smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCOc1cc(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc(Cl)c1O 218529797 XTZXAJCVEVCPES-HXUWFJFHSA-N 464.949 5.496 70 20 JKID Cc1noc(C)c1COc1ccc(CC(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)cc1 217129979 AUJHORCWFHDVNS-UHFFFAOYSA-N 489.959 5.957 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccccc1Oc1ccccc1)c1ccc(Br)cc1 217581504 QEYNPGKQZMOJGG-NRFANRHFSA-N 453.336 5.447 70 20 JKID COc1cc(CNC2CCN(C(=O)c3ccccc3)CC2)ccc1OCc1ccc(Cl)cc1Cl 217022493 KYKLQNBRPMVHOS-UHFFFAOYSA-N 499.438 5.975 70 20 JKID O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 217609229 AWGZFCPHTPSSNQ-XMMPIXPASA-N 468.534 5.452 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(C)cc1 217160501 AISPYNYVRUOBBA-OAQYLSRUSA-N 475.643 5.327 70 20 JKID O=C(CCCNC(=O)c1ccc(Cl)cc1)Nc1ccc(-c2nc3ccccc3s2)cn1 216716255 SQACEIFRZLSSNK-UHFFFAOYSA-N 450.951 5.160 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3OCc3ccc(Cl)cc3)CC2)cc1 217076911 IFANNFYVJAXNBF-UHFFFAOYSA-N 493.003 5.352 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccnc2)n1Cc1ccccc1 217155718 NISKVFOEQXLNOZ-NRFANRHFSA-N 475.643 5.078 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(N(CC)CC)cc2)n1C 217159351 SYQIDOJALYZIIP-HXUWFJFHSA-N 469.680 5.018 70 20 JKID COc1ccc([C@H](CNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c2c[nH]c3ccccc23)cc1 218530075 HXFDWIOZKBOSRB-KMRXNPHXSA-N 483.593 5.054 70 20 JKID Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccccc2Br)n1Cc1ccco1 218673405 JWPGHHJDJLQKKP-INIZCTEOSA-N 497.418 5.777 70 20 JKID Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)cc12 216849767 FVCZXVHMIXEDLW-UHFFFAOYSA-N 463.990 5.743 70 20 JKID Cc1cc(NC(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)n(-c2ccc(F)cc2)n1 217358847 TWHOVVGMFRVCIA-UHFFFAOYSA-N 481.881 5.242 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)cc1)C(F)F 216865116 KYFBFTXNCFYWFT-UHFFFAOYSA-N 475.517 5.362 70 20 JKID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)c1cnc2sccn2c1=O 217026493 HZLUNDKPEKDQQB-INIZCTEOSA-N 483.380 5.106 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccnc2)n1Cc1ccccc1 217155712 NISKVFOEQXLNOZ-OAQYLSRUSA-N 475.643 5.078 70 20 JKID O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)N1CC=C(c2ccc(O)cc2)CC1 216884962 PBYPMQGPOSSSHF-UHFFFAOYSA-N 468.582 5.048 70 20 JKID Cc1cc(Br)cc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c1NC(=O)OC(C)(C)C 865209783 GXLOAWPCBBEMKA-UHFFFAOYSA-N 487.347 5.015 70 20 JKID Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216754857 QUHSIHMKKOEWHW-UHFFFAOYSA-N 464.909 6.367 70 20 JKID CCOC(=O)c1c(NC(=O)c2cc3sc4ccccc4c3s2)sc(C(=O)NC)c1C 216858944 PVOSWAMNTDQDEM-UHFFFAOYSA-N 458.586 5.275 70 20 JKID Cc1occc1-c1nnc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1Cc1ccccc1 216866400 VMUWHHWNLJVTMI-UHFFFAOYSA-N 475.542 5.183 70 20 JKID Cc1sc2ncn(NC(=O)c3csc(-c4cccc(Cl)c4)n3)c(=O)c2c1-c1ccccc1 216821214 JJHPOUZVADIJRQ-UHFFFAOYSA-N 478.986 5.594 70 20 JKID CSc1ccccc1C(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 216644895 SOPXJJZTKCGTEY-UHFFFAOYSA-N 450.629 6.324 70 20 JKID O=C(c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1)N1CC=C(c2ccc(O)cc2)CC1 216853388 GUWJUVHIFMYEST-UHFFFAOYSA-N 470.613 5.154 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(Br)cc2)o1 217143198 NVAARCVTVLSJFZ-HNNXBMFYSA-N 464.410 5.189 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2F)n1CC(C)C 217138237 OGTGYMHCWDWFSW-LJQANCHMSA-N 458.628 5.430 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccccc1Oc1ccccc1)c1ccc(Br)cc1 217581595 QEYNPGKQZMOJGG-OAQYLSRUSA-N 453.336 5.447 70 20 JKID CCOc1ccc(-n2c(SCc3cnn(-c4ccccc4)c3)nnc2-c2cccnc2)cc1 217494778 FBGCSFGJNKOSSL-UHFFFAOYSA-N 454.559 5.206 70 20 JKID Cc1cc(I)ccc1NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F 217162440 BHXUZKYBZYWNBZ-UHFFFAOYSA-N 471.220 5.056 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccccc1Cc1ccccc1)c1ccc(Br)cc1 217142661 WNMRTHJVVYEIFK-QHCPKHFHSA-N 451.364 5.246 70 20 JKID CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc(C(C)C)nc2onc(C)c12 217960883 ONGAXQOZWXTMNA-UHFFFAOYSA-N 453.930 5.410 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2scc(-c3cccs3)c2c(=O)n1C 217155574 FEGIIJCYNMIBQC-HNNXBMFYSA-N 487.697 5.413 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(Br)cc1 216761329 VLZBLPVXWJLHKY-MRXNPFEDSA-N 463.681 5.327 70 20 JKID Cc1cc(-c2cc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)c3cnn(C(C)C)c3n2)c(C)s1 217971575 FXERWXDOSYUPLR-UHFFFAOYSA-N 472.614 5.993 70 20 JKID CCCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)NCc1ccc(Oc2ccc(F)cc2)cc1 217441157 BVOQIUYHWDTBQE-UHFFFAOYSA-N 494.954 5.630 70 20 JKID O=C(CSc1ccccc1C(=O)N1CC=C(c2ccc(O)cc2)CC1)NCC1CCCCC1 216883765 DDWDGHMEPNLNDM-UHFFFAOYSA-N 464.631 5.110 70 20 JKID O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)C1)Nc1cccc(F)c1 216782656 DCAOQNZJRNNCMC-CWFSZBLJSA-N 463.475 5.008 70 20 JKID COc1ccc([C@H](CC(=O)N(Cc2sccc2C)c2ccc(F)c(Cl)c2)NC(C)=O)cc1 217806805 NUMDBKIDXOBDNJ-QFIPXVFZSA-N 474.985 5.658 70 20 JKID COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc(C(C)C)nc3onc(C)c13)CC2 217953466 XSLAZYKFUAECTO-SANMLTNESA-N 471.557 5.460 70 20 JKID O=C(CSc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1)NC[C@H](O)c1ccccc1 217147271 QEDUZJAGEVDLHB-NRFANRHFSA-N 499.423 5.183 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(N(CC)CC)cc2)n1C 217159361 SYQIDOJALYZIIP-FQEVSTJZSA-N 469.680 5.018 70 20 JKID CC(=O)N[C@@H](CC(=O)NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(Br)cc1 217626745 SLFYHMXSQMMCDR-IBGZPJMESA-N 498.402 5.203 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2C)n1Cc1ccco1 217158904 HXAVONHYVQGVIS-OAQYLSRUSA-N 478.643 5.584 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1 217154140 RJWXNUVKOWONHR-QFIPXVFZSA-N 475.639 5.134 70 20 JKID COc1cccc([C@H](CNC(=O)N2CCC[C@@H]2c2cccn2C)c2c[nH]c3ccccc23)c1OC 217423659 RLXFZIRBZOCMKK-WIOPSUGQSA-N 472.589 5.202 70 20 JKID COc1ccc([C@@H]2CCCN2C(=O)CSc2nc(-c3ccc(F)cc3)cs2)cc1OC 218622765 IEOOIAKLNCWPMC-IBGZPJMESA-N 458.580 5.422 70 20 JKID Cc1csc(SCc2c(C(=O)N3CC=C(c4ccc(O)cc4)CC3)oc3ccccc23)n1 216886958 SIZHIFNERRPGHC-UHFFFAOYSA-N 462.596 6.125 70 20 JKID C[C@@H](Cc1nnc(S[C@H](C)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)o1)c1ccccc1 218665841 ZMUHCCWTHUBSES-VHSXEESVSA-N 457.424 5.231 70 20 JKID COc1ccc([C@H]2CCCN2C(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)cc1OC 218314927 IAIQFEVLGOHPGH-AREMUKBSSA-N 466.581 6.134 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 217155690 IRNMZLKEYDATAD-JOCHJYFZSA-N 492.645 5.822 70 20 JKID Cc1occc1-c1nnc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1-c1ccccc1 216868410 VTEJQBJSZGUNMD-UHFFFAOYSA-N 461.515 5.124 70 20 JKID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@@H](C)C(=O)Nc3c(C)cc(C)cc3Cl)cc2)cc1 218726891 HYNXNMWGAINZAJ-SFHVURJKSA-N 472.010 5.505 70 20 JKID COc1cc(CNC2CCN(C(=O)c3ccccc3)CC2)ccc1OCc1ccc(Cl)cc1 217022440 AEDHLGABQBDOJM-UHFFFAOYSA-N 464.993 5.322 70 20 JKID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@H](C)C(=O)Nc3cc(Cl)ccc3F)cc2)cc1 218727334 UMTWORDPKFHLJJ-OAHLLOKOSA-N 461.946 5.027 70 20 JKID O=C(c1ccc2c(=O)n(-c3ccccc3F)c(=S)[nH]c2c1)N1CC=C(c2ccc(F)cc2)CC1 217034365 LHAMJBJSXLWTPG-UHFFFAOYSA-N 475.520 5.256 70 20 JKID CCOc1ccccc1Nc1nnc(SCC(=O)N2CCc3sccc3[C@H]2CC)s1 217154571 MHOBXEZSOZZUGT-MRXNPFEDSA-N 460.650 5.370 70 20 JKID CC(C)C[C@H](NC(=O)CSc1nnc(C2CC2)n1Cc1ccccc1)c1nc2ccccc2[nH]1 217145000 NLMPNQFMIULSMX-QFIPXVFZSA-N 474.634 5.076 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)[C@H](C)c1nc2ccccc2s1 216851332 XMOSZTYNRWNSKL-LJQANCHMSA-N 451.595 6.582 70 20 JKID CCOc1ccc(-n2c(S[C@@H](C)C(=O)Nc3cc(C)cc(C)c3)nnc2-c2cccnc2)cc1 218619121 ACHMJGGFCJLJJC-IBGZPJMESA-N 473.602 5.464 70 20 JKID Cc1cc(NC(=O)C[C@@H](NC(=O)c2ccccc2Cl)c2ccccc2)n(-c2ccc(F)cc2)n1 217346103 OTUQIMWNBZDJPO-HSZRJFAPSA-N 476.939 5.473 70 20 JKID O=C(c1ccccc1SCC(=O)N1CCc2ccccc21)N1CC=C(c2ccc(O)cc2)CC1 218425161 AKXQKEOMZVZYFJ-UHFFFAOYSA-N 470.594 5.003 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cn(Cc4ccccc4)c4ccccc34)CC2)cc1 217084450 WVDZCLPEBUCTHM-UHFFFAOYSA-N 481.596 5.123 70 20 JKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1nnc(SCc2cccs2)s1 218140024 XPVKZEJQPBIAMA-UHFFFAOYSA-N 478.621 5.627 70 20 JKID Cc1nn(Cc2ccccc2)c2sc(C(=O)Nc3nnc(SCc4cccs4)s3)cc12 216817292 KENCETTZZHFUJR-UHFFFAOYSA-N 483.669 5.912 70 20 JKID Cc1cc(C)n(CC(=O)Nc2ccccc2CC(c2c[nH]c3ccccc23)c2c[nH]c3ccccc23)n1 216792341 JBVSBKZOVPGUOU-UHFFFAOYSA-N 487.607 6.476 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(CN2CCCCC2)n1Cc1ccccc1 217152324 CGSQCSJSYPFLTH-QFIPXVFZSA-N 495.718 5.002 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 217154111 GDRJRLUBIZPIAL-HXUWFJFHSA-N 496.061 5.672 70 20 JKID