smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 915927775 ZFUWFDFXYKYEPO-UHFFFAOYSA-N 478.571 1.965 10 20 JDCD CCOc1ccc(N/C=C2/C(=O)NC(=S)N(CCOC)C2=O)cc1S(=O)(=O)N(CC)CC 920980164 AGDIRONPHLRBKM-SQFISAMPSA-N 484.600 1.301 10 20 JDCD COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2 1779850909 ZJSOMKJHOGPMRH-OPAMFIHVSA-N 492.623 1.386 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2c[nH]c(=O)cn2)CCO3)cc1 1781754472 VRSUGOKYDPRSBL-RUZDIDTESA-N 461.522 1.935 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnn1)C2 1783221986 WPTXYJDHEFQTMR-WZMUZEJKSA-N 454.483 1.434 10 20 JDCD Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785540628 ZUZSHTCXWZSWQM-HXUWFJFHSA-N 468.000 1.952 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1785540702 NJPQHXBXOZPGGU-QZTJIDSGSA-N 479.546 1.594 10 20 JDCD CC(C)(C)[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787538803 MZZLINSVCSNTMN-WRGRXTPVSA-N 456.543 1.166 10 20 JDCD Cn1ncc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CN5C(=O)CSC5=S)C[C@@H]43)cccc21 1788068777 WOAPWSJCPDQPTB-OWQGQXMQSA-N 487.607 1.027 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21 1792219105 JPWHYNNIQCKMLN-BEAZRHNASA-N 478.505 1.986 10 20 JDCD COc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792245355 NKIVFPDYLJUYMK-NOLJZWGESA-N 498.026 1.802 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)Cn3ccncc3=O)CCC2)cc1 1792315844 GTUNMWQGVFNIBH-UHFFFAOYSA-N 471.564 1.238 10 20 JDCD COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1793903093 OTUWXALXXUEYNL-RZWHZLNYSA-N 483.521 1.443 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ncc(Cl)cn1 1794539669 KRNBXRKSAKIXHG-HBCWATKFSA-N 468.901 1.126 10 20 JDCD O=C1CSc2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)cc2N1 1796604207 PUPWTNVCSCHDCP-BTTYYORXSA-N 455.496 1.498 10 20 JDCD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1804190077 HJFVCHUZJVFKHJ-ORAYPTAESA-N 487.900 1.018 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC[C@@H](CNC(=O)CN)[C@@H]1c1cccnc1 1807033023 RJEHVYJKTPMOTO-WPYKKVEZSA-N 496.612 1.764 10 20 JDCD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807993861 OMYDIWHVXUPJIG-KUDFPVQQSA-N 450.499 1.740 10 20 JDCD N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808205887 PYKDNJZEANJGFA-VHFSOBRXSA-N 468.539 1.234 10 20 JDCD C[C@H](C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)n1ccnc1 1814185604 TXIGHGRQOUKWJY-ALKREAHSSA-N 472.596 1.405 10 20 JDCD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814188845 BTESHFRIHFYGPW-LUQKVYGDSA-N 498.634 1.843 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cc(O)ccc2O)[C@@H]1c1cccnc1 1814189329 FKZOVOAQPRFQSC-VBKZILBWSA-N 486.575 1.673 10 20 JDCD COC(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817367265 VYKHYVYOEYDHIM-GFCCVEGCSA-N 470.511 1.204 10 20 JDCD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1)n1cnnn1 1823479336 JAZPTURPPWNMSI-KUELQNGQSA-N 468.474 1.480 10 20 JDCD CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496652 MXYSGGRNPLONCJ-AWEZNQCLSA-N 480.616 1.569 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ncccc23)[nH]n1 1823498103 MURCVADVIBGNQB-HNNXBMFYSA-N 484.567 1.619 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cscn1)CCO2 1834257158 DPGJCMDGUDZJCY-IBGZPJMESA-N 453.904 1.592 10 20 JDCD CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1836618552 HXQFRRDONBUTLY-ZEZYUPADSA-N 489.569 1.730 10 20 JDCD C[C@](O)(C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)C(F)(F)F 1837018302 ZWCNDROGMBSYSN-SFHVURJKSA-N 497.561 1.159 10 20 JDCD CCc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)co1 1838137940 FZXODXWXLRITRZ-NRFANRHFSA-N 465.890 1.685 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881749 MCGPBTDBPWMRBS-YIVYICKSSA-N 499.520 1.136 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055608 NHQUNOAOIIBCAY-JLCFBVMHSA-N 494.639 1.450 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 104987666 ZWWHNJBQZFVCRO-UHFFFAOYSA-N 491.566 1.394 10 20 JDCD C[C@@]1(c2ccc(CNC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2)NC(=O)NC1=O 726235199 WYGJJAFYYREVBD-BVZFJXPGSA-N 478.553 1.442 10 20 JDCD O=C(Nc1cccc(-n2cnnn2)c1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726725643 DRZACRAPJJCKMV-UHFFFAOYSA-N 457.441 1.987 10 20 JDCD CCCNC(=O)c1cccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743432203 IWOGZAAKNVRIBR-UHFFFAOYSA-N 467.570 1.712 