYSA-N 318.486 5.151 30 20 DKED CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)cc1 538393279 LBLLLRUOPCJHHK-CVEARBPZSA-N 324.493 5.471 30 20 DKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2c(s1)CCCC2 539048178 BOCHFUWWJUYQLX-MAUKXSAKSA-N 324.493 5.323 30 20 DKED C[C@H](S[C@@H](C)c1ccc(F)cc1F)c1ccc(C#N)cc1 609825727 PWZKLXZNAGNWBA-RYUDHWBXSA-N 303.377 5.392 30 20 DKED C[C@@H](SCc1ccc2ccccc2n1)c1ccc(C#N)cc1 609901171 HNOGJHDWMDTVIH-CQSZACIVSA-N 304.418 5.101 30 20 DKED CC(=NNc1c(F)cccc1F)c1cccc(Cl)c1Cl 735614839 CPCACNITUABQPI-UHFFFAOYSA-N 315.150 5.108 30 20 DKED CC[C@H](Nc1cccc(SC(F)F)c1)c1ccc(C#N)cc1 774329157 JDNJSSRTEVMPOS-INIZCTEOSA-N 318.392 5.436 30 20 DKED O=C(/C=C\c1ccsc1Cl)c1c(F)cccc1Cl 809159702 VCCSMSNILIIQPU-PLNGDYQASA-N 301.169 5.090 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1sccc1C#N 52027827 YFDWVPIOEOBFTD-UHFFFAOYSA-N 312.438 5.119 30 20 DKED C[C@H](NC(c1cccs1)c1cccs1)c1cccc(C#N)c1 181980683 KKVYWEWQPFJTBT-ZDUSSCGKSA-N 324.474 5.121 30 20 DKED N#CC[C@@H]1CC[C@H](N[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 453296120 UAUBOTPRYVEBKS-YSSFQJQWSA-N 324.855 5.101 30 20 DKED C[C@H](Nc1cccc(C(F)F)c1Cl)c1cccc(C#N)c1 542680090 HEXJUYKIRVPXHD-JTQLQIEISA-N 306.743 5.322 30 20 DKED Cc1ccsc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 733749783 YTDBBZPZDHDEHV-BQYQJAHWSA-N 311.431 5.076 30 20 DKED C[C@H](Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 37071369 USYWEXVIFSKPGW-NSHDSACASA-N 305.208 5.233 30 20 DKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2ccccc2o1 90665430 FPROJCJMDUVDPD-QAPCUYQASA-N 304.393 5.128 30 20 DKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 170991780 OFEFNUXCKXYOGS-KGLIPLIRSA-N 314.429 5.251 30 20 DKED CC(C)Sc1ccc([C@H](C)NCCCC(C)(C)C#N)cc1 182098436 VKRJOBONEAFEQO-HNNXBMFYSA-N 304.503 5.168 30 20 DKED CC(C)C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1 192995067 PTULBWUGIFNNBK-UTKZUKDTSA-N 322.452 5.027 30 20 DKED N#CCC[C@H](NC1CC(c2ccccc2Cl)C1)c1ccccc1 352694174 VXSYNKWMWFMJQN-UHYCVJNDSA-N 324.855 5.221 30 20 DKED C=CCOc1cccc(CN[C@@H](C)c2oc3ccccc3c2C)c1 513104966 PJTBYZYIAZDMIV-INIZCTEOSA-N 321.420 5.157 30 20 DKED Cc1cccc(C)c1CNc1ccccc1S[C@H](C)CC#N 523127677 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N#Cc1ccc(CSCc2cc(Cl)cc3cccnc23)cc1 498115858 WBABLOSQWPDBKO-UHFFFAOYSA-N 324.836 5.193 30 20 DKED CC(C)C[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1 192995042 PTULBWUGIFNNBK-UWJYYQICSA-N 322.452 5.027 30 20 DKED Cc1noc(C2CC2)c1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 329088968 IGSWNAYGCKNMOE-NWANDNLSSA-N 302.418 5.055 30 20 DKED Cc1coc(-c2cc(N=C(O)[C@H]3CC34CCCC4)ccc2C)n1 330117974 XTRRXHZOVCRKFK-MRXNPFEDSA-N 310.397 5.127 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1csc(Cl)c1 340440604 CMKLRZXRPKWBCB-CZUORRHYSA-N 318.873 5.487 30 20 DKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 467118449 VXZAZMHPORZNBG-SJORKVTESA-N 322.452 5.401 30 20 DKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)CCCC(C)(C)C#N 472439434 LXILAMYSAXLCSF-GFCCVEGCSA-N 313.272 5.316 30 20 DKED CC(C)c1ccc(NC(=O)c2ccc(CC#N)cc2)c(C(C)C)c1 535374301 ZOMFHBCJCSXDGM-UHFFFAOYSA-N 320.436 5.252 30 20 DKED C[C@H](SCc1cccc2cccnc12)c1ccc(C#N)cc1 609825614 IVHXQIICEJZZHR-AWEZNQCLSA-N 304.418 5.101 30 