CCOc1ccc(C(=O)N2CCC(Nc3nc(-c4cccnc4)nc4sc5c(c34)CCC5)CC2)cc1 217115297 ZHYQXRWEMUNGTM-UHFFFAOYSA-N 499.640 5.357 70 20 JKID O=C(CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)N1CC=C(c2ccc(O)cc2)CC1 216884609 GMWRFXODSPWCFZ-UHFFFAOYSA-N 486.572 5.187 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc4cc(F)ccc4s3)n2)cc1 216819466 PJTIBFPUCBFCOY-UHFFFAOYSA-N 453.564 5.485 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(OC(F)F)cc2)o1 217156527 IUEFIPJHKAIFPC-OAHLLOKOSA-N 451.520 5.028 70 20 JKID O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)Nc1ccc(-c2nc3ccccc3s2)cn1 217028423 SYMXUTQDOCMJJI-UHFFFAOYSA-N 487.610 5.037 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc(Br)cc1 217131218 QFKBZISVMGMDFU-LJQANCHMSA-N 473.367 5.087 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1cccc(-c2csc(C)n2)c1)c1ccc(Br)cc1 216771777 WTMXGZBSYYLZHJ-IBGZPJMESA-N 458.381 5.087 70 20 JKID O=C1COc2cc(C(=O)NC[C@H](c3ccc(Cl)cc3Cl)c3c[nH]c4ccccc34)ccc2N1 216641972 CZSQOBCCROBINP-GOSISDBHSA-N 480.351 5.368 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 217154782 PTBOFRWRAQYKDW-FQEVSTJZSA-N 461.616 5.019 70 20 JKID CSCC[C@H](NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnc2ccccn12 217066198 NWJIFBLAENVJSX-JFDDCEBESA-N 488.457 5.391 70 20 JKID Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 217599521 RFEVUXIIEVFXFR-UHFFFAOYSA-N 460.540 5.826 70 20 JKID Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3ccc(CN4CCOCC4)cc3)[C@@H]2c2cccs2)cc1 218596686 DGWRAVJPMJTIKQ-SHQCIBLASA-N 489.641 5.012 70 20 JKID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)c1cnc2ccccn2c1=O 218220590 SBSDTXCYUNJTGD-GOSISDBHSA-N 477.351 5.045 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc2c(Cl)cc(C(F)(F)F)cn12 217156364 OPDNKOUEJYWPGF-ZDUSSCGKSA-N 460.934 5.091 70 20 JKID CC(=O)N[C@@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccc(Br)cc1 216769365 CKCNUZICDHXYME-FQEVSTJZSA-N 486.435 5.032 70 20 JKID CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1nc(-n2nc(C)cc2C)ccc1Cl 218629130 ZTTDLCRVBANQAD-UHFFFAOYSA-N 452.864 5.597 70 20 JKID COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N1CC=C(c2ccc(O)cc2)CC1 216851363 MBUWGUJPWXVJQI-UHFFFAOYSA-N 451.526 5.183 70 20 JKID Cc1ccc(-c2nn(-c3ccccc3)cc2CNC2CCN(C(=O)c3ccccc3)CC2)cc1 217023026 RQWXVDAJCZNXET-UHFFFAOYSA-N 450.586 5.242 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(C)cc1 217160512 AISPYNYVRUOBBA-NRFANRHFSA-N 475.643 5.327 70 20 JKID CN(Cc1ccc(S(=O)(=O)C(F)F)cc1)Cc1cn(-c2ccccc2)nc1-c1ccccc1 216896653 KVULSGINCGXNQL-UHFFFAOYSA-N 467.541 5.168 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc(C(C)C)nc4onc(C)c34)n2)cc1 217662172 MVPAHWCDULWQBA-UHFFFAOYSA-N 477.590 5.099 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 216851304 XMOSZTYNRWNSKL-IBGZPJMESA-N 451.595 6.582 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccc(C)c2)n1Cc1ccco1 217159088 YXCGQDZFJAQCIR-NRFANRHFSA-N 478.643 5.584 70 20 JKID O=C(Nc1nnc(SCc2cccs2)s1)c1sc2cc(Cl)ccc2c1Cl 216817179 BYFZFZUPJAPGPC-UHFFFAOYSA-N 458.442 6.666 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C1CCCC1 217155649 NEIBEVXQBOJHJV-FQEVSTJZSA-N 453.633 5.201 70 20 JKID COc1cccc([C@H](CNC(=O)N2CCC[C@H]2c2cccn2C)c2c[nH]c3ccccc23)c1OC 217423815 RLXFZIRBZOCMKK-DHLKQENFSA-N 472.589 5.202 70 20 JKID CC(=O)Nc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c(C(F)(F)F)c1 217910472 LHNXKHVBOPAEIA-UHFFFAOYSA-N 477.486 6.369 70 20 JKID COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1OC 216852217 FDLXWRZVPBCMMM-UHFFFAOYSA-N 481.552 5.192 70 20 JKID CC(=O)N1CCc2cc(C(=O)Nc3sc4c(c3C(=O)c3cccs3)CCCC4)ccc21 218084683 ICXHQNVAMPTQDZ-UHFFFAOYSA-N 450.585 5.081 70 20 JKID Cc1cc(NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)n(-c2ccc(F)cc2)n1 217343946 URJFRBLZPUGQAB-UHFFFAOYSA-N 454.914 5.539 70 20 JKID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1c(Cl)cccc1C(F)(F)F 216781327 RDBIZANHTOEEFU-UHFFFAOYSA-N 455.889 5.038 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(-c4cccs4)nc4ccccc34)CC2)cc1 217076371 PHBYJEPSQOSPTR-UHFFFAOYSA-N 485.609 5.397 70 20 JKID Cc1ccc(NC(=O)CSc2ccccc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1 216849644 RYKQALLPXCXVFD-UHFFFAOYSA-N 458.583 5.361 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(CN2CCCCC2)n1-c1ccc(F)cc1 217152337 NHSQETFNBOOCSM-OAQYLSRUSA-N 499.681 5.082 70 20 JKID CCOc1cc(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc(Cl)c1O 218529871 XTZXAJCVEVCPES-FQEVSTJZSA-N 464.949 5.496 70 20 JKID C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218661989 WJJZCWFRTGKKJH-SSDOTTSWSA-N 479.814 5.117 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 217142694 DMNBZEAGIRNWIJ-QFIPXVFZSA-N 492.645 5.822 70 20 JKID Cc1ccc(Cn2nccc2NC(=O)Cc2csc(COc3ccc(Cl)cc3)n2)cc1 216792152 DJFIMHXQHLLIJJ-UHFFFAOYSA-N 452.967 5.110 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)CCC(=O)c3ccc(-c4ccccc4)cc3)CC2)cc1 217080793 QJXLFCPTBWSBCW-UHFFFAOYSA-N 484.596 5.136 70 20 JKID COc1ccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2-c2ccccc2)cc1 216864674 PGUZTCIRZQPJQP-UHFFFAOYSA-N 487.553 5.232 70 20 JKID Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NC[C@@H](c3ccccc3)c3c[nH]c4ccccc34)n2)n1 217840204 MWBCSFQUZNYMQE-NRFANRHFSA-N 469.976 5.581 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)cc1)C(F)F 216863734 SIQFYSYPLJEXKP-UHFFFAOYSA-N 453.536 5.332 70 20 JKID Cc1sc2ncnc(N3CCC(C(=O)N[C@@H](C)c4cc(F)c(Cl)cc4Cl)CC3)c2c1C 216824131 PCPVMZMDHYJSMU-LBPRGKRZSA-N 481.424 5.848 70 20 JKID Cc1c(-c2ccccc2)sc(NC(=O)c2csc3ccccc23)c1C(=O)N1CCOCC1 217163215 SAXSVHVUXSWZKH-UHFFFAOYSA-N 462.596 5.663 70 20 JKID O=C(CCCCCn1c(=S)[nH]c2ccccc2c1=O)Nc1ccc2c(c1)nc1n2CCCCC1 218340237 HGNIGGCUKDDQIF-UHFFFAOYSA-N 475.618 5.334 70 20 JKID COc1ccc(-c2nc(C)c(C(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)s2)cc1OC 216830575 JCEXZJUDBYOTLH-UHFFFAOYSA-N 488.594 6.060 70 20 JKID Cc1ccccc1-c1cc(C(=O)OCc2nc(-c3ccccc3)no2)c2cnn(C(C)C)c2n1 217854483 PKMBCPZTPUOUQM-UHFFFAOYSA-N 453.502 5.395 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccco1 218167790 JVHNWEGBCSDKAF-DBXWQHBBSA-N 499.706 5.091 70 20 JKID O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CC=C(c2ccc(O)cc2)CC1 216852176 PSMFGOJCIIHGSZ-UHFFFAOYSA-N 464.521 5.308 70 20 JKID COc1ccc([C@H](C)NC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)cc1Br 217164606 UDBJZPJAZHQDTA-LBPRGKRZSA-N 468.273 5.153 70 20 JKID CCCCn1c(S[C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)nnc1[C@@H](CC)N(C)C 218631020 IFRFVKZIMGDXTI-SUMWQHHRSA-N 458.459 5.517 70 20 JKID COC[C@H](C)n1c(C)cc(C(=O)CSc2nnc(N3C[C@H](C)C[C@@H](C)C3)n2Cc2ccco2)c1C 217748897 BSENROGWTKVIGF-GGPKGHCWSA-N 499.681 5.002 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(OC)cc2)n1Cc1ccco1 217156853 NHVJCDPRUOGAAI-NRFANRHFSA-N 494.642 5.285 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCSc3ccc(F)cc3)n2)cc1 216818990 GGXXJCITRLHHSJ-UHFFFAOYSA-N 457.596 5.139 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccc(Br)cc1 216756207 NHDOJFPJOBTFNY-QHCPKHFHSA-N 467.363 5.234 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccs2)n1Cc1ccccc1 217139041 FCFGTSNQZYUZPB-IBGZPJMESA-N 480.684 5.745 70 20 JKID O=C(c1ccccc1)N1CCC(NCc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 217022962 WTAGJWWCBTWELE-UHFFFAOYSA-N 476.580 5.680 70 20 JKID CC(C)C[C@@H](NC(=O)CSc1nnc(C2CC2)n1Cc1ccccc1)c1nc2ccccc2[nH]1 217144989 NLMPNQFMIULSMX-JOCHJYFZSA-N 474.634 5.076 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCCC2)n1-c1ccccc1Cl 217159774 ZECRVMOYSXVOIM-SFHVURJKSA-N 488.082 5.211 70 20 JKID COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 218387428 SRMUTUGRCTZSTQ-XMMPIXPASA-N 488.613 5.098 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cccc(OCc4cccc(C)c4)c3)CC2)cc1 218261252 QEBFVVJINVDYKD-UHFFFAOYSA-N 472.585 5.007 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N1CCC(NC(=O)c2ccccc2)CC1 217569543 JYMTVNZENJTTIW-UHFFFAOYSA-N 463.581 5.174 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccco1 218167651 JVHNWEGBCSDKAF-LVCYWYKZSA-N 499.706 5.091 70 20 JKID CC(=O)N[C@H](CC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(Br)cc1 216774368 AEQFIHWMSANLTE-XTZNXHDOSA-N 476.173 5.340 70 20 JKID Cc1ccc(NC(=O)CSc2ccccc2C(=O)N2CCc3[nH]c4ccccc4c3C2)cc1 218594101 SIRWHQNEHWOUNM-UHFFFAOYSA-N 455.583 5.406 70 20 JKID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)c1cnc2ccccn2c1=O 218220639 SBSDTXCYUNJTGD-SFHVURJKSA-N 477.351 5.045 70 20 JKID Cc1ccc(-n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nnc2-c2ccncc2)cc1C 216863466 DLVUTLLRBURVAG-UHFFFAOYSA-N 486.569 5.235 70 20 JKID Cc1ccc(OCc2nc(CC(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)cs2)cc1 217028481 IMTQILNINQIMRG-UHFFFAOYSA-N 472.595 5.883 70 20 JKID COc1ccc(/C=C2/C[C@@H](C)Cc3c2nc2ccccc2c3C(=O)N(C)C2CCN(C)CC2)cc1 217932208 SJORAJCTOOLMCH-VZFXBBDVSA-N 469.629 5.533 