10 20 JDCD CN1CCN(C(=O)CN(C)C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 914450130 XMRWJKUDOFZCFQ-SSZFMOIBSA-N 466.654 1.962 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)NCc3cccnc3N3CCOCC3)CC2)cc1 916197140 VJOMMUVTANGOLR-UHFFFAOYSA-N 468.602 1.938 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(=O)(=O)N2CCOCC2)o1 917708144 HXWJSSNRHFYBDN-UHFFFAOYSA-N 453.492 1.206 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4nc(O)nc(O)c4c3)cc2)C1 917929281 BXLSTWDTIVFTRR-AWEZNQCLSA-N 457.512 1.221 10 20 JDCD CC(C)(C)[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127019 WNVKMBYPFZJFFI-FZOAFFARSA-N 470.570 1.700 10 20 JDCD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127266 HTIFTTFYOYPVHR-UNIVCBNLSA-N 497.596 1.598 10 20 JDCD CCNC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1779325110 GIQFLRQGDFUFDH-NYFKNOIKSA-N 482.965 1.586 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008697 HPGKKTYWSGXRBY-MPBGBICISA-N 456.879 1.756 10 20 JDCD Cc1cccnc1CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783245199 MARLIJTVCDYYEV-WZONZLPQSA-N 490.651 1.697 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)c(F)c1)C2 1783246625 BJIAQCMGIZYJOD-VGOFRKELSA-N 495.598 1.306 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCCC1)C2 1783246627 ZONICSJKSAOWMV-VGOFRKELSA-N 482.672 1.237 10 20 JDCD C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1783257292 NGPOBVMRZABPMV-DNHRDODTSA-N 482.537 1.439 10 20 JDCD O=C(Cc1ccc(Cl)s1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1785113034 HDHAGSISRQQEJT-UBHSHLNASA-N 488.056 1.784 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1nnc(-c3ccccc3)o1)CCO2 1785540968 NRCIHSFBUSTLNN-OAQYLSRUSA-N 487.563 1.040 10 20 JDCD O=C1CCCc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CN5C(=O)CSC5=S)C4)C3)ccc21 1785541253 XSRGBQJRUMFODL-QHCPKHFHSA-N 487.603 1.509 10 20 JDCD O=C(Cc1cc(F)ccc1F)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785546214 JAMIWHLHCSTICJ-FQEVSTJZSA-N 469.535 1.198 10 20 JDCD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1)[S@](=O)c1ccccc1 1787294495 UFIOFFUPUHIMSZ-IRDDAQFPSA-N 473.551 1.282 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(Cl)cn3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787537372 QNTNRYDMEVAEIJ-FNHZYXHNSA-N 482.928 1.516 10 20 JDCD Nc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)cs1 1792218445 DVNIETXOUMUMBA-OXAOVKGQSA-N 460.512 1.149 10 20 JDCD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)ccc21 1796601338 VMAXQRQYEXYNGM-MUJYYYPQSA-N 451.483 1.249 10 20 JDCD CC1(C(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)COC1 1802668633 VXXBTRYFNKAOHD-GCJKJVERSA-N 461.522 1.917 10 20 JDCD CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808227680 DHGNTWQIIQQASJ-LZNRXBQRSA-N 491.552 1.327 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cnc2ncccn12 1809337510 RGZMZBJIIMZSRW-DNVCBOLYSA-N 495.590 1.304 10 20 JDCD CS(=O)(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1813577074 JYEAKENHTFAJKJ-LIRRHRJNSA-N 481.958 1.901 10 20 JDCD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814185631 UMCUBGFXTRCUAC-ABSDTBQOSA-N 475.640 1.432 10 20 JDCD CS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817058268 SKVIDKLGIQMNME-OWNNVSBGSA-N 464.500 1.277 10 20 JDCD Cc1cc(NC(=O)CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)no1 1818094176 RBAWTYQETGBNEG-AWEZNQCLSA-N 469.458 1.847 10 20 JDCD Cc1cnc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)CN4C(=O)CSC4=S)[nH]n3)cnn2c1 1819075191 RCEUXZGCHCSHPU-OAHLLOKOSA-N 498.594 1.927 10 20 JDCD O=C(Nc1cccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819528408 QIYQFPACIFOWIX-OAHLLOKOSA-N 451.443 1.556 10 20 JDCD O=C(c1cc(=O)cco1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898586 QHJFWZXHDHKDLV-MRXNPFEDSA-N 463.581 1.733 10 20 JDCD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1)n1ccnn1 1832899890 MRCWZWSOPCCRHQ-GDBMZVCRSA-N 464.617 1.319 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835132710 GPRKHCVCVKHJMO-UHFFFAOYSA-N 488.592 1.989 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1838030236 HEBGGSZSTMFWCR-UHFFFAOYSA-N 459.459 1.655 10 20 JDCD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031749 JVFOTVAQLCLZMN-PMACEKPBSA-N 487.553 1.860 10 20 JDCD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839032130 IRYMEWQIRQSXTI-XMMPIXPASA-N 493.557 1.321 