20 DKED CC(C)(CCC#N)CNCc1c(Cl)ccc(Cl)c1Cl 610271075 QVYPNOBDGSGISE-UHFFFAOYSA-N 319.663 5.066 30 20 DKED CCc1c([C@@H](C)NCc2ccc(C#N)cc2)oc2ccc(C)cc12 776154110 NEGAMSNTCFWEHW-OAHLLOKOSA-N 318.420 5.026 30 20 DKED C[C@@H](SCCCCC(C)(C)C#N)c1nc2ccccc2o1 435886602 ZMIKTDUPSGXGBY-CYBMUJFWSA-N 302.443 5.342 30 20 DKED C=CCCCN(C)C(=O)Nc1c(C)cc(Cl)c2ccccc12 462852274 DSLOPMQRRNOSTD-UHFFFAOYSA-N 316.832 5.232 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(C(C)C)c1C 506045242 APTAMQMAAYMGJP-UHFFFAOYSA-N 324.468 5.482 30 20 DKED N#CCC[C@@H](N[C@@H]1CCCc2ccc(Cl)cc21)c1ccccc1 539048287 DETVGWGDGWHPDB-WOJBJXKFSA-N 324.855 5.352 30 20 DKED CC(C)(C#N)CCCNc1ccc(COc2ccccc2)cc1 540194244 RNLISECEWOCZSK-UHFFFAOYSA-N 308.425 5.007 30 20 DKED C=CCC[C@H](N[C@@H]1CCCc2c(O)cccc21)c1ccccc1 565109656 HTELNAUDAYRVGU-VQTJNVASSA-N 307.437 5.067 30 20 DKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cccs2)cc1 741468662 GSKIJJJWBUTHKN-OUKQBFOZSA-N 320.413 5.320 30 20 DKED Clc1cccc(Cl)c1C=NNc1cccc2ccccc12 747060114 HWDSYMLJWWTOIY-UHFFFAOYSA-N 315.203 5.593 30 20 DKED Cc1ccc(F)c(C(=O)/C=C\c2cnc(-c3ccccc3)s2)c1 763287339 BONZOPRCMRCJPT-NTMALXAHSA-N 323.392 5.154 30 20 DKED CC(C)CCOc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1 863995727 FXAFZNKGIYFSSC-INIZCTEOSA-N 308.425 5.156 30 20 DKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C3CCC3)cc2)n1 192242126 OUVMHQMMUWBESN-MRXNPFEDSA-N 324.449 5.024 30 20 DKED N#CCC[C@H](NCc1c(Cl)oc2ccccc12)c1ccccc1 341518359 XFZMRWOZNKDIAF-KRWDZBQOSA-N 324.811 5.221 30 20 DKED N#CC1(CCSCc2csc(C3CC3)n2)CCCCC1 419438531 ONDWPTGMGYKXSH-UHFFFAOYSA-N 306.500 5.118 30 20 DKED O=C(/C=C/c1ccc(Cl)cc1)c1cccc(-c2ccncc2)c1 741471595 BOBKWRFJTWIACR-RMKNXTFCSA-N 319.791 5.298 30 20 DKED CCC[C@@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748618323 HFSMZWGJJKJTET-OXQOHEQNSA-N 320.436 5.107 30 20 DKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccccc1OC(F)F 794930993 IICXABLKPAOXNQ-JXMROGBWSA-N 324.273 5.122 30 20 DKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C#N)cc1 7668983 YNRHJWOMXGWSAJ-UHFFFAOYSA-N 306.409 5.057 30 20 DKED CCCCCCC[C@@H](O)CCCCCCCCCC(=O)O 85885646 CJUFNCPPYUSJPR-QGZVFWFLSA-N 300.483 5.303 30 20 DKED C[C@H](SCc1cc(-c2ccccc2)on1)c1cccc(C#N)c1 443145000 MDTNIMFMNCRAFN-AWEZNQCLSA-N 320.417 5.208 30 20 DKED CCC(C)(C)OCc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1C 447588659 VRVBEMUZCREMQC-WMZOPIPTSA-N 314.473 5.195 30 20 DKED CC(C)CCc1nc(CSCCCC(C)(C)C#N)cs1 480369780 IGIFJNQHJLIIJG-UHFFFAOYSA-N 310.532 5.295 30 20 DKED O=C(/C=C/c1cnc(C2CCC2)s1)c1coc2ccccc12 747706293 UDHAVDQWNVQBLV-CMDGGOBGSA-N 309.390 5.053 30 20 DKED CCCCCCC[C@@H](NCc1cscn1)c1ccccc1 765511344 WYAOYDIEDZJSCX-GOSISDBHSA-N 302.487 5.335 30 20 DKED N#C[C@H]1CC[C@@H](Nc2ccccc2SCc2ccccc2)C1 799721951 BQLUPKXEAHVBGK-DLBZAZTESA-N 308.450 5.083 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C1CCC(C)(C)CC1 330192102 XNBOZWQUZBPXRS-UHFFFAOYSA-N 311.429 5.190 30 20 DKED C[C@@H](NCCCCC#N)c1ccccc1-c1ccc(Cl)cc1 538215953 VWRDBFZYPVFHMT-OAHLLOKOSA-N 312.844 5.351 30 20 DKED CC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)cc1 540705563 TZPSNTLPFSBAKT-XIKOKIGWSA-N 316.807 5.153 30 20 DKED C[C@@H](Nc1cccc(N2CCCCCC2)c1)c1ccc(C#N)cc1 540834781 AIJDNQFDBGSYAR-QGZVFWFLSA-N 319.452 5.112 30 20 DKED