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(-c4ccc(Cl)cc4)s3)CC2)cc1 217082870 PTVGYRVNNVAHHT-UHFFFAOYSA-N 469.006 5.502 70 20 JKID CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc(C(C)C)nc2onc(C)c12 217649262 BLAAXTFKUPFCTN-UHFFFAOYSA-N 463.365 5.452 70 20 JKID Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1ccc(S(=O)(=O)F)cc1 865204477 VFZHGXOIVBSJOP-UHFFFAOYSA-N 470.906 5.012 70 20 JKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 218127275 LCBBMLXMJUCJRJ-UHFFFAOYSA-N 476.558 6.094 70 20 JKID CC(=O)N[C@H](CC(=O)N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(Br)cc1 216799028 FJCTYIKCLKYBLD-BJKOFHAPSA-N 465.391 5.117 70 20 JKID C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)NC1CCN(Cc2ccccc2)CC1 218626845 QSGKMEITDUGAIR-KRWDZBQOSA-N 455.624 5.211 70 20 JKID CN1CCC2(CC1)C[C@@H](NC(=O)Cc1csc(COc3ccc(Cl)cc3)n1)c1ccccc1O2 216791721 XQPRRFQMGWWJFQ-JOCHJYFZSA-N 498.048 5.022 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3SCc3cccs3)CC2)cc1 217083841 FAILGGJMEWDSKW-UHFFFAOYSA-N 480.655 5.474 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(Cc3cccs3)n2-c2ccccc2)cc1)C(F)F 216872471 ORSXXAUEZYDZAP-UHFFFAOYSA-N 477.583 5.208 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(-c4ccccc4)nc4ccccc34)CC2)cc1 217075355 ZYIZVTJAOBKJBW-UHFFFAOYSA-N 479.580 5.335 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1cc2c(cc1Cl)OCCCO2 217065052 UHAXHGZRGVQQKL-UHFFFAOYSA-N 458.945 6.206 70 20 JKID COc1ccc(-c2cc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)c3ccccc3n2)cc1OC 216848353 YRDCTAFUEFFPCV-UHFFFAOYSA-N 466.537 5.554 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc(Br)cc1 217131205 QFKBZISVMGMDFU-IBGZPJMESA-N 473.367 5.087 70 20 JKID COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)c1 216887931 GSUWRPUTVHVDSH-UHFFFAOYSA-N 465.553 5.242 70 20 JKID Cc1cc(NC(=O)Cc2csc(COc3ccc(Cl)cc3)n2)n(-c2ccc(F)cc2)n1 217371825 OIELFADHBLPQRY-UHFFFAOYSA-N 456.930 5.190 70 20 JKID Cc1noc2nc(C(C)C)cc(C(=O)N(Cc3nnc(-c4ccccc4Cl)o3)C(C)C)c12 217954288 NOZMSLLRUQMADX-UHFFFAOYSA-N 453.930 5.409 70 20 JKID Cc1ccsc1CN(C(=O)CCn1cnc2sccc2c1=O)c1ccc(F)c(Cl)c1 217806877 TXSNOVDZXRROKS-UHFFFAOYSA-N 461.971 5.244 70 20 JKID O=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)c1occc1CSc1ccccc1 217049977 VUSPEFJRKGKUNM-UHFFFAOYSA-N 491.034 5.652 70 20 JKID COc1ccc(-c2nc(C)c(C(=O)Nc3cc(C)nn3-c3ccc(F)cc3)s2)cc1OC 217369652 FYBVLESKVMRKEL-UHFFFAOYSA-N 452.511 5.021 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)CC2)cc1 217118716 NGTXKXLGJLCJHJ-UHFFFAOYSA-N 496.529 5.806 70 20 JKID CCOc1ccc(-n2c(S[C@H](C)C(=O)Nc3cc(C)cc(C)c3)nnc2-c2cccnc2)cc1 218619188 ACHMJGGFCJLJJC-LJQANCHMSA-N 473.602 5.464 70 20 JKID COc1cccc([C@@H](CNC(=O)N2CCC[C@@H]2c2cccn2C)c2c[nH]c3ccccc23)c1OC 217423603 RLXFZIRBZOCMKK-RCZVLFRGSA-N 472.589 5.202 70 20 JKID COc1ccc(/C=C2/CCCc3c2nc2ccccc2c3C(=O)N(C)C2CCN(C)CC2)cc1 217931910 CUYMQVQOEYXPDU-VZCXRCSSSA-N 455.602 5.287 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3oc4c(ccc5ccccc54)c3C)CC2)cc1 217081695 JSVVLIXJWHHKMF-UHFFFAOYSA-N 456.542 5.328 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3sc4cc(Cl)ccc4c3Cl)CC2)cc1 217081770 KAZNYAHGSGTBHK-UHFFFAOYSA-N 477.413 5.641 70 20 JKID O=C(c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1)N1CC=C(c2ccc(O)cc2)CC1 218131570 JSZOJMWQPRQOOJ-UHFFFAOYSA-N 496.514 5.650 70 20 JKID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1c(Cl)cc(Cl)cc1Cl 216778962 SQDVGSYBOSLZMJ-UHFFFAOYSA-N 456.782 5.326 70 20 JKID CCCCn1c(S[C@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nnc1[C@H](CC)N(C)C 218631599 ZODIKKVRPWJVQP-AEFFLSMTSA-N 452.068 5.480 70 20 JKID COc1ccc([C@H]2CCCN2C(=O)CSc2nc(-c3ccc(F)cc3)cs2)cc1OC 218622853 IEOOIAKLNCWPMC-LJQANCHMSA-N 458.580 5.422 70 20 JKID O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)c1ccc(=O)n(Cc2ccccc2Cl)c1 217056831 ZJJFGNPVOSXKMJ-UHFFFAOYSA-N 487.774 5.354 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(Nc3cccc(Br)c3)s2)cc1)C(F)F 216874516 DVMIGWWVPZDYPI-UHFFFAOYSA-N 492.392 5.333 70 20 JKID Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)Nc2cc(C)nn2-c2ccccn2)c1 216742197 LSAUKLSAIYGLGT-UHFFFAOYSA-N 452.493 5.128 70 20 JKID Cc1ccc(Cn2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nc3ccccc3c2=O)cc1 216860389 WZTCZDLLWLJTPV-UHFFFAOYSA-N 486.565 5.042 70 20 JKID O=C(NC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)C1)Nc1cccc(F)c1 216782703 DCAOQNZJRNNCMC-BEVDRBHNSA-N 463.475 5.008 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(C)c(C)c1 217151170 DUOUDECXSVQASD-QFIPXVFZSA-N 489.670 5.636 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 217152396 QDFRZYBRUFTFLC-SFHVURJKSA-N 456.637 5.733 70 20 JKID COc1cccc([C@@H](CNC(=O)N2CCC[C@H]2c2cccn2C)c2c[nH]c3ccccc23)c1OC 217423735 RLXFZIRBZOCMKK-RDGATRHJSA-N 472.589 5.202 70 20 JKID COc1cc(/C=C/C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)ccc1OCc1c(C)noc1C 217355701 RCCOCZXCRJSXCJ-WUXMJOGZSA-N 476.508 5.164 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(C)c(C)c1 217151160 DUOUDECXSVQASD-JOCHJYFZSA-N 489.670 5.636 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCCC2)n1-c1cccc(Cl)c1 217159866 JSADOILKJNRVPL-LJQANCHMSA-N 488.082 5.211 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3sc(-c4ccc(Cl)cc4)nc3C)CC2)cc1 217084282 PAPNXAHOHXLQKS-UHFFFAOYSA-N 484.021 5.205 70 20 JKID Cc1oc2nc[nH]c(=O)c2c1C(=O)NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12 218528878 RAQOLCMJLRUFGT-MRXNPFEDSA-N 481.339 5.175 70 20 JKID C[C@]1(CCc2ccc(OC(F)F)cc2)NC(=O)N(Cc2cc(-c3ccc(Cl)cc3)no2)C1=O 217925539 SFZZWSUMXJNURN-HSZRJFAPSA-N 475.879 5.040 70 20 JKID Cc1ccc(-n2c(S[C@H](C)C(=O)N(C)Cc3c(F)cccc3Cl)nnc2-c2ccncc2)cc1 218775903 JNHJORYLMDWVMT-QGZVFWFLSA-N 496.011 5.569 70 20 JKID CC(C)c1ccc(CSc2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)s2)cc1 216868908 KYKRQZMYNKRUIN-UHFFFAOYSA-N 486.656 6.242 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(COc4ccc5ccccc5c4)o3)CC2)cc1 217078815 LJEVRAXRGLYTIP-UHFFFAOYSA-N 498.579 5.445 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1 217154762 ODKZDDMHLUJQBB-SFHVURJKSA-N 450.589 5.217 70 20 JKID O=C(CSc1nnc(-c2ccccc2F)n1-c1ccccc1)N1CC=C(c2ccc(O)cc2)CC1 216884487 YKKVZGJDFQXAKQ-UHFFFAOYSA-N 486.572 5.187 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)COc3ccc(-c4ccccc4)cc3Cl)CC2)cc1 217083301 DVZBBIHGTUXPRO-UHFFFAOYSA-N 493.003 5.206 70 20 JKID Cc1ccccc1-c1nnc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1Cc1ccco1 216870877 NJBANNPQVLWSDT-UHFFFAOYSA-N 475.542 5.183 70 20 JKID Cc1noc(CCC(=O)Nc2nc(-c3ccccc3Cl)c(-c3ccccc3Cl)s2)n1 218321778 VQIDODBUQNVACG-UHFFFAOYSA-N 459.358 6.047 70 20 JKID Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2ccccc2Br)n1Cc1ccco1 218673481 JWPGHHJDJLQKKP-MRXNPFEDSA-N 497.418 5.777 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3cccs3)n2Cc2ccccc2)cc1)C(F)F 216859629 DLMPUCONCHSVGH-UHFFFAOYSA-N 477.583 5.344 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc2c(Cl)cc(C(F)(F)F)cn12 217156350 OPDNKOUEJYWPGF-CYBMUJFWSA-N 460.934 5.091 70 20 JKID CN(C(=O)CSc1ccccc1C(=O)Nc1nc2c(s1)CCCCC2)C1CCCCC1 217918425 BSFAQTPTZLRVEA-UHFFFAOYSA-N 457.665 5.548 70 20 JKID CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1nc2ccccc2n1CCS(=O)(=O)F 883954473 OQLUOXWJAYHYDQ-SFHVURJKSA-N 486.396 5.160 70 20 JKID Cc1ccccc1-c1cc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)c2cnn(C(C)C)c2n1 217800566 GZDDRTWXALPNFK-UHFFFAOYSA-N 452.558 5.623 70 20 JKID Cc1ccccc1-c1nnc(S[C@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)n1Cc1ccco1 218675035 TZTVHROPMSYWMZ-QGZVFWFLSA-N 499.011 5.827 70 20 JKID CCOc1ccc(N(C(=O)CCn2c(=O)n(C)c3ccccc32)c2nc3ccccc3s2)cc1 217763801 OFYLMNPDQVFFHI-UHFFFAOYSA-N 472.570 5.103 70 20 JKID Cc1nc(CSc2ccccc2C(=O)N[C@H]2CC3(CCN(C)CC3)Oc3ccccc32)cs1 218073075 SORNICLBVOULKB-QFIPXVFZSA-N 479.671 5.462 70 20 JKID CCCCn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nnc1-c1ccc(OC)cc1 216860182 ZIHZHIORSWUPOU-UHFFFAOYSA-N 467.563 5.042 70 20 JKID Cc1ccc(-c2nnc(-c3ccc(C(=O)Nc4cc(C)nn4-c4ccc(F)cc4)cc3)o2)cc1 217370950 YHLQORXLKMIXLT-UHFFFAOYSA-N 453.477 5.598 70 20 JKID CCN(CC)c1ccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2CC)cc1 216870647 GULAHMHMRBWKSE-UHFFFAOYSA-N 480.606 5.100 70 20 JKID Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216830766 XXBOBTDUISSKQA-UHFFFAOYSA-N 497.506 5.003 70 20 JKID C[C@@H](NCc1cc(Br)c(O)c(Br)c1)c1ccc(Br)cc1 218408092 KNUCMMLIADKLHD-SECBINFHSA-N 463.995 5.531 70 20 JKID C[C@@]12CCCc3cc(OS(=O)(=O)C(F)(F)F)ccc3[C@]1(Cc1ccccc1)CCC(=O)C2 97973138 KLEDRLQUFCHLPF-XZOQPEGZSA-N 466.521 5.491 70 20 JKID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@H](C)C(=O)Nc3c(C)cc(C)cc3Cl)cc2)cc1 218726970 HYNXNMWGAINZAJ-GOSISDBHSA-N 472.010 5.505 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccoc2C)n1Cc1ccccc1 217155740 PFAJWWBWZWLUBA-NRFANRHFSA-N 478.643 