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CN)C3)C2)cc1 1839348582 WXRNAHBEKGPPSV-IQGLISFBSA-N 454.571 1.759 10 20 JDCD C[C@@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433174 NYGDGLFGRONZJQ-CMJOXMDJSA-N 491.928 1.684 10 20 JDCD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)cc1 1839938331 GCSUGRSAFAVUKT-DEOSSOPVSA-N 455.511 1.504 10 20 JDCD C[C@@H]1CCc2c(C(=O)N3CCOC[C@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)n[nH]c21 1840880623 BKYVWOYSBXJMJK-MOGMQKQQSA-N 498.536 1.360 10 20 JDCD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)nn1-c1ccccc1F 1843249795 AGXBJZJDZRGFSG-UHFFFAOYSA-N 467.457 1.957 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1 1844199623 XRTSVQCIVZNIHQ-LBQODKDLSA-N 465.462 1.755 10 20 JDCD Cc1nnnn1-c1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1F 727946556 JIGUYQRBFFPXDJ-UHFFFAOYSA-N 453.478 1.544 10 20 JDCD COC(=O)CN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)CC1 729060892 MFSNNAIXTPQLST-UHFFFAOYSA-N 479.581 1.619 10 20 JDCD NC(=O)[C@H]1CCCN(CCCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 729495949 CEUWNJYZVMVVGP-KRWDZBQOSA-N 471.524 1.929 10 20 JDCD CN(C)c1ccc(CNC(=O)CN2C(=O)N[C@@]3(CCS(=O)(=O)c4ccc(F)cc43)C2=O)cc1 749012827 ZLFPWDCIIDMGCT-JOCHJYFZSA-N 474.514 1.133 10 20 JDCD COC(=O)[C@@H](F)/C(NCc1ccc(N(C)C)cc1)=C1/C(=O)NC(=S)N(CC(C)C)C1=O 814334995 DJZGEONIMIFGRN-UYTDBDHRSA-N 450.536 1.507 10 20 JDCD Cn1cc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@@H]2CCCO2)CCCC3)cc1C(N)=O 914564610 UPQMVESGNKBPTN-LBPRGKRZSA-N 466.585 1.774 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 917707587 PGYOHYVDVJIOMT-UHFFFAOYSA-N 463.531 1.613 10 20 JDCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 918310655 NHZLNQSIYLGORZ-UHFFFAOYSA-N 493.608 1.818 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CCCS(=O)(=O)N3CCCC3)cc2F)C[C@@H](C)O1 919554132 CNFHYZIUDUEFFT-HDICACEKSA-N 499.605 1.805 10 20 JDCD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 920636873 OPVNTHSUPSCLQD-VIFPVBQESA-N 489.428 1.481 10 20 JDCD COCCN1C(=O)/C(=C/Nc2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)C(=O)NC1=S 920979158 ZECFYWPXXCXNEN-WYMLVPIESA-N 487.003 1.700 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)c3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)CC2)cc1 1318019914 RMEBPBDUXMRMMT-OAQYLSRUSA-N 465.598 1.949 10 20 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C[C@H](C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)N1C[C@H]2C[C@@H]2C1 1814189336 OOOQIGOXWARYSA-RWBBEJTFSA-N 487.651 1.288 10 20 JDCD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)no1 1814189608 UBGMPEXIBCWWBT-LIRRHRJNSA-N 473.580 1.812 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2cnn3ccncc23)CC1 1828286516 XZVCGGJCGTWBJY-QGZVFWFLSA-N 486.623 1.823 10 20 JDCD CN(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCN2C(=O)OCc1ccccc1 1829037394 GWDIZROXDKEUCK-VWLOTQADSA-N 497.552 1.120 10 20 JDCD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)s1 1832891538 NIZFPYICZNSQTR-NRFANRHFSA-N 497.664 1.306 10 20 JDCD CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)N(CC)CC 1833539819 GNKCSJBJZISFJX-IBGZPJMESA-N 497.731 1.539 10 20 JDCD CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cn1 1833957959 WUCAGZAAGNBROJ-UHFFFAOYSA-N 470.574 1.943 10 20 JDCD Cc1cc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)no1 1834987622 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Cc1cc(C)n(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n1 1815930464 BYQGMTYSUHLOBA-OAHLLOKOSA-N 475.600 1.776 10 20 JDCD CCN(C)[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821628691 AUARXXGWOSRWNN-OCCSQVGLSA-N 452.606 1.602 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2 1828244811 RNCZMKNAXHEJOK-SNVBAGLBSA-N 487.592 1.272 10 20 JDCD C[C@]1(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)CC1(F)F 1828249004 CJZVTAONGVCPBB-ZKANADHPSA-N 460.553 1.961 10 20 JDCD COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1834498424 XWDIAGHXNAQAHB-UHFFFAOYSA-N 468.554 1.929 10 20 JDCD O=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)c1ccccc1 1834707807 RRDQJQBTVSBNNF-HSZRJFAPSA-N 474.897 1.704 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cnc(C(F)(F)F)cn3)CC2)CC1)c1cc(O)nc(O)c1 1834987057 ULQPAIDHYYUKKS-UHFFFAOYSA-N 494.474 1.801 10 20 JDCD CC(C)(O)CC(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837772008 