CC(C)Oc1cccc(/C=C\C(=O)c2ccccc2Cl)c1 921261897 WLHXEBYPMDVYEH-KHPPLWFESA-N 300.785 5.023 30 20 DKED C[C@H](N[C@@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 174358467 UNSBDNIFOHUVFT-HOTGVXAUSA-N 300.405 5.123 30 20 DKED C[C@H](Nc1ccccc1Cc1ccccc1)c1cccc(C#N)c1 324186325 IVTVJKSCGLTWLY-KRWDZBQOSA-N 312.416 5.322 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1C 475579651 BVMASNQCLGZPEP-UHFFFAOYSA-N 322.452 5.169 30 20 DKED C=CCCCN(C)C(=O)Nc1ccc(SC2CCCC2)cc1 532505930 LEETXOBTOPMBDY-UHFFFAOYSA-N 318.486 5.151 30 20 DKED Cc1ccc(-c2ccccc2NCc2ccc(C#N)cc2F)s1 864018164 NPOBVVUEOQRUKT-UHFFFAOYSA-N 322.408 5.346 30 20 DKED C=CCCCS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 588913435 KZQHGUFKVWMUJT-HNNXBMFYSA-N 305.487 5.145 30 20 DKED N#C[C@@H]1CC[C@H](Sc2ccc(Cl)c(C(F)(F)F)c2)C1 430089428 NHTYACKMCHLQRV-BDAKNGLRSA-N 305.752 5.143 30 20 DKED C=C(C)[C@H](N[C@H](C)c1cc(C)oc1C)c1ccc(F)c(F)c1 447590337 BUMAFBMDSBKSDZ-XIKOKIGWSA-N 305.368 5.143 30 20 DKED Cc1cccc(C2(CNCC(C)(C)CCC#N)CCCCC2)c1 462686111 PZQDTYTWULOMHH-UHFFFAOYSA-N 312.501 5.117 30 20 DKED CCCC[C@H](CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 463772499 ATEDEYBTGGIUBA-GJZGRUSLSA-N 318.486 5.236 30 20 DKED CCC/C(C)=C/C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 729375565 LCJOMDKBCNQURZ-NTCAYCPXSA-N 320.392 5.035 30 20 DKED O=C(/C=C\c1ccc(F)cc1)c1ccc(SC(F)F)cc1 734981351 QFPMDHPDLGEPHR-KMKOMSMNSA-N 308.324 5.037 30 20 DKED CC(C)(C)c1ncc(/C=C/C(=O)c2cc3ccccc3o2)s1 736433366 SWBFEFCIYBBJER-CMDGGOBGSA-N 311.406 5.083 30 20 DKED CCCCCCCCC(=O)N1CCCCC[C@@H]1c1ccco1 736525845 JEJGWHOTMDRZCK-QGZVFWFLSA-N 305.462 5.474 30 20 DKED COCc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)c1 742429776 ZPCBAZJBNQEETC-YVMONPNESA-N 321.203 5.036 30 20 DKED CC#CCCCC(=O)Nc1ccc(SC(C)(C)C)cc1C 767072275 QJWLGJCZJODKJH-UHFFFAOYSA-N 303.471 5.018 30 20 DKED Cc1ccc(C(=O)/C=C\c2ncc(-c3ccccc3)s2)s1 770570637 IDZHDBCAHXTZGJ-NTMALXAHSA-N 311.431 5.076 30 20 DKED CCCCCc1ccc(NC(=S)Nc2ccccc2C#N)cc1 915996628 KHMPELMNKMJAOU-UHFFFAOYSA-N 323.465 5.100 30 20 DKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccccc1 1776785313 UEULUBLLBPYKRW-LJQANCHMSA-N 319.489 5.275 30 20 DKED Cc1coc(-c2ccc(C)c(N[C@@H](C)c3cccc(C#N)c3)c2)n1 180035031 UWWOLLYTVPQSTA-HNNXBMFYSA-N 317.392 5.003 30 20 DKED C=CCCc1ccccc1NC(=O)CCc1cc(Cl)cs1 410345541 QHLSQZFSPUBOEI-UHFFFAOYSA-N 319.857 5.091 30 20 DKED C=CCC[C@@H](Nc1ccc(C)c(-c2ncco2)c1)c1ccco1 565136980 IXVXEWAWTDZRPB-QGZVFWFLSA-N 308.381 5.362 30 20 DKED O=C(/C=C\c1ccc(-c2ccccc2)o1)c1ccc(F)cc1F 917516645 BWLXOLFYDIKVLR-YFHOEESVSA-N 310.299 5.121 30 20 DKED C[C@H](N[C@@H](C)c1cc(Cl)ccc1Cl)c1ccc(C#N)cc1 36991836 DGXHVGVHVRCKRD-RYUDHWBXSA-N 319.235 5.277 30 20 DKED N#Cc1c(F)cccc1Oc1ccc(Sc2ccncc2)cc1 60342696 UAONQSUKZGWXJZ-UHFFFAOYSA-N 322.364 5.036 30 20 DKED C=CCC[C@@H](N[C@@H](C)c1ccc(Cl)nc1)c1ccccc1 181508198 NJWJVGOARZAMSQ-WMLDXEAASA-N 300.833 5.093 30 20 DKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 340448043 IRMJZYQJTAISGS-KUHUBIRLSA-N 314.379 5.051 30 20 DKED CC(C)(C#N)c1ccccc1CSCCCCC(F)(F)F 507634291 MXZZGOBAIIIZJA-UHFFFAOYSA-N 315.404 5.454 30 20 DKED CC(C)c1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512625786 QMDQPIWONFCKGW-GJZGRUSLSA-N 310.416 5.233 30 20 DKED N#C[C@H](Sc1nc2ccc(Cl)cc2o1)C1CCCCC1 