5.584 70 20 JKID COc1cc(CNC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)ccc1OCc1ccccc1 217164325 YRFYDOYUFXQODY-UHFFFAOYSA-N 481.474 5.409 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(-c4ccc(OC)cc4)c(C)s3)CC2)cc1 217119254 RLDVSQMQBFDVJP-UHFFFAOYSA-N 478.614 5.165 70 20 JKID COc1ccc2c(C)c(CCC(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)c(=O)oc2c1 217787510 KZLJNOJUUIPSOQ-UHFFFAOYSA-N 471.538 5.353 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)/C=C/c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 217079171 QAXYFCZOHGFUNC-BJMVGYQFSA-N 480.914 5.192 70 20 JKID Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3ccc(CN4CCOCC4)cc3)[C@H]2c2cccs2)cc1 218596921 DGWRAVJPMJTIKQ-IGKIAQTJSA-N 489.641 5.012 70 20 JKID Cc1cc(C)n(-c2ccc(Cl)c(C(=O)NC[C@H](c3ccccc3)c3c[nH]c4ccccc34)n2)n1 217840105 MWBCSFQUZNYMQE-OAQYLSRUSA-N 469.976 5.581 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccccc3F)n2Cc2ccccc2)cc1)C(F)F 216860220 ITANFPSBIFHZOI-UHFFFAOYSA-N 489.544 5.421 70 20 JKID COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cc(C)cc(C)c3)n2Cc2ccco2)cc1 218668647 BSQCINIDCJAKQG-SFHVURJKSA-N 462.575 5.331 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCC(=O)c3ccc4c(c3)CCCC4)n2)cc1 217154291 NMAHWOJQAASKJW-UHFFFAOYSA-N 489.641 5.359 70 20 JKID CCCCCOc1ccc(-c2cc(-c3ccc(C(=O)On4nnc5ccccc54)cc3)no2)cc1 100341970 OVGDHNCIEZTWJS-UHFFFAOYSA-N 468.513 5.591 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 217159815 KEEFZYSQEGAUMP-HXUWFJFHSA-N 463.632 5.451 70 20 JKID FC(F)Oc1ccccc1CSc1nnc(SCc2ccccc2OC(F)F)s1 217926035 VVAAFHBTARFLSN-UHFFFAOYSA-N 462.515 6.326 70 20 JKID Cc1ccc(N2C(=O)CC[C@@H](C(=O)N3CC=C(c4ccc(O)cc4)CC3)[C@@H]2c2cccs2)cc1 216851570 BVGUYJFYPWIMIS-SHQCIBLASA-N 472.610 5.562 70 20 JKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(Br)cc3Br)c12 217937313 LELFKJWRWQESEX-UHFFFAOYSA-N 453.134 5.432 70 20 JKID O=C1N[C@]2(CCCc3sccc32)C(=O)N1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 218287428 ZPXJAOABGZYNBB-FQEVSTJZSA-N 463.506 5.174 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 217152386 QDFRZYBRUFTFLC-GOSISDBHSA-N 456.637 5.733 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCSc3ccccc3Cl)n2)cc1 216817988 BENCPIFHKYWNHH-UHFFFAOYSA-N 474.051 5.653 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccs2)n1Cc1ccccc1 217139032 FCFGTSNQZYUZPB-LJQANCHMSA-N 480.684 5.745 70 20 JKID O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc(-c2nc3ccccc3s2)cn1 218369367 AOVBXNMWTMRWLO-UHFFFAOYSA-N 479.974 5.793 70 20 JKID COc1ccc([C@H]2CCCN2C(=O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1OC 218643199 UKVWKQKPKTVPQY-QGZVFWFLSA-N 477.401 5.484 70 20 JKID COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2ccccc2Br)c1 216666593 YXAPTJQSEHUFCK-UHFFFAOYSA-N 462.347 5.622 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2C)n1Cc1ccco1 217158914 HXAVONHYVQGVIS-NRFANRHFSA-N 478.643 5.584 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCCC2)n1-c1cccc(Cl)c1 217159876 JSADOILKJNRVPL-IBGZPJMESA-N 488.082 5.211 70 20 JKID Cn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nc2scc(-c3cccs3)c2c1=O 216868606 VDUMGMFBIJAXAK-UHFFFAOYSA-N 484.596 5.012 70 20 JKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(NC(=O)c4ccco4)cc3C(F)(F)F)c12 217985883 ZLKKHBOEFFWRLQ-UHFFFAOYSA-N 472.423 5.771 70 20 JKID Cc1ccccc1-c1nnc(SCC(=O)N2c3ccccc3CC[C@@H]2C)n1Cc1ccco1 217158883 SWJYLVHEBZIFPZ-IBGZPJMESA-N 458.587 5.355 70 20 JKID Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)n1Cc1ccco1 218674954 TZTVHROPMSYWMZ-KRWDZBQOSA-N 499.011 5.827 70 20 JKID COc1cccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2-c2ccccc2)c1 216867461 CPCZTKDUVBLWMU-UHFFFAOYSA-N 487.553 5.232 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2sc3c(c2c(=O)n1CC)CCCC3 217155626 IOKLHUYSPFACSA-INIZCTEOSA-N 473.689 5.046 70 20 JKID O=C(c1ccccc1)N1CCC(NCc2ccc(-c3ccc(Br)cc3)s2)CC1 218469552 DAZDRJAAQDCSNF-UHFFFAOYSA-N 455.421 5.572 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc(C4CC4)nc4ccccc34)n2)cc1 216819153 GDAUFTPVBBADNK-UHFFFAOYSA-N 470.598 5.557 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccco1 218167725 JVHNWEGBCSDKAF-UEXGIBASSA-N 499.706 5.091 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1 217154132 RJWXNUVKOWONHR-JOCHJYFZSA-N 475.639 5.134 70 20 JKID Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218627845 BOLMKBIKYNOEQL-MRXNPFEDSA-N 452.580 5.871 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C 217154018 MMGDTNOGOYJQSI-HXUWFJFHSA-N 475.643 5.327 70 20 JKID O=C(Cc1cc2c(cc1Br)OCCO2)Nc1ccc(SCc2cccnc2)cc1 217142381 BOXOIKLQOFBBDR-UHFFFAOYSA-N 471.376 5.089 70 20 JKID C[C@H](Sc1nnc(C[C@H](C)c2ccccc2)o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218665680 ZMUHCCWTHUBSES-UWVGGRQHSA-N 457.424 5.231 70 20 JKID Cc1sc2ncnc(N3CCC(C(=O)N[C@H](C)c4cc(F)c(Cl)cc4Cl)CC3)c2c1C 216824166 PCPVMZMDHYJSMU-GFCCVEGCSA-N 481.424 5.848 70 20 JKID CC(=O)N[C@H](CC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(Br)cc1 216774452 AEQFIHWMSANLTE-MLCYQJTMSA-N 476.173 5.340 70 20 JKID O=S(=O)(Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)c1ccccc1Br 217517040 VWAAQUSZZMRWQQ-UHFFFAOYSA-N 477.327 5.316 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C 217154027 MMGDTNOGOYJQSI-FQEVSTJZSA-N 475.643 5.327 70 20 JKID CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216715429 ZYVDHNACDPITSU-NRFANRHFSA-N 464.978 5.405 70 20 JKID Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)Nc3ccc(Sc4nncn4C)cc3)cc12 217833609 CLLJTKQRWUDOPK-UHFFFAOYSA-N 481.006 5.581 70 20 JKID Cc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1NC(=O)c1ccco1 216715670 KBCRGERGYUOLDO-UHFFFAOYSA-N 454.511 5.764 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3cccs3)n2-c2ccccc2)cc1)C(F)F 216865646 YXMLQVQBHLRETI-UHFFFAOYSA-N 463.556 5.284 70 20 JKID Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)Nc2nc(-c3ccccc3)cs2)c1 217139317 CCQZWQMPKFGYEF-UHFFFAOYSA-N 463.584 5.480 70 20 JKID Cc1oc2nc[nH]c(=O)c2c1C(=O)NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12 218528960 RAQOLCMJLRUFGT-INIZCTEOSA-N 481.339 5.175 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)cc1 217076247 RVJXIRFDNGQOPC-UHFFFAOYSA-N 488.428 5.158 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccc(OC)c2)n1Cc1ccco1 217156931 OPTDIBZUOWEHIR-NRFANRHFSA-N 494.642 5.285 70 20 JKID CCCCn1c(SCC(=O)Nc2ccc(Br)cc2Cl)nnc1[C@H](CC)N(C)C 217150709 BTONQUYDBICCFU-INIZCTEOSA-N 488.883 5.238 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2cc(Cl)ccc2n1CCOC 217158791 VFPYGWBEOQBQPZ-QGZVFWFLSA-N 450.029 5.026 70 20 JKID CCCCCn1nc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)c2ccccc2c1=O 216720926 MDHKPGNMTQYSBZ-UHFFFAOYSA-N 469.570 5.511 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3sc(-c4cccc(Cl)c4)nc3C)CC2)cc1 217084101 YTCNUVKUFDUWGD-UHFFFAOYSA-N 484.021 5.205 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2Cl)n1CCCOC 217141231 ZCGRYEPJGFMMQY-IBGZPJMESA-N 491.082 5.325 70 20 JKID Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1 216827834 PSCHYLHFAPCVFY-INIZCTEOSA-N 462.600 5.366 70 20 JKID O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1ccc(Cl)c(NC(=O)c2cccs2)c1 217606731 GACUANNCCJTJDU-UHFFFAOYSA-N 481.986 5.965 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccc(SCc2cccnc2)cc1)c1ccc(Br)cc1 217142355 HEACZRJXIHFKLV-JOCHJYFZSA-N 484.419 5.342 70 20 JKID O=C(Nc1nnc(SCc2cccs2)s1)c1ccc(=O)n(Cc2ccccc2Cl)c1 217054636 NDHRVNCYGVSORM-UHFFFAOYSA-N 475.020 5.008 70 20 JKID O=C(c1ccccc1)N1CCC(NCc2ccc(OCc3ccccc3)c(Br)c2)CC1 217022603 CMAYMDUOBZPKGT-UHFFFAOYSA-N 479.418 5.423 70 20 JKID CN(C(=O)OC(C)(C)C)c1ccc(/C=C/c2ccc(OCCOCCOCCF)nc2)cc1 217358267 WCBLXMXEPXJAHF-AATRIKPKSA-N 460.546 5.005 70 20 JKID COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)c1 216851446 LRKCMJFLRJWLGA-UHFFFAOYSA-N 481.552 5.192 70 20 JKID COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cc(C)cc(C)c3)n2Cc2ccco2)cc1 218668718 BSQCINIDCJAKQG-GOSISDBHSA-N 462.575 5.331 70 20 JKID COc1ccc(-c2nc(CC(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)cs2)cc1OC 216827787 CCUFVVZKQVMXQG-UHFFFAOYSA-N 488.594 5.680 70 20 JKID CCCCn1c(S[C@@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)nnc1[C@H](CC)N(C)C 216860955 XFISNZNXMGWZFE-HOCLYGCPSA-N 486.667 5.502 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2cc(Cl)ccc2n1CCOC 217158801 VFPYGWBEOQBQPZ-KRWDZBQOSA-N 450.029 5.026 70 20 JKID Cc1ccc(C)c(OCc2nnc(S[C@@H](C)C(=O)Nc3ccccc3Br)o2)c1 218666095 YMKXIRQINHJSTC-AWEZNQCLSA-N 462.369 5.147 70 20 JKID CCOC(=O)c1sc(N(Cc2ccc(F)cc2)C(=O)c2cnc3onc(C(C)C)c3c2)nc1C 217809423 JOSDZRIWBJDSFA-UHFFFAOYSA-N 482.537 5.274 70 20 JKID C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)NC1CCN(Cc2ccccc2)CC1 218626767 QSGKMEITDUGAIR-QGZVFWFLSA-N 455.624 5.211 70 20 JKID CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc(C(C)C)nc2onc(C)c12 