ZSUVAXXOWKCROM-UHFFFAOYSA-N 470.570 1.939 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1)CCO2 1838972571 JJEIPHZJAIPNKO-LHLOKTHNSA-N 470.478 1.292 10 20 JDCD Cc1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)s1 1839433973 GRLRUJQSSCAGIN-HXUWFJFHSA-N 467.931 1.900 10 20 JDCD Cc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1 1839948936 LHRDADYVOCFCLF-GAJHUEQPSA-N 491.635 1.415 10 20 JDCD O=C(Cc1cccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839981885 ZCSGNSYUEBPAKI-JOCHJYFZSA-N 463.437 1.084 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)c2nc[nH]n2)C1 1843189603 ZQTLWRHKKMLXJA-HNNXBMFYSA-N 486.529 1.169 10 20 JDCD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501417 NDLIPUCBGOBJTO-UHFFFAOYSA-N 494.895 1.766 10 20 JDCD O=C(c1csc(Br)n1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054208 IEILKQOENGINPS-UHFFFAOYSA-N 475.415 1.583 10 20 JDCD O=C(C[C@H]1OCCc2ccccc21)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056876 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C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1)n1ccnc1 1823496881 QMCNLYSHGCVKGY-TZMCWYRMSA-N 461.573 1.720 10 20 JDCD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1)n1cnnn1 1827717418 GGLRUYGCMCSKGH-DYESRHJHSA-N 478.557 1.647 10 20 JDCD Cc1nn(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)c1F 1832896739 OHIZIHZDIYIVRH-HNNXBMFYSA-N 481.619 1.961 10 20 JDCD Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)cn1 1834191593 VZOYMYGOUOMEOI-UHFFFAOYSA-N 477.569 1.398 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CS[C@H]3CCCCO3)CC2)CC1)c1cc(O)nc(O)c1 1834987047 BSWQJBJDAVPBHV-QFIPXVFZSA-N 478.615 1.938 10 20 JDCD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)nc1 1834988148 PRKKNYAPRDTKDL-UHFFFAOYSA-N 468.558 1.453 10 20 JDCD Cn1ccc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)c21 1836418446 UTPHUKREBUJYSE-XMMPIXPASA-N 466.494 1.368 10 20 JDCD CN(C)c1c(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1F 1836419185 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COc1ccc([C@H]2C[C@H]2C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847056422 FRSRKSWJIYHNCJ-IAGOWNOFSA-N 459.593 1.862 10 20 JDCD O=C(C[C@H]1COc2ccccc2O1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056775 NBEHXBBMTALNAN-AWEZNQCLSA-N 461.565 1.280 10 20 JDCD CN(CC(=O)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1)Cc1ccc(N2CCOCC2)cc1 15571865 WXJBAUVKJQMZCO-FGZHOGPDSA-N 465.616 1.150 10 20 JDCD Cc1cc(C(=O)COC(=O)[C@H]2CCCN(C(N)=O)C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 16681363 ZPTDYZDHWQSSDU-HNNXBMFYSA-N 462.528 1.258 10 20 JDCD O=c1[nH]c2ccc(S(=O)(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2[nH]c1=O 726600940 LJCWUIXWFGSPPE-UHFFFAOYSA-N 466.466 1.765 10 20 JDCD Cn1cc(C(=O)NCC2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)cn1 726707428 ZSHUFAMCFDXUIW-FQEVSTJZSA-N 481.601 1.473 10 20 JDCD CNS(=O)(=O)c1cc(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)ccc1C 743288414 YLNXNXLJDPEBBV-UHFFFAOYSA-N 461.588 1.855 10 20 JDCD CN1CCCc2cc(CNC(=O)C(=O)Nc3ccc(N4CCNC(=O)C4)c(Cl)c3)ccc21 747017686 UQWLGYJCXYMUFP-UHFFFAOYSA-N 455.946 1.914 10 20 JDCD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(OCC(=O)O)cc3)CC2)cc1 914871685 GKOUPZVKGQQNNL-UHFFFAOYSA-N 463.556 1.649 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)CC2)cc1 914994731 ZFGVGVISLXIUCW-UHFFFAOYSA-N 477.539 1.578 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](NS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 917103782 PLUFJARZKPSAAP-JFIYKMOQSA-N 456.584 1.069 10 20 JDCD O=C(NCc1nnc2n1CCCC2)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 917297570 QNRQHROGOAZNHA-UHFFFAOYSA-N 472.483 1.959 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc4nc(O)nc(O)c4c3)cc2)C1 917929282 BXLSTWDTIVFTRR-CQSZACIVSA-N 457.512 1.221 10 20 JDCD CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918284871 SHZIZXDWCYYBCI-UHFFFAOYSA-N 492.573 1.994 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 918284903 UJWVSWNKBMLLIU-UHFFFAOYSA-N 470.501 1.390 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(-n4cncn4)nc3)cc2F)C[C@@H](C)O1 919052196 RIUSDOIHYZTZNZ-HZPDHXFCSA-N 468.489 1.888 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1 1777738318 OAEMAQMHOCHYLH-JARBLVMWSA-N 476.489 1.904 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)COC4)C2)C1 1777917191 