524534456 UXNBUBTUZJVQLB-AWEZNQCLSA-N 306.818 5.046 30 20 DKED CCN(CCC(C)(C)C#N)[C@@H](C)c1cccc(C(F)(F)F)c1 540665223 MXNOFZPXVCKEJO-ZDUSSCGKSA-N 312.379 5.028 30 20 DKED Cc1c(F)cccc1-c1ccc(CNc2ccc(CC#N)cc2)o1 546781786 KKEFAXQYZWJKDC-UHFFFAOYSA-N 320.367 5.072 30 20 DKED CC(C)[C@@H](NCC(C)(C)CCC#N)c1ccc(Cl)cc1F 554076447 DPJCNZLWOPBGBK-MRXNPFEDSA-N 310.844 5.096 30 20 DKED C[C@H](Nc1cc(Cl)c(Cl)cc1F)c1cccc(C#N)c1 600853924 JUOKLLWNHSBWPB-VIFPVBQESA-N 309.171 5.177 30 20 DKED C[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)C1CCCCC1 726317718 CTAWIOLLILJREJ-YJBOKZPZSA-N 320.436 5.018 30 20 DKED CC(=NNc1cccc(F)c1F)c1cc(Cl)sc1Cl 743442824 IEMNMBJMYZHKQA-UHFFFAOYSA-N 321.179 5.169 30 20 DKED O=C(/C=C/c1cnc(C2CCC2)s1)c1ccc(F)c(Cl)c1 760262304 JHJURYIIDQZOTC-FNORWQNLSA-N 321.804 5.099 30 20 DKED C=CCCCCC[C@H](C)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 793556286 WPUNMWSCXMUIJH-PWIZWCRZSA-N 319.464 5.160 30 20 DKED Clc1ccccc1CNN=Cc1ccccc1-c1ccccc1 918152602 LXTWXHYESMZLOD-UHFFFAOYSA-N 320.823 5.131 30 20 DKED C[C@@H](Nc1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)cc1 182333139 INDJHQZQRRCYOQ-CYBMUJFWSA-N 318.342 5.226 30 20 DKED N#CCC(=O)Nc1ccc(Cl)cc1-c1cccc2ccccc12 447626894 QLEUCDYGLYALTE-UHFFFAOYSA-N 320.779 5.012 30 20 DKED CC(C)(C)CCCCC(=O)N[C@@H](CCCC#N)c1ccccc1 487218894 LISUHBZJEGSTJG-SFHVURJKSA-N 314.473 5.144 30 20 DKED N#Cc1ccc(CN[C@H]2CCc3ccc(-c4ccccc4)cc32)cc1 495195475 VMNGUTQMKWNMNU-QHCPKHFHSA-N 324.427 5.002 30 20 DKED Cc1ccc(C2CC(N[C@@H](CCCC#N)c3ccccc3)C2)cc1 519690143 QCVYALNJQAVMHS-HRTMPFAESA-N 318.464 5.266 30 20 DKED C[C@@H](CCc1ccccc1F)N[C@@H](CCCC#N)c1ccccc1 568116561 FWXCFEUHKAJVSP-UWJYYQICSA-N 324.443 5.172 30 20 DKED Cc1cccc(C(=O)/C=C/c2csc(-c3cccs3)n2)c1 728439535 MKTMSKCIHFFPPA-BQYQJAHWSA-N 311.431 5.076 30 20 DKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cccc(F)c3)s2)cc1 734303573 VAOZOCZSBOUKHR-MDZDMXLPSA-N 323.392 5.154 30 20 DKED C=CCCCCCN(C)C(=S)Nc1c(CC)cccc1CC 739457249 JSMZYUAYIHMVFY-UHFFFAOYSA-N 318.530 5.186 30 20 DKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(C#N)s2)cc1 748997167 GXZPBPRVAGIOGQ-KTKRTIGZSA-N 313.447 5.016 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)c(C)s1 189868120 CWAAJSDSJGYHOY-UHFFFAOYSA-N 313.466 5.469 30 20 DKED C[C@H](c1ccccc1Cl)N(CCCC(C)(C)C#N)C1CC1 472444944 UEJVJDCUFZOVQY-CQSZACIVSA-N 304.865 5.195 30 20 DKED N#Cc1ccccc1-c1ccc(CSc2ccccc2O)cc1 507939631 SRYQJGPJQHBFLM-UHFFFAOYSA-N 317.413 5.223 30 20 DKED CCC[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1F 540594503 KPVJKOLGGFINLI-YJYMSZOUSA-N 314.379 5.028 30 20 DKED CSc1ccc(Cl)cc1N[C@H](C)c1cccc(C#N)c1 540833621 OMJGAVUCENDMLI-LLVKDONJSA-N 302.830 5.107 30 20 DKED CC(C)(C#N)CCSc1ncc(-c2ccc(Cl)cc2)o1 610285810 AABOZBKSRFGXFS-UHFFFAOYSA-N 306.818 5.027 30 20 DKED Cc1ccccc1C=NOCc1csc(C2CCCCC2)n1 744180221 OQUIHYHCTLRJHC-UHFFFAOYSA-N 314.454 5.050 30 20 DKED Cc1cccc2c1[C@H](C)/C(=C\c1cnc(C3CCC3)s1)C2=O 766695194 HRPVMRMNIGPXNA-GFQQVXNGSA-N 309.434 5.102 30 20 DKED CCCCC[C@@H](CC)C(=O)[C@H](C#N)c1ccc2ccccc2n1 776073914 DQDADYBEXJTMKL-NVXWUHKLSA-N 308.425 5.018 30 20 DKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 303775056 NNFAACHCFTZYBD-INIZCTEOSA-N 314.388 5.524 30 20 DKED C=CCOc1ccc(CN[C@@H](CC)c2ccc(Cl)cc2)cc1 315558562 