217651295 XBHDMACAMIMUPQ-UHFFFAOYSA-N 463.365 5.452 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(-c4ccccc4Cl)o3)CC2)cc1 217081581 NCOUZNOTKZCYQE-UHFFFAOYSA-N 452.938 5.033 70 20 JKID Cc1ccc(-n2c(S[C@@H](C)C(=O)N(C)Cc3c(F)cccc3Cl)nnc2-c2ccncc2)cc1 218775818 JNHJORYLMDWVMT-KRWDZBQOSA-N 496.011 5.569 70 20 JKID CC(=O)N[C@H](CC(=O)N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(Br)cc1 216799102 FJCTYIKCLKYBLD-DNQXCXABSA-N 465.391 5.117 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(CN2CCCCC2)n1Cc1ccccc1 217152313 CGSQCSJSYPFLTH-JOCHJYFZSA-N 495.718 5.002 70 20 JKID Cc1nc(CSc2ccccc2C(=O)N[C@@H]2CC3(CCN(C)CC3)Oc3ccccc32)cs1 218072988 SORNICLBVOULKB-JOCHJYFZSA-N 479.671 5.462 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(COc2ccccc2Cl)n1C1CC1 217149899 XPHADVUAUABUPH-GOSISDBHSA-N 489.066 5.535 70 20 JKID CCOc1ccc(Oc2ccccc2NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1 216768129 LRHSPJQLHVYGPJ-HSZRJFAPSA-N 497.389 5.846 70 20 JKID Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)cc12 216850005 GNXNJTLIRWCMBU-UHFFFAOYSA-N 463.990 5.743 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc(-c4ccc(Cl)cc4)n[nH]3)n2)cc1 217812483 DQMLCYIMRPVRLA-UHFFFAOYSA-N 479.993 5.175 70 20 JKID CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2cc(C(C)C)nc3onc(C)c23)sc1C 217965267 XPEIOFPQFCASEA-UHFFFAOYSA-N 492.601 5.486 70 20 JKID COc1cc2c(cc1OC)[C@@H](c1cccs1)N(CC(=O)N(C)[C@@H](C)c1ccc(F)cc1)CC2 217139355 FEZZKEMQJYBXLX-QLXKLKPCSA-N 468.594 5.072 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1 216852092 OZWPHAPXLQNXLS-OAQYLSRUSA-N 461.569 5.553 70 20 JKID O=C(N[C@@H](CC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccccc1)c1ccccc1Cl 216849198 DOJVJUMDSTWEAP-VWLOTQADSA-N 460.961 5.223 70 20 JKID C[C@@]1(CCc2ccc(OC(F)F)cc2)NC(=O)N(Cc2cc(-c3ccc(Cl)cc3)no2)C1=O 217925463 SFZZWSUMXJNURN-QHCPKHFHSA-N 475.879 5.040 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)CC(c3ccccc3)c3ccccc3)CC2)cc1 217076497 XRHQGGXYZCMORF-UHFFFAOYSA-N 456.586 5.028 70 20 JKID Cc1ccsc1CN(C(=O)CCn1cnc2ccccc2c1=O)c1ccc(F)c(Cl)c1 216911194 MQKUHNNATLLLCR-UHFFFAOYSA-N 455.942 5.182 70 20 JKID Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3ccc(CN4CCOCC4)cc3)[C@@H]2c2cccs2)cc1 218596772 DGWRAVJPMJTIKQ-RPLLCQBOSA-N 489.641 5.012 70 20 JKID Cc1cc(NC(=O)c2cc3c(C)nn(Cc4ccc(Cl)cc4)c3s2)n(-c2ccccn2)n1 216740520 IGDMDXUSARILFJ-UHFFFAOYSA-N 462.966 5.249 70 20 JKID Cc1ccc(N2C(=O)CC[C@H](C(=O)N3CC=C(c4ccc(O)cc4)CC3)[C@@H]2c2cccs2)cc1 216851597 BVGUYJFYPWIMIS-RPLLCQBOSA-N 472.610 5.562 70 20 JKID Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)Sc1ccc(Cl)c(C(F)(F)F)c1 218634461 QOYBCLDCTYUVLI-AWEZNQCLSA-N 453.917 6.281 70 20 JKID C[C@H](Sc1nnc(COc2ccc(Cl)cc2)o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218662056 WJJZCWFRTGKKJH-ZETCQYMHSA-N 479.814 5.117 70 20 JKID COCc1nc(OC)c2c(C)c(C(=O)Nc3nc(-c4ccc5c(c4)CCC5)cs3)sc2n1 216820958 GLNJWXCFPYRVCU-UHFFFAOYSA-N 466.588 5.019 70 20 JKID Cc1cc(-c2csc(NC(=O)c3ccc(CN4CCCC4=O)cc3)n2)c(C)n1CCc1ccccc1 216812549 UYYKJTHWOKHZMS-UHFFFAOYSA-N 498.652 5.846 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N1CCC(OCc2ccccc2)CC1 217058850 QFMFFPYNGPIXBB-UHFFFAOYSA-N 450.582 5.961 70 20 JKID COc1ccc(-c2nnc(SCC(=O)N3c4ccccc4CC[C@H]3C)n2Cc2ccco2)cc1 217156826 BXGZAMRUHQWLLF-GOSISDBHSA-N 474.586 5.055 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(COc3ccccc3Cl)n2C2CC2)cc1)C(F)F 216860595 GNLYQLFNGWYPNN-UHFFFAOYSA-N 485.965 5.134 70 20 JKID CN(C(=O)CSc1ccccc1C(=O)N1CC=C(c2ccc(O)cc2)CC1)C1CCCCC1 216883576 PYCTVNVQGORUAH-UHFFFAOYSA-N 464.631 5.205 70 20 JKID CCOc1c(Br)cc(CNC2CCN(C(=O)c3ccccc3)CC2)cc1Br 217022782 IJUCGIMJMRUGQS-UHFFFAOYSA-N 496.243 5.005 70 20 JKID Cc1cc(CSc2ncccc2C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)no1 218370899 WYCYJCSCQDJTHJ-UHFFFAOYSA-N 459.556 5.594 70 20 JKID Cc1cc(NC(=O)C[C@H](NC(=O)c2ccccc2Cl)c2ccccc2)n(-c2ccc(F)cc2)n1 217346175 OTUQIMWNBZDJPO-QHCPKHFHSA-N 476.939 5.473 70 20 JKID COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1 216854110 UODKZIWOJWTOLE-UHFFFAOYSA-N 452.554 5.798 70 20 JKID COc1ccccc1-n1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nnc1-c1cccs1 216864885 TYGKBDXNIOXQOE-UHFFFAOYSA-N 493.582 5.293 70 20 JKID CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc(Br)cc1 216798992 FJCTYIKCLKYBLD-ZEQRLZLVSA-N 465.391 5.117 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(CN2CCCCC2)n1-c1ccc(F)cc1 217152345 NHSQETFNBOOCSM-NRFANRHFSA-N 499.681 5.082 70 20 JKID C[C@@H](Sc1nnc(-c2ccccc2)n1-c1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218650005 AWDGXCUVGZWKIV-GFCCVEGCSA-N 490.457 5.749 70 20 JKID CCn1c(S[C@@H](C)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)nnc1-c1cccc(C)c1 218668022 KXZATNOIFBMFSX-JTQLQIEISA-N 456.440 5.088 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 216717290 XTRUMSKRDGSYSX-SFHVURJKSA-N 476.989 5.503 70 20 JKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Oc1ccc(N(C)C(=O)C(C)(C)C)cc1 218128572 TXOLFUFQYAMKHN-UHFFFAOYSA-N 456.539 5.398 70 20 JKID Cc1cccc(-c2nnc(S[C@@H](C(N)=O)c3ccc(F)cc3)n2-c2ccc(Cl)cc2)c1 217810578 NAKHESCCLSCXKT-HXUWFJFHSA-N 452.942 5.354 70 20 JKID Cc1ccc(Cn2nccc2NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)cc1 217816161 FDYMEMPNNPADHV-UHFFFAOYSA-N 459.859 5.350 70 20 JKID C[C@@H](Sc1nnc(C2CC2)n1Cc1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218661492 HLULVYQNWHGYEX-SNVBAGLBSA-N 468.451 5.019 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 217154121 GDRJRLUBIZPIAL-FQEVSTJZSA-N 496.061 5.672 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(OC(F)F)cc2)o1 217156536 IUEFIPJHKAIFPC-HNNXBMFYSA-N 451.520 5.028 70 20 JKID COc1ccc(-c2nnc(SCC(=O)N3c4ccccc4CC[C@@H]3C)n2Cc2ccco2)cc1 217156818 BXGZAMRUHQWLLF-SFHVURJKSA-N 474.586 5.055 70 20 JKID CCN(CC)[C@H](CNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1Cl 218347685 LHBREBMPBOFYHN-HXUWFJFHSA-N 464.919 5.357 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cc1)C(F)F 216872532 PTHJDYXBALEQTQ-UHFFFAOYSA-N 460.531 5.050 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)CCCSc3ccc(Cl)cc3)CC2)cc1 217077339 BDLKUUJVXYDYER-UHFFFAOYSA-N 461.027 5.032 70 20 JKID CCOc1ccc(-n2c(SCc3ccccc3OC(F)F)nnc2-c2cccnc2)cc1 218183468 CMSRQEXKGPLVGI-UHFFFAOYSA-N 454.502 5.622 70 20 JKID CC(=O)N[C@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccc(Br)cc1 216769412 CKCNUZICDHXYME-HXUWFJFHSA-N 486.435 5.032 70 20 JKID CC(C)Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1csc2ccccc12 217162891 ADCLMIJDWMIUGW-UHFFFAOYSA-N 458.605 5.115 70 20 JKID Cc1sc2nc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n(C3CCCC3)c(=O)c2c1C 216870037 UTGDKZFNTOEJQI-UHFFFAOYSA-N 484.615 5.479 70 20 JKID COc1ccc([C@@H]2CCCN2C(=O)COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1OC 218643132 UKVWKQKPKTVPQY-KRWDZBQOSA-N 477.401 5.484 70 20 JKID CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(C(C)C)nc4onc(C)c34)cc2)cc1 217938151 GSEXUDGTYBYEHE-UHFFFAOYSA-N 458.518 5.558 70 20 JKID C[C@H](NCc1cc(Br)c(O)c(Br)c1)c1ccc(Br)cc1 218408164 KNUCMMLIADKLHD-VIFPVBQESA-N 463.995 5.531 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)C1CCN(c2nc3ccccc3o2)CC1 217958321 KDMSXSOXYUUUNM-UHFFFAOYSA-N 455.543 5.355 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCC(=O)c3cc(C)ccc3C)n2)cc1 217154306 PKHMGUJSOVMQJY-UHFFFAOYSA-N 463.603 5.097 70 20 JKID CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216715899 WYJDZGJIOKRSAG-NRFANRHFSA-N 466.513 5.030 70 20 JKID Cc1cccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2Cc2ccco2)c1 216870985 WRWBKZLNADGKTH-UHFFFAOYSA-N 475.542 5.183 70 20 JKID CC(C)CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCSc3c(F)cccc32)c(Cl)cc1Cl 216881340 WOOZEMBDFSXQPQ-KRWDZBQOSA-N 491.437 5.034 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N2CCCC2)n1-c1ccccc1Cl 217159763 ZECRVMOYSXVOIM-GOSISDBHSA-N 488.082 5.211 70 20 JKID O=C(NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1Nc1cccc(C(F)(F)F)c1 216916391 KAEYYLYSTADYRO-UHFFFAOYSA-N 467.491 5.484 70 20 JKID O=C(CCc1nc(-c2ccc(Cl)cc2)no1)Nc1ccc(-c2nc3ccccc3s2)cn1 216829803 JDKAOWYPYGGYGL-UHFFFAOYSA-N 461.934 5.633 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1)c1ccc(Cl)cc1 217788453 OYZOXYBPWCENEQ-IBGZPJMESA-N 450.951 5.218 70 20 JKID COc1ccc([C@@H]2CCCN2C(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)cc1OC 218314864 IAIQFEVLGOHPGH-SANMLTNESA-N 466.581 6.134 70 20 JKID COc1ccccc1Oc1ccc(NC(=O)C[C@@H](NC(C)=O)c2ccc(Br)cc2)cc1 216890072 UTZXUXYDRXYVRX-OAQYLSRUSA-N 483.362 5.456 70 20 JKID CC(C)CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCSc3c(F)cccc32)c(Cl)cc1Cl 216881294 WOOZEMBDFSXQPQ-QGZVFWFLSA-N 491.437 5.034 70 20 JKID CC(C)NC(=O)CSc1ccccc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 218369482 CGJYGGFZNUXIJB-UHFFFAOYSA-N 462.600 5.227 70 20 JKID