LGPRWRDMRIEDQF-NRFANRHFSA-N 461.565 1.021 10 20 JDCD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)n(C)n1 1779627912 SRTNHYDVDCRQLR-BVBLWJPBSA-N 456.499 1.256 10 20 JDCD CN1CCCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1781026408 HOIRHKFHGXTILT-GBXCKJPGSA-N 453.543 1.094 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2 1782000838 CFBGNHPRBCWVGK-CYFREDJKSA-N 471.941 1.909 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cc(F)c[nH]1 1782050113 NKSWEVCKGOVGJZ-AUUYWEPGSA-N 454.549 1.142 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1782371041 SILQCQNORGOIFR-COIATFDQSA-N 482.468 1.747 10 20 JDCD CO[C@@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)CCO2 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Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c(C(F)F)n1 1834987300 YVOBTYKELWVJRV-UHFFFAOYSA-N 478.500 1.663 10 20 JDCD COc1cscc1C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1835233627 XUYOSPLCLZCVIX-UHFFFAOYSA-N 496.680 1.802 10 20 JDCD O=C(c1cc2sccn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417450 SHSHPTRXGGEWEP-OAQYLSRUSA-N 458.496 1.191 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1 1837366800 HVOUFLWQOXKVIZ-UHFFFAOYSA-N 492.536 1.587 10 20 JDCD O=C(CCCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1837620518 FLGXPRDWTOTMNJ-QHCPKHFHSA-N 458.515 1.235 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cc1)CCO2 1838954977 KPFFHWVFHXTOQH-RUZDIDTESA-N 480.496 1.689 10 20 JDCD Cc1ncc(CC(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)s1 1840399715 ZCQJWPJAKRBJQQ-XMMPIXPASA-N 497.577 1.243 10 20 JDCD COc1nc(C)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880614 APPXRYNZNWSFIK-AAHGLTIQSA-N 499.520 1.299 10 20 JDCD O=C(CCc1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840896976 FRHLFHWAKFYIPF-JOCHJYFZSA-N 495.598 1.075 10 20 JDCD C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2)c1ccccc1 1840897040 IQYNRZNZZDDMSF-GAJHUEQPSA-N 491.635 1.497 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CNC(=O)C1)C2 1843331452 ZDYDWXJLUXWNTH-PKOBYXMFSA-N 485.585 1.044 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc3nc(CO)[nH]c3c2)C1 1843670008 ILAWBZNSEBNYRA-UHFFFAOYSA-N 472.505 1.665 10 20 JDCD Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)C3=NN(c5ccccc5)C(=O)C3)C4)ccc21 1843733877 JJALBDXPFQEHLH-UHFFFAOYSA-N 486.532 1.487 10 20 JDCD O=C1NCc2cc(C(=O)N3CCCC34CN(C(=O)C3=NN(c5ccccc5)C(=O)C3)C4)ccc21 1844133043 YZUYXGMTTRNENC-UHFFFAOYSA-N 457.490 1.540 10 20 JDCD CC(C)[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1847631003 IIVGDQYNLALMSZ-RYLXDESZSA-N 491.585 1.752 10 20 JDCD CC[C@@]1(C)NC(=O)N(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1=O 9945361 RHZFIXXANSHYCH-JOCHJYFZSA-N 490.538 1.188 10 20 JDCD CCOC(=O)[C@@H]1CCCN1S(=O)(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 725827134 NGTCZZJUICXILD-FQEVSTJZSA-N 492.577 1.304 10 20 JDCD CS(=O)(=O)CCOc1cccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 726288346 YALHSHHAOGCUIS-FQEVSTJZSA-N 476.551 1.962 10 20 JDCD C[C@H](NC(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1)c1ccc(N2CCOCC2)cc1 726293583 NBHYRHZYPANBBD-KRWDZBQOSA-N 475.567 1.763 10 20 JDCD O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCCN1C(=O)CNC1=O 731009525 KTPNXPRWAVSYIX-RAXLEYEMSA-N 452.583 1.788 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)N3CCN(C(=O)c4ccccc4O)CC3)CC2)cc1 742940737 WSKXOCRPKMEPFL-UHFFFAOYSA-N 467.570 1.690 10 20 JDCD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 756270323 XYOWHCWZFCPIRI-LJQANCHMSA-N 468.558 1.098 10 20 JDCD C[C@H]1CCCCN1C(=O)CN1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 916981355 OKFSITZPRTUAMI-FQEVSTJZSA-N 475.609 1.297 10 20 JDCD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)COC(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)C1 920638160 OTAIVQSUVIQDQV-OAHLLOKOSA-N 481.571 1.418 10 20 JDCD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777851806 SEXYRKSGTSYCDA-OBWXTZQISA-N 492.573 1.924 10 20 JDCD O=C(Cc1ccc2c(c1)CCCO2)N1CC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1778271136 KMFBJNZLWZGGKO-QHCPKHFHSA-N 489.619 1.244 10 20 JDCD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN2C(=O)CSC2=S)C3)on1 1780205391 AHUWVKINGWGEND-IIBYNOLFSA-N 480.612 1.786 10 20 JDCD CCOc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1780549495 MICNZECQTNQSLS-NRFANRHFSA-N 463.581 1.389 10 20 