NUTNVRCVUIKATO-IBGZPJMESA-N 315.844 5.146 30 20 DKED C=CCC[C@@H](NCc1ncc(C(C)(C)C)s1)c1ccccc1 447899136 QPSLXQHUADYYFO-MRXNPFEDSA-N 314.498 5.238 30 20 DKED CCc1cccc(CNc2ccccc2S[C@@H](C)CC#N)c1 468962984 KORADCJQZVDKSW-HNNXBMFYSA-N 310.466 5.255 30 20 DKED C=CCC[C@@H](C(=O)Nc1ccccc1SC)c1ccccc1 487650654 IMFXVLDYVYXTPV-MRXNPFEDSA-N 311.450 5.097 30 20 DKED Cc1cc(CN[C@H](C)c2cc(Cl)ccc2Cl)ccc1C#N 488165832 IKOOFBHYILRJQZ-GFCCVEGCSA-N 319.235 5.024 30 20 DKED C[C@@H](N[C@@H](CC1CCC1)c1ccccc1)c1cccc(C#N)c1 495401143 JMJMVDHELXVDOZ-IERDGZPVSA-N 304.437 5.140 30 20 DKED CC(C)C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccs1 561139585 DXFPTKPCURMCDJ-OALUTQOASA-N 324.493 5.374 30 20 DKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 734079483 QJOFDEXUNVHVOA-WMZOPIPTSA-N 320.436 5.018 30 20 DKED CC(C)CCCCCC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 749041298 OZMKLTWKQPESGC-CQSZACIVSA-N 306.475 5.049 30 20 DKED C=CCCCN(C)C(=O)Nc1ccccc1SC1CCCC1 303833275 KVWGGDBTMBURRT-UHFFFAOYSA-N 318.486 5.151 30 20 DKED Cc1cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(C)s1 340451872 PXAYDCSJTVNRHL-KXBFYZLASA-N 312.482 5.451 30 20 DKED C=CCC[C@@H](NC(=O)c1cccc(C(F)F)c1)c1ccccc1 435283448 XVPBOPLHNRXODV-QGZVFWFLSA-N 315.363 5.062 30 20 DKED Cc1sc2ncnc(SCCCCC(C)(C)C#N)c2c1C 436136145 GNWMTLWSWBNVPS-UHFFFAOYSA-N 319.499 5.120 30 20 DKED CC(C)(C)[C@@H](NCc1cccc(C#N)c1)c1cc2ccccc2o1 497807593 CWKCRLVURFIVNZ-FQEVSTJZSA-N 318.420 5.181 30 20 DKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1cccc(C)c1)c1ccccc1 535367142 DLQTZGPHHXSCCA-RXVVDRJESA-N 319.448 5.018 30 20 DKED C#Cc1cccc(NC(=S)Nc2ccccc2CCC(C)C)c1 726485450 QIQQJTIFJFOPFA-UHFFFAOYSA-N 322.477 5.065 30 20 DKED C[C@@H](Sc1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 735616692 FDOBJOHCWHGOLZ-LLVKDONJSA-N 307.340 5.430 30 20 DKED C/C(=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)(C)C 742654342 UVXGCIQDJFUPNL-FNDVETGQSA-N 316.470 5.012 30 20 DKED C=CC[C@H](N[C@@H](C)c1ccc(C(C)(C)C)cc1)c1ccncc1 746048113 WBCBNZPANKAGPT-JXFKEZNVSA-N 308.469 5.347 30 20 DKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1ccc(Cl)s1 761474705 MPVNLEYGTNBAKR-UTCJRWHESA-N 323.801 5.046 30 20 DKED CCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 781505705 AMOCGSVUJZYNNE-KSSFIOAISA-N 320.502 5.439 30 20 DKED C=CCCCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 175363133 ROSYACKXUGNBKJ-HNNXBMFYSA-N 312.240 5.013 30 20 DKED Cc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1C(F)(F)F 314790482 KAILGWXWZNRNEN-LBPRGKRZSA-N 304.315 5.059 30 20 DKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)CC1CCCCCC1 330125805 MDPPWYINVDEIDU-UHFFFAOYSA-N 311.429 5.334 30 20 DKED C[C@H](N[C@H](c1ccccc1)C(C)(C)C)c1ccc(C#N)cc1F 512655053 REYSRZBGIPKWHX-IFXJQAMLSA-N 310.416 5.135 30 20 DKED CC[C@@H](Nc1cccc(C2CCOCC2)c1)c1ccc(C#N)cc1 527992673 BGXDUJWAFKFZST-OAQYLSRUSA-N 320.436 5.015 30 20 DKED CC[C@H](C)C(C)=NNc1nc2cc(C(F)(F)F)ccc2s1 743445469 VYWCQOIWRUUXOG-QMMMGPOBSA-N 315.364 5.149 30 20 DKED CC(C)(C)Sc1ccc(NCc2cccc(F)c2C#N)cc1 864009956 DFACBXKHROPEGA-UHFFFAOYSA-N 314.429 5.200 30 20 DKED O=C(/C=C/c1cccs1)c1ccc(N2CCCCCC2)cc1 916132374 AONWQPTZRIJMEN-VAWYXSNFSA-N 311.450 5.025 30 20 DKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2ccccc21 72030977 