Cc1ccc(C)c(OCc2nnc(S[C@H](C)C(=O)Nc3ccccc3Br)o2)c1 218666191 YMKXIRQINHJSTC-CQSZACIVSA-N 462.369 5.147 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(Cc2cccs2)n1-c1ccccc1 217159801 URMMTTWCIWIZCH-FQEVSTJZSA-N 480.684 5.609 70 20 JKID Cc1ccc(C)c(OCc2nnc(S[C@@H](C)C(=O)Nc3c(F)c(F)c(F)c(F)c3F)o2)c1 218666510 PYHZDYAURCUYRX-JTQLQIEISA-N 473.423 5.080 70 20 JKID CN(Cc1ccccc1N1CCCC1)C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 217423191 FFNZEDDOYGOXEE-RUZDIDTESA-N 452.602 5.742 70 20 JKID Cc1ccccc1-c1cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)c2cnn(C(C)C)c2n1 217994146 URTOZWHOXLBXKW-UHFFFAOYSA-N 469.589 5.072 70 20 JKID Cc1ccccc1-c1cc(C(=O)Nc2c(C(N)=O)oc3ccccc23)c2cnn(C(C)C)c2n1 217814822 GXKZVLDTAQRXRH-UHFFFAOYSA-N 453.502 5.085 70 20 JKID Cc1ccc(-c2cc(C(=O)Nc3c(C(N)=O)oc4ccccc34)c3cnn(C(C)C)c3n2)s1 217815048 LGCFHNXRJAGIEP-UHFFFAOYSA-N 459.531 5.147 70 20 JKID O=C(C(Br)=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1 142614351 ZNRGONUTKDLPOC-UHFFFAOYSA-N 459.323 5.388 70 20 JKID Cc1cc(-c2cc(C(=O)N3CCN(c4cccc(O)c4)CC3)c3cnn(C(C)C)c3n2)c(C)s1 217969814 SBNWQZLDFNSFIC-UHFFFAOYSA-N 475.618 5.026 70 20 JKID COc1ccc([C@@H](C)NC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)cc1Br 217164596 UDBJZPJAZHQDTA-GFCCVEGCSA-N 468.273 5.153 70 20 JKID Cc1ccc(NC(=O)c2cc(C(C)C)nc3onc(C)c23)cc1S(=O)(=O)Nc1ccccc1Cl 217951334 SZLRKOPNOMGZDL-UHFFFAOYSA-N 498.992 5.670 70 20 JKID COc1cc(CNCc2ccc(NC(C)=O)cc2)ccc1OCc1cccc(C(F)(F)F)c1 218258619 SFEOJYYPEVYLNO-UHFFFAOYSA-N 458.480 5.541 70 20 JKID Cc1cc(C)cc(N(C(=O)CCc2nc(C)no2)c2nc(-c3ccc(Br)cc3)cs2)c1 218323517 CFZNFUQDOVCCAL-UHFFFAOYSA-N 497.418 6.178 70 20 JKID CCCCn1c(S[C@@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nnc1[C@H](CC)N(C)C 218631514 ZODIKKVRPWJVQP-WMZOPIPTSA-N 452.068 5.480 70 20 JKID CC(=O)N[C@@H](CC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(Br)cc1 216774323 AEQFIHWMSANLTE-YPMLDQLKSA-N 476.173 5.340 70 20 JKID Cc1sc2ncnc(N3CCC(C(=O)Nc4ccc5c(c4)nc4n5CCCCC4)CC3)c2c1C 216672548 JSDUZMOLEWYQPC-UHFFFAOYSA-N 474.634 5.239 70 20 JKID O=C(Cn1cnc2sc3c(c2c1=O)CCCCC3)Nc1ccc(Cl)cc1C(F)(F)F 216776935 ALHVVKCJVQCKEV-UHFFFAOYSA-N 455.889 5.038 70 20 JKID CCCCn1c(S[C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)nnc1[C@@H](CC)N(C)C 218631100 IFRFVKZIMGDXTI-CXAGYDPISA-N 458.459 5.517 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(Br)cc1 216761288 VLZBLPVXWJLHKY-INIZCTEOSA-N 463.681 5.327 70 20 JKID O=C1N[C@@]2(CCCc3sccc32)C(=O)N1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 218287361 ZPXJAOABGZYNBB-HXUWFJFHSA-N 463.506 5.174 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1occc1CS(=O)(=O)c1ccccc1 217132532 UYKUSLMKPYPWIP-UHFFFAOYSA-N 475.551 5.178 70 20 JKID Cc1cc(NC(=O)Cc2ccc(OCc3c(C)noc3C)cc2)n(-c2cccc(C(F)(F)F)c2)n1 217924758 BTWKJVZSVNWZIT-UHFFFAOYSA-N 484.478 5.565 70 20 JKID O=C(Nc1ccc(CNCc2ccc(-c3ccc(Br)cc3)s2)cc1)c1ccco1 218470004 XTUFQZVBSLZQBG-UHFFFAOYSA-N 467.388 6.313 70 20 JKID C[C@H](Sc1nnc(-c2ccccc2)n1-c1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218650077 AWDGXCUVGZWKIV-LBPRGKRZSA-N 490.457 5.749 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2sc(C)c(C)c2c(=O)n1C(C)C 217155608 OOWKUYWPWQEYPA-INIZCTEOSA-N 461.678 5.345 70 20 JKID O=C(CSc1nc(-c2ccc(F)cc2)cs1)Nc1cc2c(cc1Cl)OCCCO2 217147000 WGXXKVRXGJXKHJ-UHFFFAOYSA-N 450.944 5.495 70 20 JKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1ccc(Sc2nccn2C)cc1 218146955 UNJALJFFUVMFIJ-UHFFFAOYSA-N 454.552 5.307 70 20 JKID C[C@@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218665923 ZMUHCCWTHUBSES-NXEZZACHSA-N 457.424 5.231 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 217159825 KEEFZYSQEGAUMP-FQEVSTJZSA-N 463.632 5.451 70 20 JKID C[C@H](Sc1nnc(C2CC2)n1Cc1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218661562 HLULVYQNWHGYEX-JTQLQIEISA-N 468.451 5.019 70 20 JKID COc1cc(C)c(CN(C)C(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)cc1OC 216806073 WBADTRKRPDOYQM-UHFFFAOYSA-N 454.570 5.737 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(Cc3ccccc3)n2-c2ccccc2)cc1)C(F)F 217863106 SNFAVROURRRZOJ-UHFFFAOYSA-N 471.554 5.147 70 20 JKID CCn1c(SCC(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)nnc1-c1ccccc1C 217608698 JWIJYLCPYIOVGB-UHFFFAOYSA-N 477.615 5.063 70 20 JKID CN1CCC2(CC1)C[C@H](NC(=O)Cc1csc(COc3ccc(Cl)cc3)n1)c1ccccc1O2 216791762 XQPRRFQMGWWJFQ-QFIPXVFZSA-N 498.048 5.022 70 20 JKID Cc1ccc(S(=O)(=O)Nc2ccc(N[C@@H](C)C(=O)Nc3cc(Cl)ccc3F)cc2)cc1 218727256 UMTWORDPKFHLJJ-HNNXBMFYSA-N 461.946 5.027 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2Cl)n1CCCOC 217141220 ZCGRYEPJGFMMQY-LJQANCHMSA-N 491.082 5.325 70 20 JKID COc1ccc(C(=O)C2CCN(C(=O)Cc3c(C)nc4ccccc4c3-c3ccccc3)CC2)cc1 218261595 YJGRCMXFEZHGCN-UHFFFAOYSA-N 478.592 5.883 70 20 JKID Cc1noc(C)c1COc1ccc(CC(=O)Nc2ccnn2Cc2ccccc2Br)cc1 216854529 CTYQAJYERDTOJV-UHFFFAOYSA-N 495.377 5.059 70 20 JKID COc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)c1 217049726 BQRYMYNQOWGYIK-UHFFFAOYSA-N 487.943 5.063 70 20 JKID O=C(N[C@H](CC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccccc1)c1ccccc1Cl 216849170 DOJVJUMDSTWEAP-RUZDIDTESA-N 460.961 5.223 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1Cc1ccccc1 217155672 INNCBGCUSVOWCC-NRFANRHFSA-N 475.643 5.078 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(-c4ccc(F)cc4)nc4ccccc34)CC2)cc1 217076450 GRRDCDSFEKMVNM-UHFFFAOYSA-N 497.570 5.474 70 20 JKID C[C@@H](C1CC1)n1nccc1NC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1 217889348 BELKORJMILKLLJ-KRWDZBQOSA-N 452.518 5.159 70 20 JKID C[C@H](NC(=O)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1)c1cccnc1 216695701 DEMUSKQBFFGVEQ-INIZCTEOSA-N 464.641 5.842 70 20 JKID COc1ccc(-c2nnc(S[C@@H](C(N)=O)c3ccc(F)cc3)n2-c2ccc(Cl)cc2)cc1 217811233 ZGTLSYIJKQQFMH-HXUWFJFHSA-N 468.941 5.054 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccccc3)n2-c2ccccc2)cc1)C(F)F 216865441 BHYHKOCSKOIBJL-UHFFFAOYSA-N 457.527 5.223 70 20 JKID O=C(CCc1ncc(-c2ccc(F)cc2F)o1)Nc1ccc(-c2nc3ccccc3s2)cn1 217788856 CEKVUICEGFQKCK-UHFFFAOYSA-N 462.481 5.863 70 20 JKID Cc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)n(-c2ccc(F)cc2)n1 217830799 LVGPYOQAJQPSFI-UHFFFAOYSA-N 459.308 5.853 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3cc(C)n(C4CCCCC4)c3C)CC2)cc1 217085288 ALFIJWGOUWRZTK-UHFFFAOYSA-N 451.611 5.043 70 20 JKID CC(=O)N[C@@H](CC(=O)Nc1ccc(SCc2cccnc2)cc1)c1ccc(Br)cc1 217142341 HEACZRJXIHFKLV-QFIPXVFZSA-N 484.419 5.342 70 20 JKID CCOc1ccc(N(C(=O)CCc2ccc3c(c2)OCCO3)c2nc3ccccc3s2)cc1 217048334 VKCLRMQCPIPMIB-UHFFFAOYSA-N 460.555 5.764 70 20 JKID Cc1ccn2cc(-c3ccc(NC(=O)c4cnn(-c5ccccc5)c4C(F)(F)F)cc3)nc2c1 217569440 SOQAZONYZRRRRX-UHFFFAOYSA-N 461.447 5.767 70 20 JKID CCOC(=O)c1sc(N(Cc2ccc(F)cc2)C(=O)c2ccc3ncsc3c2)nc1C 216647815 WQNRNUFGPKEUFK-UHFFFAOYSA-N 455.536 5.224 70 20 JKID COc1cc(/C=C\C(=O)NC(c2ccccc2)c2ccccc2)ccc1OCc1c(C)noc1C 216835959 YFZVSRHNEXEGIP-ICFOKQHNSA-N 468.553 5.798 70 20 JKID O=C1COc2cc(C(=O)NC[C@@H](c3ccc(Cl)cc3Cl)c3c[nH]c4ccccc34)ccc2N1 216642015 CZSQOBCCROBINP-SFHVURJKSA-N 480.351 5.368 70 20 JKID CCCCn1c(S[C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)nnc1[C@H](CC)N(C)C 218631255 IFRFVKZIMGDXTI-DYVFJYSZSA-N 458.459 5.517 70 20 JKID C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(=O)Nc1ccccc1Br 218651199 WYGVZPVNZRISQD-MRXNPFEDSA-N 494.414 5.327 70 20 JKID COc1ccc([C@@H](CNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)c2c[nH]c3ccccc23)cc1 218529979 HXFDWIOZKBOSRB-PIKZIKFNSA-N 483.593 5.054 70 20 JKID CSCC[C@@H](NC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1)c1nnc2ccccn12 217066072 GCFZGBFYWQBDOY-XMMPIXPASA-N 481.625 5.406 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 217155699 IRNMZLKEYDATAD-QFIPXVFZSA-N 492.645 5.822 70 20 JKID O=C(OCc1nc2ccccc2n1C(F)F)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 218246454 KQALSQGMCAIQCF-UHFFFAOYSA-N 469.448 5.237 70 20 JKID CCCCn1c(SCC(=O)N2CCc3sccc3[C@@H]2CC)nnc1-c1ccc(OC)cc1 217142564 NXYDBARAKDMXIF-FQEVSTJZSA-N 470.664 5.443 70 20 JKID Clc1ccc(Cl)c(OCCSc2nnc(CN3CCCC3)n2Cc2ccccc2)c1 216794249 YBLCHDHFLTXVAQ-UHFFFAOYSA-N 463.434 5.400 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cc1)C(F)F 216866503 BFPTVSVGULKBER-UHFFFAOYSA-N 495.960 5.528 70 20 JKID O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCN(Cc2nccn2C(F)F)CC1 217416929 DWPLEISEZSNNJP-UHFFFAOYSA-N 481.934 5.105 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 217789430 AQNKGLWZSDZAEA-UHFFFAOYSA-N 478.524 5.127 70 20 JKID Cc1cc(-c2cc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)c3cnn(C(C)C)c3n2)c(C)o1 217800458 VEIUFMJNLORCFU-UHFFFAOYSA-N 456.546 5.524 70 20 JKID Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1c(-c2ccccc2)nc2ccccn12 218137449 FIHASUBFWIEDGE-UHFFFAOYSA-N 458.518 5.737 70 20 JKID Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Sc1ccc(Cl)c(C(F)(F)F)c1 