JDCD CN1CCCn2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cc(O)c(O)c(Cl)c5)C4)C3)cc2C1 1782009706 ZNKJVVAUVSUKQD-HSZRJFAPSA-N 489.960 1.541 10 20 JDCD CC(C)(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)[nH]n1 1783247941 JNSMKNGDOIXNIS-OPAMFIHVSA-N 493.655 1.695 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1783409940 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CFNZMZVSGKRGRK-CYBMUJFWSA-N 461.573 1.618 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccnnc2O)CC1 1829540784 LSUBGSRHNVMJAF-OAHLLOKOSA-N 463.585 1.276 10 20 JDCD O=C(CCC1CCC1)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1831069438 INHQKNDXGLLHJF-RUZDIDTESA-N 468.554 1.816 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835134634 OWMKPVUNZQUBDA-UHFFFAOYSA-N 489.580 1.384 10 20 JDCD CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)nn1 1838030298 KWUOSBILPDULML-UHFFFAOYSA-N 471.514 1.608 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998347 UYJDXDUAEGWDEZ-RUZDIDTESA-N 498.486 1.828 10 20 JDCD CCCCC[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897047 JAQQBZRUSGXTQL-IERDGZPVSA-N 471.645 1.520 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2c[nH]c3nccc-3c2Cl)C1 1843287023 UNTJVPJMTVLQAW-UHFFFAOYSA-N 463.972 1.845 10 20 JDCD O=C([C@@H]1Cc2ccccc2CN1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 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CC(C)(C)n1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)nn1 1780358114 SCBQDGAHRYVTIK-OAQYLSRUSA-N 463.922 1.855 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]2C1 1784917571 UMALVNBDESOETH-FWDPORAESA-N 498.813 1.700 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)CCc1ccc(F)nc1)CCO2 1785508380 COPLZIAVHYKZCS-LHLOKTHNSA-N 471.485 1.813 10 20 JDCD Cc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1F 1785508679 JDKUULWHHZXDNK-UKKYDJSUSA-N 460.462 1.141 10 20 JDCD COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1789013876 SKWODPZDGUZRQG-XJABCFGWSA-N 491.548 1.785 10 20 JDCD O=C(/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)NCc1ccccc1 1792941653 ZXCFTOHSRWLYML-MMXJWNFTSA-N 499.951 1.827 10 20 JDCD Cc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1793115114 CQJJRAZLKJGUIM-QUKZKKHZSA-N 453.495 1.352 10 20 JDCD COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1794530997 PLOAIDHHSRFCMX-SYSDTLGTSA-N 455.467 1.124 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cn2ncccc2n1 1796934563 MXNVNJVNEJLUSY-VBUUOAMHSA-N 457.494 1.774 10 20 JDCD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)n(C(F)F)n1 1799405561 FDDXOWIYSJJXIK-ZSBIGDGJSA-N 457.528 1.699 10 20 JDCD COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cn1 1799768532 XQOMOLJAMKLWNR-ZSBFGKGUSA-N 475.885 1.450 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nonc3c1)C2)c1cc(O)c(O)c(Cl)c1 1799768549 ZIFZLEUYEPSICI-IVWMJMPLSA-N 458.858 1.804 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2 1802080196 NKHLNXSRDOBFSE-RJSSMCAOSA-N 494.426 1.529 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccccc3o1)C2 1802103858 FJCHNEWIFPPHSA-HBCWATKFSA-N 459.549 1.496 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1 1803663900 KTOMAQWEPHCXHX-XPHJMQOMSA-N 462.572 1.840 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992576 CXGOOORZAXUSNB-BTYIYWSLSA-N 477.477 1.687 10 20 JDCD Cc1c[nH]cc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1808589539 PBSQTYCZMNIYOH-KXBFYZLASA-N 457.581 1.898 10 20 JDCD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813630307 QNXACVKVCIJXFG-LDBYXDLTSA-N 476.624 1.764 10 20 JDCD NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)cc1 1813740453 COSFUVLJMDIFIH-FXAWDEMLSA-N 497.602 1.360 10 20 JDCD Cc1cnoc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189353 GCMXECWJIRFQEW-WMLDXEAASA-N 459.553 1.558 10 20 JDCD O=C1COc2ccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cc(O)nc(O)c5)sc4C3)cc2N1 1816724953 FDFUUAGXUMRWBN-GFCCVEGCSA-N 481.490 1.820 10 20 JDCD COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)C4=NN(c5ccccc5)C(=O)C4)sc3C2)cn1 1817362448 PVZZWDFTRPCTJL-ZDUSSCGKSA-N 491.533 1.960 10 20 JDCD CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817363057 FRYSGWMQTJJAKM-AWEZNQCLSA-N 482.566 1.763 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)[nH]n1)c1cc(O)nc(O)c1 1817845983 FNMAZVPHLCDOAD-ZDUSSCGKSA-N 481.494 1.905 10 20 JDCD