IQWFTKMZTLGIRY-UKTHLTGXSA-N 323.442 5.084 30 20 DKED CCSc1ccccc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 90664721 NRVPSTWCRQWPHV-LPHOPBHVSA-N 324.493 5.494 30 20 DKED Cc1ccc2oc(CN(CCCCC#N)Cc3ccco3)cc2c1 133765492 DWIJTYJWDKOPDM-UHFFFAOYSA-N 322.408 5.030 30 20 DKED CC(C)(C#N)CCCSCc1coc(-c2cccc(F)c2)n1 161405771 BBICXVXUTXZDHG-UHFFFAOYSA-N 318.417 5.044 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1C 189877945 RFWCRLPOQCGMCK-UHFFFAOYSA-N 321.464 5.418 30 20 DKED CCc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 321676331 VNJUALANIUBTIA-MRXNPFEDSA-N 308.425 5.105 30 20 DKED CC1(C)CCC(/N=C(/O)C(C2CCC2)C2CCC2)(C(=N)O)CC1 329627789 HAMOALRTAFKVKI-UHFFFAOYSA-N 320.477 5.034 30 20 DKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 340448039 IRMJZYQJTAISGS-AUUYWEPGSA-N 314.379 5.051 30 20 DKED C[C@H](S[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1 437279678 YBUSSMARMSQEIC-QWHCGFSZSA-N 312.394 5.022 30 20 DKED CC(C)[C@H]1C[C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc21 448020059 ADOABYMEPJYDPZ-IPHXSNPTSA-N 304.437 5.093 30 20 DKED CC1(C)C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 520850945 MZILGMGQJGDVJK-SFTDATJTSA-N 318.464 5.434 30 20 DKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1CCC1)c1ccc(C#N)cc1 539496820 MESCNTHNZCZESR-XOBRGWDASA-N 324.855 5.404 30 20 DKED Cc1cc(C)cc(NN=Cc2c(Cl)cccc2OC(F)F)c1 732924291 WFBWTDMFEHDPEM-UHFFFAOYSA-N 324.758 5.004 30 20 DKED C=C1CCC(c2nc(-c3c(Cl)cccc3Cl)no2)CC1 904306169 DLKFYNMJJMIDQK-UHFFFAOYSA-N 309.196 5.257 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C=C)cc1 192222658 DYKSGSLAWZMJSY-UHFFFAOYSA-N 305.421 5.434 30 20 DKED N#CCCC[C@H](NCc1cccc2ccccc12)c1ccccc1 552313207 UOUDZCAXTANYSC-QFIPXVFZSA-N 314.432 5.365 30 20 DKED Cc1cc(C)c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1C 577634390 PONOLNLNSWRPIQ-UGKGYDQZSA-N 320.480 5.698 30 20 DKED C=CCC[C@H](NC(=S)Nc1ccc(C)cc1C)c1ccccc1 771850428 KRDWFTWMDTVAEB-IBGZPJMESA-N 324.493 5.297 30 20 DKED O=C(/C=C\c1cc2ccccc2o1)c1c(F)cccc1Cl 809159152 JGWPPFWHCHHMOR-HJWRWDBZSA-N 300.716 5.121 30 20 DKED C[C@H](Nc1ccc(OC2CCCC2)c(F)c1)c1cccc(C#N)c1 863996119 PQEJIUMKFPNICW-AWEZNQCLSA-N 324.399 5.192 30 20 DKED CCCCCCCCCCCN(C)c1nc(C)ccc1C(=O)O 1776787754 NCWFONITXNUSQE-UHFFFAOYSA-N 320.477 5.055 30 20 DKED Cc1noc(C)c1[C@H](C)C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@H]2C1 328676917 LTMCVDSDCMVVBA-ISWURRPUSA-N 318.461 5.100 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)CC=C 439388624 SMTJUDIJEVCBTJ-MRXNPFEDSA-N 300.446 5.015 30 20 DKED C=CCCc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1 505040239 TUXHJTNDHYYFRV-MRXNPFEDSA-N 308.425 5.030 30 20 DKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccsc2)cc1 741466676 AORCPYSXGVAGRH-DHZHZOJOSA-N 320.413 5.320 30 20 DKED CC(C)(CCC#N)CNc1ccc(N2CCCCC2)c(Cl)c1 770529907 XSZBPGGDDQBXGG-UHFFFAOYSA-N 319.880 5.072 30 20 DKED Cc1ncsc1C(=O)/C=C/c1cc(-c2ccccc2)cs1 917519350 QTPPSCNDIJFLPQ-BQYQJAHWSA-N 311.431 5.076 30 20 DKED CC(C)c1occc1/C(O)=N/[C@@H](C)c1nc(C(C)(C)C)cs1 331069760 BVOKTQPXFOQIDK-NSHDSACASA-N 320.458 5.223 30 20 DKED CC(C)c1ccc2c(c1)[C@H](N[C@H](C)c1ccc(C#N)cc1)CC2 427870202 ZBLFFRLSIGNGSO-QVKFZJNVSA-N 304.437 5.020 30 20 DKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cccc(C#N)c1 519907825 