218634387 QOYBCLDCTYUVLI-CQSZACIVSA-N 453.917 6.281 70 20 JKID Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3ccc(CN4CCOCC4)cc3)[C@H]2c2cccs2)cc1 218596849 DGWRAVJPMJTIKQ-SQHAQQRYSA-N 489.641 5.012 70 20 JKID Cc1ccc(NC(=O)CS[C@H](C)C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1 216827868 PSCHYLHFAPCVFY-MRXNPFEDSA-N 462.600 5.366 70 20 JKID COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 218387360 SRMUTUGRCTZSTQ-DEOSSOPVSA-N 488.613 5.098 70 20 JKID C[C@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)N1CCC[C@H]1c1cccs1 218649677 YDSMWBMNHZHUCV-KKSFZXQISA-N 479.602 5.431 70 20 JKID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N(Cc1ccccn1)C1CC1 217424302 LGBBWWRFAFIDPC-JOCHJYFZSA-N 479.411 6.376 70 20 JKID CCCCn1c(SCC(=O)N2CCc3sccc3[C@H]2CC)nnc1-c1ccc(OC)cc1 217142576 NXYDBARAKDMXIF-HXUWFJFHSA-N 470.664 5.443 70 20 JKID CCOc1ccc(Oc2ccccc2NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1 216768171 LRHSPJQLHVYGPJ-QHCPKHFHSA-N 497.389 5.846 70 20 JKID COc1ccc(/C=C2/C[C@H](C)Cc3c2nc2ccccc2c3C(=O)N(C)C2CCN(C)CC2)cc1 217932291 SJORAJCTOOLMCH-UUZBPDLYSA-N 469.629 5.533 70 20 JKID COc1ccc([C@@H](CC(=O)N(Cc2sccc2C)c2ccc(F)c(Cl)c2)NC(C)=O)cc1 217806716 NUMDBKIDXOBDNJ-JOCHJYFZSA-N 474.985 5.658 70 20 JKID CCCCn1c(SCC(=O)Nc2ccc(Br)cc2Cl)nnc1[C@@H](CC)N(C)C 217150697 BTONQUYDBICCFU-MRXNPFEDSA-N 488.883 5.238 70 20 JKID CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1nc2ccccc2n1CCS(=O)(=O)F 883954472 OQLUOXWJAYHYDQ-GOSISDBHSA-N 486.396 5.160 70 20 JKID CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccccc1SCc1csc(C)n1 218067387 RXLGDFYBHULPTG-UHFFFAOYSA-N 461.559 5.123 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1)c1ccc(Cl)cc1 217788530 OYZOXYBPWCENEQ-LJQANCHMSA-N 450.951 5.218 70 20 JKID Cc1ccc(N2C(=O)CC[C@H](C(=O)N3CC=C(c4ccc(O)cc4)CC3)[C@H]2c2cccs2)cc1 216851657 BVGUYJFYPWIMIS-IGKIAQTJSA-N 472.610 5.562 70 20 JKID Cc1cccc(C)c1NC(=O)[C@H](C)Sc1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccco1 217858922 HUZMZHHMIIRZKH-HLIPFELVSA-N 467.639 5.138 70 20 JKID O=C(NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1Nc1ccc(OC(F)F)cc1 217132850 SKDXANWYXDBWCJ-UHFFFAOYSA-N 465.500 5.066 70 20 JKID CCCCn1c(S[C@@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nnc1[C@@H](CC)N(C)C 218631354 ZODIKKVRPWJVQP-FUHWJXTLSA-N 452.068 5.480 70 20 JKID O=C(c1ccc(CSc2cc(Cl)ccc2Cl)cc1)N(C1CC1)[C@H]1CCS(=O)(=O)C1 216834953 BODLUTJTHPHZRS-SFHVURJKSA-N 470.443 5.077 70 20 JKID Cc1cccc(-c2nnc(S[C@H](C(N)=O)c3ccc(F)cc3)n2-c2ccc(Cl)cc2)c1 217810663 NAKHESCCLSCXKT-FQEVSTJZSA-N 452.942 5.354 70 20 JKID Cc1noc(C)c1CSc1ncccc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 218370603 PPIOQPJRNVJTBU-UHFFFAOYSA-N 473.583 5.903 70 20 JKID CC(C)Cn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nnc1-c1ccccc1F 216859211 NDVXPUUBQSSQMJ-UHFFFAOYSA-N 455.527 5.029 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1cnc2c(cnn2Cc2ccccc2)c1 218127153 ALPSEGJZPRRNAP-UHFFFAOYSA-N 462.538 5.404 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3oc4ccccc4c3COc3ccccc3)CC2)cc1 217081933 ACFXNMLNQAEYJD-UHFFFAOYSA-N 498.579 5.445 70 20 JKID COc1ccc(-c2nnc(S[C@H](C(N)=O)c3ccc(F)cc3)n2-c2ccc(Cl)cc2)cc1 217811313 ZGTLSYIJKQQFMH-FQEVSTJZSA-N 468.941 5.054 70 20 JKID C[C@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)N1CCC[C@@H]1c1cccs1 218649505 YDSMWBMNHZHUCV-HRAATJIYSA-N 479.602 5.431 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1cccc(-c2csc(C)n2)c1)c1ccc(Br)cc1 216771820 WTMXGZBSYYLZHJ-LJQANCHMSA-N 458.381 5.087 70 20 JKID COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)c1 216848517 MRLHGLOWCVXHEI-UHFFFAOYSA-N 451.526 5.183 70 20 JKID O=C(CSc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1)NC[C@@H](O)c1ccccc1 217147263 QEDUZJAGEVDLHB-OAQYLSRUSA-N 499.423 5.183 70 20 JKID C[C@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 218665762 ZMUHCCWTHUBSES-ZJUUUORDSA-N 457.424 5.231 70 20 JKID Cc1cc(C(=O)CS[C@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)c(C)n1-c1nccs1 217122174 XRMHPAJVHGDAKD-CQSZACIVSA-N 496.639 5.786 70 20 JKID CCCCn1c(S[C@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nnc1[C@@H](CC)N(C)C 218631438 ZODIKKVRPWJVQP-SJLPKXTDSA-N 452.068 5.480 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2ccccc2c(=O)n1C1CCCC1 217155643 NEIBEVXQBOJHJV-HXUWFJFHSA-N 453.633 5.201 70 20 JKID COc1cc(C(=O)Nc2cc(C)nn2-c2ccc(F)cc2)cc(OC)c1OCc1ccccc1 217370245 BHIPOBCWCYSWDW-UHFFFAOYSA-N 461.493 5.168 70 20 JKID COc1cccc(NCc2nnc(SCc3cnn(-c4ccccc4)c3)n2C2CCCCC2)c1 217504704 LWRJLLKYOPHOKI-UHFFFAOYSA-N 474.634 5.882 70 20 JKID Cc1ccc(-c2cc(C(=O)N[C@H]3CC4(CCN(C)CC4)Oc4ccccc43)c3c(C)noc3n2)cc1 217962312 RUUGTHCXNAMTSH-DEOSSOPVSA-N 482.584 5.225 70 20 JKID CCn1c(S[C@H](C)C(=O)Nc2c(F)c(F)c(F)c(F)c2F)nnc1-c1cccc(C)c1 218668107 KXZATNOIFBMFSX-SNVBAGLBSA-N 456.440 5.088 70 20 JKID CC(=O)N[C@H](CC(=O)NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(Br)cc1 217626825 SLFYHMXSQMMCDR-LJQANCHMSA-N 498.402 5.203 70 20 JKID O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1ccc(CN2CCOCC2)cc1 217994485 YABLRVUXPRDCSF-UHFFFAOYSA-N 460.361 5.052 70 20 JKID COc1ccc([C@H](CNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c2c[nH]c3ccccc23)cc1 218530244 HXFDWIOZKBOSRB-RBTNQOKQSA-N 483.593 5.054 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 217142686 DMNBZEAGIRNWIJ-JOCHJYFZSA-N 492.645 5.822 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2sc(C)c(C)c2c(=O)n1C(C)C 217155603 OOWKUYWPWQEYPA-MRXNPFEDSA-N 461.678 5.345 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2sc3c(c2c(=O)n1CC)CCCC3 217155618 IOKLHUYSPFACSA-MRXNPFEDSA-N 473.689 5.046 70 20 JKID O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 217609144 AWGZFCPHTPSSNQ-DEOSSOPVSA-N 468.534 5.452 70 20 JKID CCCCn1c(SCc2ccc(S(=O)(=O)C(F)F)cc2)nc2sc(C)c(C)c2c1=O 216859800 BQDWZCXUSAKKOK-UHFFFAOYSA-N 472.604 5.164 70 20 JKID Cc1ccc(-c2cc(C(=O)N[C@@H]3CC4(CCN(C)CC4)Oc4ccccc43)c3c(C)noc3n2)cc1 217962228 RUUGTHCXNAMTSH-XMMPIXPASA-N 482.584 5.225 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(CSc4ccccc4)cc3)CC2)cc1 217078970 WTIGZJPJHPRHNG-UHFFFAOYSA-N 474.626 5.412 70 20 JKID Cc1cc(CSc2ccccc2C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)on1 218371291 HJFHHMCPOKAVRH-UHFFFAOYSA-N 458.568 6.199 70 20 JKID C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(=O)Nc1ccccc1Br 218651254 WYGVZPVNZRISQD-INIZCTEOSA-N 494.414 5.327 70 20 JKID CN(Cc1ccccc1N1CCCC1)C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 217423280 FFNZEDDOYGOXEE-VWLOTQADSA-N 452.602 5.742 70 20 JKID O=c1c2ccccc2nc(SCc2ccc(S(=O)(=O)C(F)F)cc2)n1C1CCCCC1 216866432 WLOZHTFJIOVFMT-UHFFFAOYSA-N 464.559 5.190 70 20 JKID CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CC=C(c3ccc(O)cc3)CC2)c1 216848305 WJDYNSASBKDZCE-UHFFFAOYSA-N 497.016 5.190 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 217154776 PTBOFRWRAQYKDW-HXUWFJFHSA-N 461.616 5.019 70 20 JKID CCOc1ccccc1Nc1nnc(SCC(=O)N2CCc3sccc3[C@@H]2CC)s1 217154558 MHOBXEZSOZZUGT-INIZCTEOSA-N 460.650 5.370 70 20 JKID Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)Sc1nc(-c2ccc(F)cc2)cs1 218627911 BOLMKBIKYNOEQL-INIZCTEOSA-N 452.580 5.871 70 20 JKID C[C@@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)N1CCC[C@@H]1c1cccs1 218649441 YDSMWBMNHZHUCV-IIBYNOLFSA-N 479.602 5.431 70 20 JKID CCCCn1c(S[C@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)nnc1[C@@H](CC)N(C)C 216860933 XFISNZNXMGWZFE-GDBMZVCRSA-N 486.667 5.502 70 20 JKID Cc1noc2nc(C(C)C)cc(C(=O)Nc3cccc(S(=O)(=O)Nc4ccccc4Cl)c3)c12 217941151 PHXIKWGZGQNLCL-UHFFFAOYSA-N 484.965 5.361 70 20 JKID O=C(c1ccc(CSc2cc(Cl)ccc2Cl)cc1)N(C1CC1)[C@@H]1CCS(=O)(=O)C1 216834919 BODLUTJTHPHZRS-GOSISDBHSA-N 470.443 5.077 70 20 JKID COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1 216852842 WXSNBXVXEKRNDN-UHFFFAOYSA-N 465.553 5.242 70 20 JKID Cc1cc(-c2cc(C(=O)Nc3c(C(N)=O)oc4ccccc34)c3cnn(C(C)C)c3n2)c(C)s1 217706349 NDVLWFLSWHCHRE-UHFFFAOYSA-N 473.558 5.455 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)cc1)C(F)F 216865482 BRKDAHMWAFYBOG-UHFFFAOYSA-N 469.538 5.494 70 20 JKID O=C(Nc1nnc(SCc2cccs2)s1)c1cnn(-c2ccccc2)c1C(F)(F)F 217163733 FIJYSDWSJOEFNV-UHFFFAOYSA-N 467.523 5.349 70 20 JKID CCN(CC)[C@@H](CNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1Cl 218347611 LHBREBMPBOFYHN-FQEVSTJZSA-N 464.919 5.357 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(Br)cc2)o1 217143187 NVAARCVTVLSJFZ-OAHLLOKOSA-N 464.410 5.189 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)cc1)C(F)F 216866246 VJTRWHMRERMHPU-UHFFFAOYSA-N 489.544 5.421 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccc(OC)c2)n1Cc1ccco1 217156923 OPTDIBZUOWEHIR-OAQYLSRUSA-N 494.642 5.285 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2cccc(C)c2)n1Cc1ccco1 217159079 YXCGQDZFJAQCIR-OAQYLSRUSA-N 478.643 5.584 70 20 JKID CC(C)[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 