CC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1821971262 QGTRSBXDKHYVCL-LIRRHRJNSA-N 465.514 1.719 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cncn2)[nH]n1 1823475368 RJJXBLZZOYATLF-KEDPEKRHSA-N 453.459 1.524 10 20 JDCD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823500028 KPLZTMHLOCBRIR-GXTWGEPZSA-N 480.616 1.567 10 20 JDCD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2)n1ccnn1 1824695846 VMISCSDVODFWPG-LXDSGBGESA-N 470.511 1.738 10 20 JDCD CN1N=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CCC1=O 1824928959 XARYJCFXBVDTOZ-MRXNPFEDSA-N 479.628 1.075 10 20 JDCD CN(C)C(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715229 JPKFYGMNXIVFBM-FQEVSTJZSA-N 453.543 1.487 10 20 JDCD Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1830157464 WMKFVMMGMBGJPH-AREMUKBSSA-N 494.523 1.997 10 20 JDCD O=C(CCOc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830254184 FMYLXVNLVMMNAT-HSZRJFAPSA-N 475.473 1.171 10 20 JDCD CC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896989 YBYHIVGOZFVAIQ-SJORKVTESA-N 468.645 1.381 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2 1840580520 GTYPDCCKKZFHLH-YEUXVMMMSA-N 464.540 1.169 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3C3CC3)C2)C1 1840880381 MFMQSWQTLQVKNS-WUQPGSQJSA-N 485.493 1.452 10 20 JDCD Cc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)c(C)c1 1840897550 JFQFDGZUPNPABN-HSZRJFAPSA-N 491.635 1.542 10 20 JDCD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)O2)C1 1841079916 IYEYGFGRRALJEP-MRXNPFEDSA-N 488.541 1.478 10 20 JDCD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 15445138 LFVVJAZIUIGYKE-UHFFFAOYSA-N 488.610 1.552 10 20 JDCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)OC)sc2C(=O)OC)cc1 726520860 QQDGRIGIKHESSS-UHFFFAOYSA-N 462.527 1.884 10 20 JDCD COc1ccc(N2CCN(C(=O)C3CCN(S(=O)(=O)c4ccc(C(=O)O)o4)CC3)CC2)cc1 915133927 YAEZIHPNLGJHAG-UHFFFAOYSA-N 477.539 1.736 10 20 JDCD COCCS(=O)(=O)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 915553825 JXWXIIMFKVJAKM-UHFFFAOYSA-N 451.497 1.652 10 20 JDCD O=C(CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 916632471 VOZALDJJOPVSBH-OAHLLOKOSA-N 492.520 1.035 10 20 JDCD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)N(C)Cc2ccccc2O)c1OC 917310316 RBFXOPZFCNJXKT-UHFFFAOYSA-N 450.513 1.703 10 20 JDCD CCN(CC)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 918220021 GMKPKNHEYZDJDN-QZTJIDSGSA-N 485.626 1.853 10 20 JDCD CN(C)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918441347 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Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c(O)n1 1838029905 OUGIDPQLBWLGAG-UHFFFAOYSA-N 456.499 1.828 10 20 JDCD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1839433634 MPXOTWRZYQBKAP-JPXDGAFASA-N 479.961 1.161 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586372 BGSQEFILWFKVGQ-HSZRJFAPSA-N 453.451 1.623 10 20 JDCD CCN(CC)C[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1839677755 QLXOCCRVKYNKQL-FQRUVTKNSA-N 499.612 1.214 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(Cl)cc3)CC1)CCO2 1839786823 LXLRRSUVVAAVFG-QHCPKHFHSA-N 487.940 1.948 10 20 JDCD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1840298496 WGFJWBIJUUEIJO-MZNJEOGPSA-N 455.511 1.442 10 20 JDCD COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)CC1 1841754210 CVRVIRIYHXUDST-HDJSIYSDSA-N 453.586 1.030 10 20 JDCD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502062 JZXKWFWATCHIJQ-UHFFFAOYSA-N 462.846 1.338 10 20 JDCD O=C([C@H]1COc2ccccc2O1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033830 IIGCUYQHBIPIJM-QRBZPYHOSA-N 452.463 1.860 10 20 JDCD COc1ccnc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)c1OC 1847038531 VBMVYXXTTJIKOC-FNORWQNLSA-N 455.467 1.746 10 20 JDCD CCNc1nc(NCC)n2c(SCC(=O)N3CCC[C@H]3CN3C[C@H](C)O[C@H](C)C3)nnc2n1 109466466 FASRGPYDBHHSKB-XHSDSOJGSA-N 477.639 1.575 10 20 JDCD NS(=O)(=O)c1ccc(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726601349 QBARMHYGVABXGH-UHFFFAOYSA-N 461.512 1.883 10 20 JDCD COc1ncnc(OC)c1C(=O)OCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 729868592 LXJSXKOZTWUAQP-OKILXGFUSA-N 462.478 1.720 10 20 JDCD CC1CCN(c2ccc(CNC(=O)N3CCN(C(=O)CN4C(=O)CCC4=O)CC3)cc2)CC1 731120928 ILSDQCUBBJYMPF-UHFFFAOYSA-N 455.559 1.426 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)C3=NN([C@H]4CCS(=O)(=O)C4)C(=O)CC3)cc2F)C[C@@H](C)O1 917711012 PDDACFIQLIDNMS-UXLLHSPISA-N 