IHJBNWFEVWONQN-GFCCVEGCSA-N 319.235 5.058 30 20 DKED C=CCOc1cccc(CN[C@@H](c2ccccc2)C(C)(C)C)c1 520206898 YMUUGIVVDUXRHH-FQEVSTJZSA-N 309.453 5.128 30 20 DKED C[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1ccc(Cl)s1 594515600 OGOSBMCIYNGANA-GFCCVEGCSA-N 316.857 5.003 30 20 DKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc2ccccc2c1 619746597 BPNHCMNVXFVPFO-AWEZNQCLSA-N 320.823 5.216 30 20 DKED Cc1cc(F)ccc1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745989855 CWYARUBQYDEAGG-CLFYSBASSA-N 317.363 5.092 30 20 DKED CCCCCCCC(=O)Nc1ccccc1CCC(F)(F)F 757010334 JPAMTNSDDFJEDW-UHFFFAOYSA-N 315.379 5.481 30 20 DKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(C)c(C)c1 794993879 BRWGWDZMQGIQOB-UHFFFAOYSA-N 324.493 5.079 30 20 DKED C=CCCO[C@@H](C)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 921145853 IXGGDSQWXSCBJA-HNNXBMFYSA-N 323.396 5.022 30 20 DKED Cc1oc(-c2ccccc2)nc1CSCCCC(C)(C)C#N 161343010 WOTYINWPNLWBMY-UHFFFAOYSA-N 314.454 5.213 30 20 DKED CC(C)(C#N)CCCCN[C@@H](c1cccc(F)c1)C(C)(C)C 444684575 NCMPSZREGPXHQM-KRWDZBQOSA-N 304.453 5.223 30 20 DKED CC[C@@H](CNc1ccccc1S[C@H](C)CC#N)CC(F)F 594704636 CCHGMACTUYEXAA-CHWSQXEVSA-N 312.429 5.174 30 20 DKED Cc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)ccc1F 741468709 HEYSSUHOOCPIID-VURMDHGXSA-N 317.363 5.092 30 20 DKED CC(C)Oc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1Cl 97393720 GMOOKIVWFKLSNN-ZDUSSCGKSA-N 314.816 5.172 30 20 DKED CCCCCCCCCC(=O)CCCCCCCCC(=O)O 102184453 PEBIXVCZWGYSTN-UHFFFAOYSA-N 312.494 5.902 30 20 DKED N#CCC[C@H](N[C@@H]1CCCc2c(Cl)cccc21)c1ccccc1 349756916 JABNFHCRAVQXSZ-VQTJNVASSA-N 324.855 5.352 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)[C@@H](C)[C@@H]1C 417035374 FYKKECBNHGOUSZ-XHSDSOJGSA-N 314.473 5.047 30 20 DKED C=CCC(CC=C)C(=O)N(CC)[C@@H](C)c1cc2ccccc2o1 467822406 AVXQSCVKKLEEJY-HNNXBMFYSA-N 311.425 5.111 30 20 DKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2)c(C)c1 499741058 FPIIKLRTKZGZTE-CQSZACIVSA-N 324.449 5.010 30 20 DKED CC[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)s1 539497241 SAWCEEASBPFZQV-BXUZGUMPSA-N 304.846 5.075 30 20 DKED CC(C)C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccs1 594927977 RRJQBTXZOVSRSZ-GOSISDBHSA-N 324.493 5.180 30 20 DKED Cc1ccc2ccccc2c1CNc1ccccc1O[C@H](C)C#N 779743551 PJTNUXIDKODBTH-MRXNPFEDSA-N 316.404 5.051 30 20 DKED C=C(Cl)COc1ccc([C@H](C)NCc2cscc2C)cc1 786924502 BRQYVWBSMPEODZ-AWEZNQCLSA-N 321.873 5.039 30 20 DKED CCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nccc2ccccc12 792092061 OJWSIVHFQYSMGF-RXVVDRJESA-N 322.452 5.408 30 20 DKED C[C@@H](Sc1ccccc1C#N)c1ncc(-c2ccccc2)o1 173707488 ROSNTOMGQHBMSX-CYBMUJFWSA-N 306.390 5.067 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1CC 191414893 SCAJVVCTMQCHDQ-QGZVFWFLSA-N 314.473 5.335 30 20 DKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H](C)C1 191464910 DRACEWMBUGYDGS-HZPDHXFCSA-N 314.473 5.048 30 20 DKED C=CCCc1ccccc1NC(=O)[C@H](CC=C)c1ccccc1 410347016 XZAUXGUZGGIZRH-LJQANCHMSA-N 305.421 5.104 30 20 DKED CC[C@H](C)Sc1ccc(NCc2ccc(C#N)cc2)c(C)c1 498638843 OLXRQWJRZSMQJF-HNNXBMFYSA-N 310.466 5.369 30 20 DKED C=CCC[C@@H](Nc1cccc(C2CCOCC2)c1)c1ccco1 527995239 NAJFXKITUBKGEN-LJQANCHMSA-N 311.425 5.293 30 20 DKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(Cl)s1 