216715380 ZYVDHNACDPITSU-OAQYLSRUSA-N 464.978 5.405 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1 217154755 ODKZDDMHLUJQBB-GOSISDBHSA-N 450.589 5.217 70 20 JKID Cc1cc(C(=O)CS[C@@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)c(C)n1-c1nccs1 217122159 XRMHPAJVHGDAKD-AWEZNQCLSA-N 496.639 5.786 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)Cc3coc4cc(C)c(C(C)C)cc34)CC2)cc1 217078291 BUCATMXOJHGJPO-UHFFFAOYSA-N 462.590 5.227 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccoc2C)n1Cc1ccccc1 217155732 PFAJWWBWZWLUBA-OAQYLSRUSA-N 478.643 5.584 70 20 JKID CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2csc3ccccc23)sc1C 217163589 BGLBXBLIFAAVKR-UHFFFAOYSA-N 450.585 5.732 70 20 JKID Cc1cc(NC(=O)Cc2ccc(OCc3c(C)noc3C)cc2)n(-c2ccc(Cl)cc2)n1 217923403 GCAZGUTYJAKNBF-UHFFFAOYSA-N 450.926 5.199 70 20 JKID COc1ccc(-c2nc(NC(=O)C[C@H](NC(C)=O)c3ccc(Br)cc3)sc2C)cc1 218055881 DCQCVBWXXQHZPO-IBGZPJMESA-N 488.407 5.096 70 20 JKID COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)c(OC)c1 216851814 UJFXBTLVTDZCFN-UHFFFAOYSA-N 481.552 5.192 70 20 JKID O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 216717245 XTRUMSKRDGSYSX-GOSISDBHSA-N 476.989 5.503 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccc(OC)cc2)n1Cc1ccco1 217156840 NHVJCDPRUOGAAI-OAQYLSRUSA-N 494.642 5.285 70 20 JKID NC(=O)c1ccc(N2CCCC2)c(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)c1 216794992 JWUMJBAVNGYSDN-UHFFFAOYSA-N 468.793 5.813 70 20 JKID Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1 216852060 OZWPHAPXLQNXLS-NRFANRHFSA-N 461.569 5.553 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)cc1)C(F)F 216864592 ZZIDLRSWDYEKJX-UHFFFAOYSA-N 492.960 5.271 70 20 JKID Cc1ccc(Cn2nccc2NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cc1 217816627 HKOJHXGMHYFAEG-UHFFFAOYSA-N 455.345 5.773 70 20 JKID CN(C(=O)c1cc(Br)c(C(=O)N(C)C2CCCC2)cc1Br)C1CCCC1 216845302 FWDWYHSOKOXURJ-UHFFFAOYSA-N 486.248 5.241 70 20 JKID COc1cc(CCC(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cc(OC)c1OC 216851180 WLPFJEVHSHBWIW-YFHOEESVSA-N 489.568 5.163 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)cc1)C(F)F 216860043 MSARRJVCVSEMHU-UHFFFAOYSA-N 483.993 6.002 70 20 JKID COc1ccc(-c2nnc(SCc3ccc(S(=O)(=O)C(F)F)cc3)n2C2CCCCC2)cc1 216869912 MJEKERIEPZOGNQ-UHFFFAOYSA-N 493.601 5.748 70 20 JKID COc1ccc(-n2c(SCc3ccc(S(=O)(=O)C(F)F)cc3)nnc2-c2ccccc2)cc1 216866718 BMFCZDOCMUONPM-UHFFFAOYSA-N 487.553 5.232 70 20 JKID O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)N(Cc1ccccn1)C1CC1 217424378 LGBBWWRFAFIDPC-QFIPXVFZSA-N 479.411 6.376 70 20 JKID COc1cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)ccc1OCc1ccc(Cl)cc1 216688670 SMHHQYMRHGDAFW-UHFFFAOYSA-N 466.965 5.012 70 20 JKID O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)c1cnc2sccn2c1=O 217026448 HZLUNDKPEKDQQB-MRXNPFEDSA-N 483.380 5.106 70 20 JKID Cc1ccccc1-c1nnc(SCC(=O)Nc2ccc(N3CCCCC3)nc2)n1Cc1ccco1 218673572 GRKNFVJOHMFJGD-UHFFFAOYSA-N 488.617 5.011 70 20 JKID O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 217164843 YLPHPEVZGVJMTO-UHFFFAOYSA-N 496.455 5.258 70 20 JKID Cc1noc2nc(C(C)C)cc(C(=O)N(C)CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)c12 217651187 IKXJOQWNQMGPNR-UHFFFAOYSA-N 468.863 5.038 70 20 JKID O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)NC1CCN(C(=O)c2ccccc2)CC1 216881165 VTHYPODSSXWLEJ-UHFFFAOYSA-N 469.560 5.328 70 20 JKID CC(=O)N[C@@H](CC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(Br)cc1 216774409 AEQFIHWMSANLTE-MGNBDDOMSA-N 476.173 5.340 70 20 JKID Cc1nc(COc2cccc(C(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)c2)cs1 216830955 SESNROZDFIYIMJ-UHFFFAOYSA-N 458.568 5.955 70 20 JKID C[C@]12CCCc3cc(OS(=O)(=O)C(F)(F)F)ccc3[C@]1(Cc1ccccc1)CCC(=O)C2 97973137 KLEDRLQUFCHLPF-DHIUTWEWSA-N 466.521 5.491 70 20 JKID CCCCn1c(S[C@@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)nnc1[C@@H](CC)N(C)C 216860907 XFISNZNXMGWZFE-GOEBONIOSA-N 486.667 5.502 70 20 JKID O=S(=O)(c1ccc(CSc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)cc1)C(F)F 216867750 SKLNMNFSBIKOOZ-UHFFFAOYSA-N 475.517 5.362 70 20 JKID O=C(OCc1nc2ccccc2n1C(F)F)c1ccc(Cl)c(NC(=O)c2cccs2)c1 217913075 CTGLOPHFOHHHRS-UHFFFAOYSA-N 461.877 5.756 70 20 JKID Cc1noc(C)c1COc1ccc(CC(=O)Nc2nnc(SCc3cccs3)s2)cc1 216817430 AJVZNVVDEJYGFV-UHFFFAOYSA-N 472.617 5.257 70 20 JKID Cc1ccccc1-c1nnc(SCC(=O)N2c3ccccc3CC[C@H]2C)n1Cc1ccco1 217158890 SWJYLVHEBZIFPZ-LJQANCHMSA-N 458.587 5.355 70 20 JKID COc1ccc([C@@H](CNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)c2c[nH]c3ccccc23)cc1 218530159 HXFDWIOZKBOSRB-LYZGTLIUSA-N 483.593 5.054 70 20 JKID Cc1ccc(-c2csc(NC(=O)CSc3nnc(C4CC4)n3Cc3ccccc3)n2)s1 217153954 RJVNWUDZMDMPAZ-UHFFFAOYSA-N 467.645 5.428 70 20 JKID CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(-c4nc5ccccc5s4)s3)CC2)cc1 217077079 UUPWVAFGIGYOFD-UHFFFAOYSA-N 491.638 5.458 70 20 JKID COc1cc(CNC2CCN(C(=O)c3ccccc3)CC2)ccc1OCc1cccc(C(F)(F)F)c1 217022548 DONHMNYVXIQCKT-UHFFFAOYSA-N 498.545 5.687 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCC(=O)c3ccc(Cl)cc3)n2)cc1 216817915 BLVLCMRPNFDPHP-UHFFFAOYSA-N 469.994 5.134 70 20 JKID COc1ccccc1Oc1ccc(NC(=O)C[C@H](NC(C)=O)c2ccc(Br)cc2)cc1 216890112 UTZXUXYDRXYVRX-NRFANRHFSA-N 483.362 5.456 70 20 JKID CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1 216830253 ZJRHOMWGKPKGOS-UHFFFAOYSA-N 460.559 5.635 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(COc2ccccc2Cl)n1C1CC1 217149907 XPHADVUAUABUPH-SFHVURJKSA-N 489.066 5.535 70 20 JKID CSCC[C@H](NC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1)c1nnc2ccccn12 217066107 GCFZGBFYWQBDOY-DEOSSOPVSA-N 481.625 5.406 70 20 JKID CC(=O)NCCCc1ccc(-c2csc(NC(=O)CCc3cccc(Br)c3)n2)cc1 216818539 VANGAWSXZXHEJV-UHFFFAOYSA-N 486.435 5.213 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccncc2)n1Cc1ccccc1 217155663 INNCBGCUSVOWCC-OAQYLSRUSA-N 475.643 5.078 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2scc(-c3cccs3)c2c(=O)n1C 217155564 FEGIIJCYNMIBQC-OAHLLOKOSA-N 487.697 5.413 70 20 JKID Cc1nn(C)c2ncc(C(=O)Nc3nc(-c4cc(C)n(CCc5ccccc5)c4C)cs3)cc12 218178266 PJBXXZJHTFYRFV-UHFFFAOYSA-N 470.602 5.314 70 20 JKID Cc1ccc(N2C(=O)CC[C@@H](C(=O)N3CC=C(c4ccc(O)cc4)CC3)[C@H]2c2cccs2)cc1 216851628 BVGUYJFYPWIMIS-SQHAQQRYSA-N 472.610 5.562 70 20 JKID O=C(c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1)N1CC=C(c2ccc(O)cc2)CC1 217891781 SUVJUXNBLBOIEQ-UHFFFAOYSA-N 476.536 5.375 70 20 JKID COc1ccc(-c2nc(NC(=O)C[C@@H](NC(C)=O)c3ccc(Br)cc3)sc2C)cc1 218055816 DCQCVBWXXQHZPO-LJQANCHMSA-N 488.407 5.096 70 20 JKID Cc1ccc(C)c(OCc2nnc(S[C@H](C)C(=O)Nc3c(F)c(F)c(F)c(F)c3F)o2)c1 218666583 PYHZDYAURCUYRX-SNVBAGLBSA-N 473.423 5.080 70 20 JKID Cc1ccc(-n2ncc(C(=O)Nc3ccc4nc(N5CCCC5)sc4c3)c2C(F)(F)F)cc1 217844592 GOYPKLHHKVQVNX-UHFFFAOYSA-N 471.508 5.662 70 20 JKID C[C@@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)N1CCC[C@H]1c1cccs1 218649594 YDSMWBMNHZHUCV-IERDGZPVSA-N 479.602 5.431 70 20 JKID CCCCc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3ncccc3C)c2)cc1 217009758 ZZZGGMYLJAVIOH-UHFFFAOYSA-N 457.983 5.439 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccccc1Cc1ccccc1)c1ccc(Br)cc1 217142672 WNMRTHJVVYEIFK-HSZRJFAPSA-N 451.364 5.246 70 20 JKID CCCCn1c(S[C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)nnc1[C@H](CC)N(C)C 218631180 IFRFVKZIMGDXTI-GUYCJALGSA-N 458.459 5.517 70 20 JKID CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(-c2ccccc2F)n1CC(C)C 217138249 OGTGYMHCWDWFSW-IBGZPJMESA-N 458.628 5.430 70 20 JKID COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc(C(C)C)nc3onc(C)c13)CC2 217953382 XSLAZYKFUAECTO-AREMUKBSSA-N 471.557 5.460 70 20 JKID CCCCn1c(S[C@H](C)c2nc3scc(-c4ccco4)c3c(=O)[nH]2)nnc1[C@H](CC)N(C)C 216860985 XFISNZNXMGWZFE-ZBFHGGJFSA-N 486.667 5.502 70 20 JKID COc1cccc(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)c1OC(F)F 217615126 DYGNJEVTPMOJCP-UHFFFAOYSA-N 469.307 5.359 70 20 JKID CC(=O)N[C@@H](CC(=O)N[C@H](Cc1ccccc1)c1ccccc1)c1ccc(Br)cc1 216799067 FJCTYIKCLKYBLD-RPWUZVMVSA-N 465.391 5.117 70 20 JKID CSCC[C@@H](NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnc2ccccn12 217066168 NWJIFBLAENVJSX-SQRWCISFSA-N 488.457 5.391 70 20 JKID CC(=O)N[C@H](CC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccc(Br)cc1 216756257 NHDOJFPJOBTFNY-HSZRJFAPSA-N 467.363 5.234 70 20 JKID CCOC(=O)c1sc(N(Cc2ccc(F)cc2)C(=O)c2cc(C3CC3)nc3onc(C)c23)nc1C 217970742 LALYSZOWKUAHRV-UHFFFAOYSA-N 494.548 5.336 70 20 JKID O=C(Nc1ccc(Cc2ccncc2)cc1)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 217011902 WGMOXFCIABSVGC-UHFFFAOYSA-N 456.855 5.783 70 20 JKID CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(Cc2cccs2)n1-c1ccccc1 217159789 URMMTTWCIWIZCH-HXUWFJFHSA-N 480.684 5.609 70 20 JKID C[C@H](C1CC1)n1nccc1NC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1 217889431 BELKORJMILKLLJ-QGZVFWFLSA-N 452.518 5.159 70 20 JKID