574027230 HLSMESWSOVEXQU-XHDPSFHLSA-N 316.857 5.001 30 20 DKED CC(C)c1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 578562908 CWEFZKUSIAARCS-UWJYYQICSA-N 306.453 5.506 30 20 DKED C=CCCc1ccccc1NC(=S)Nc1ccc(Cl)cc1 799900794 PQDCCIYUTGKXCQ-UHFFFAOYSA-N 316.857 5.268 30 20 DKED C[C@H](N[C@H](C)c1csc(C(F)(F)F)c1)c1ccc(C#N)cc1 924785619 OTYPECAAZWEMHN-WDEREUQCSA-N 324.371 5.050 30 20 DKED CC(C)[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)cc1 502499742 HNCBQODIXSXNEC-HXUWFJFHSA-N 324.443 5.114 30 20 DKED C[C@@H](SCCCC1(C#N)CCOCC1)c1cccc(Cl)c1 507694319 KVWJQQMBLQIVLV-CQSZACIVSA-N 323.889 5.235 30 20 DKED CC(CSC(C)(C)C)=NNc1ccccc1C(F)(F)F 729632701 HJQJMFMZAULXAE-UHFFFAOYSA-N 304.381 5.025 30 20 DKED C[C@H](SCc1nc(Cl)ccc1Cl)c1cccc(C#N)c1 785536829 JOSIGRRZPNRKGI-JTQLQIEISA-N 323.248 5.254 30 20 DKED CCCCC[C@H](CC)C(=O)[C@@H](C#N)c1nccc2ccccc12 792104126 WUZFYNDFOBCTGL-YJBOKZPZSA-N 308.425 5.018 30 20 DKED C=CCC[C@H](NCc1csc(-c2ccoc2)n1)c1ccccc1 180046115 YWKRVZSLTIDFQQ-SFHVURJKSA-N 324.449 5.200 30 20 DKED C[C@@H](S[C@H](C)c1nc2ccccc2o1)c1cccc(C#N)c1 190822436 JIVWYIMWZSZLKV-CHWSQXEVSA-N 308.406 5.255 30 20 DKED CCc1c([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)oc2ccccc12 325107855 BKPVXKFHXUYLSQ-HUUCEWRRSA-N 318.420 5.279 30 20 DKED Cc1cc(CN[C@@H](C)c2cccc(Cl)c2Cl)ccc1C#N 488105564 CVQZRTMDISYSRT-LBPRGKRZSA-N 319.235 5.024 30 20 DKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CC(C)(C)C 500766852 BYURMRQKJYGLOC-UHFFFAOYSA-N 322.408 5.034 30 20 DKED Cc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3cccs3)n1)C2 730948887 OCVQWVJCFPNEMM-UKTHLTGXSA-N 323.442 5.002 30 20 DKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]1c1cc(C)on1 820893028 FAYFOVDJLBKYTF-YJBOKZPZSA-N 320.477 5.033 30 20 DKED COc1cccc2cc(/C=C\C(=O)c3cc(C)sc3C)oc12 916156024 YBTOAHNGYNIARU-FPLPWBNLSA-N 312.390 5.016 30 20 DKED COc1cccc2cc(/C=C\C(=O)c3cc4ccccc4o3)oc12 213210497 BANKPVUBMOFRPU-KTKRTIGZSA-N 318.328 5.084 30 20 DKED CC[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1c(C)noc1C 329089876 ISEVJOXTTIABAQ-NXOAAHMSSA-N 318.461 5.306 30 20 DKED N#CCCC[C@@H](NC1CC(c2ccccc2F)C1)c1ccccc1 340448074 RBNIRONQYXWMPC-WIXQSORDSA-N 322.427 5.096 30 20 DKED COc1cccc(CCCSCCCCC(C)(C)C#N)c1 435880021 GXLWLWVRNRTVRS-UHFFFAOYSA-N 305.487 5.081 30 20 DKED C[C@@H](SCCC(C)(C)C#N)c1ccc(Cl)c(Cl)c1 463198207 LINUAYQWKMYCRD-SNVBAGLBSA-N 302.270 5.727 30 20 DKED C[C@H](NCC(C)(C)CCC#N)c1cccc(-c2ccccc2)c1 558244440 WWHXFDNYOJIYKS-KRWDZBQOSA-N 306.453 5.334 30 20 DKED Cc1ccc(Oc2ccccc2)c(NC(=O)CCCCCC#N)c1 588942421 AMCGKITWGZJHIQ-UHFFFAOYSA-N 322.408 5.200 30 20 DKED CC(C)[C@@H]1C[C@H](N[C@H]2CCc3cc(C#N)ccc32)c2ccccc21 618802159 CZEZDFQXZNQKBZ-FKBYEOEOSA-N 316.448 5.020 30 20 DKED CC[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 734080627 XTVJBMNGFVWDGQ-HZPDHXFCSA-N 324.424 5.001 30 20 DKED C=CCC[C@H](NC(=S)Nc1c(C)cccc1C)c1ccccc1 771848567 AZRSEVRQLZMDCK-SFHVURJKSA-N 324.493 5.297 30 20 DKED C#CC[C@@H](N[C@@H](C)c1cc2ccccc2s1)c1ccccc1 783258403 HVZFNDMSIAGLQU-MAUKXSAKSA-N 305.446 5.317 30 20 DKED CC1(C)CCCC[C@H]1CC(=O)[C@@H](C#N)c1nccc2ccccc12 792108096 XPPBFVCRUQHDTA-FUHWJXTLSA-N 320.436 5.018 30 20 DKED C=C(C)c1cccc(NC(=O)N(CC)[C@H](CC)c2ccncc2)c1 934875540 GLXLTXGHCSRIHZ-LJQANCHMSA-N 323.440 5.120 30 20 DKED