480.562 1.221 10 20 JDCD COCCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918370836 BTIIRBIBDDCLKG-LJQANCHMSA-N 474.583 1.243 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)cc2)C1 918463040 HDRUHAIQAAUXSU-LJQANCHMSA-N 461.526 1.283 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(N4CCCS4(=O)=O)cc3)cc2)C1 918463913 OUNZKJJIDBNDIJ-SFHVURJKSA-N 499.593 1.183 10 20 JDCD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)c1cc(NS(C)(=O)=O)ccc1O 919809221 IFGNYZZUJXUWQN-UHFFFAOYSA-N 455.558 1.522 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cnc(Cl)s1 1779839966 WWQJOOHBEGAPJI-KZULUSFZSA-N 489.044 1.784 10 20 JDCD CC(C)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)n[nH]1 1780295577 QTSMWMLKKFTIQT-DEOSSOPVSA-N 464.526 1.770 10 20 JDCD O=C(CSc1ncccn1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782002973 YITQQFHPVCRCAL-HXUWFJFHSA-N 464.931 1.777 10 20 JDCD Cn1nc2c(c1C(=O)N1CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C1)CCC2 1782437285 KTQGJGXWTVRMQI-RUZDIDTESA-N 476.537 1.145 10 20 JDCD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1783250689 CAXRKWPZXLGTFU-DXEZIKHYSA-N 451.614 1.503 10 20 JDCD CC(C)n1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1785506103 ZIZSWDLVAQFUOQ-LHXJMTLCSA-N 457.487 1.133 10 20 JDCD C[C@@](O)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1)C(F)(F)F 1787537488 XINXBHZTGNFRPG-GVKMRPKGSA-N 482.459 1.072 10 20 JDCD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787541522 SLYFAIUYUOZFBA-QRFRQXIXSA-N 499.568 1.284 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1ccc2c(c1)CNC2=O 1788446271 MNIHHWZTWOCGKI-XOIXWDMESA-N 493.516 1.354 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21 1792239233 ZTIJTULDSKFCNE-ZQIUZPCESA-N 473.580 1.017 10 20 JDCD Cc1cc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN2C(=O)CSC2=S)C3)c(C)c1 1793244026 VUWZUGRCULYNSM-UPHUGPLXSA-N 491.635 1.441 10 20 JDCD CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccc1 1795170877 QYBNIXAXWIIUHZ-FBSVTDBBSA-N 468.506 1.794 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)C1 1796138057 UQXJHTSHTRICCB-KWCZIXHQSA-N 490.557 1.343 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1Cc1ccccc1)C2)c1cc(O)nc(O)c1 1796139828 RVHHNTOYHWBQFK-XARGGIHNSA-N 480.565 1.751 10 20 JDCD CC(C)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1)C(C)C 1796481417 XLONQBNIZXCOQM-AAUAJYIVSA-N 469.586 1.392 10 20 JDCD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796482776 YOODPUWFBGPCGD-LBQWBERBSA-N 494.548 1.124 10 20 JDCD Cn1nc2c(c1C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cc(O)c(O)c(Cl)c1)CCC2 1799767971 GVEQVDYYLSHLCZ-IVWMJMPLSA-N 460.918 1.490 10 20 JDCD CN(C)c1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN2C(=O)CSC2=S)cc1 1802106558 AXDKFZHLTMCSNA-FAQVEIGNSA-N 490.651 1.135 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc(N2CCCC2)ccn1 1804333825 UKFODNATTIVUDK-ACHSLPGTSA-N 473.624 1.794 10 20 JDCD CN(C)c1cncc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1 1804853510 BKGFVHFPJDUPMZ-IIBYNOLFSA-N 498.634 1.723 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cnsn1 1805003687 YPKAOJYMKFWOHN-BLLLJJGKSA-N 462.582 1.113 10 20 JDCD O=C(CCN1CCCCC1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806650192 JWNRZVPTMXQVMB-GCJKJVERSA-N 489.667 1.824 10 20 JDCD CN(C)C(=O)C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1806949430 ARNHIVXECXBFFD-IESGORFISA-N 454.483 1.006 10 20 JDCD C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1810528711 ARUQGLQBJVTZNM-YJLYGGOZSA-N 488.548 1.571 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1 1818441031 RYJXZPCECYTVII-SNVBAGLBSA-N 487.592 1.272 10 20 JDCD C[C@]1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)CCCN1 1822778048 RTGGHCGOYBKLJN-MLCYQJTMSA-N 453.615 1.058 10 20 JDCD Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)c(=O)[nH]c1C 1825449671 ZFEJQNSDLLTCID-MRXNPFEDSA-N 491.639 1.480 10 20 JDCD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1O)CC2)n1cncn1 1826801655 NCAUWFBUHSYTML-TWICZNDLSA-N 470.511 1.738 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1 1827588062 RAMRPVTZUPULMZ-FQEVSTJZSA-N 492.536 1.914 10 20 JDCD CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)nn1 1828247215 PTKCHEGQVUTJDE-JTQLQIEISA-N 492.608 1.418 10 20 JDCD Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1830157467 WMKFVMMGMBGJPH-SANMLTNESA-N 494.523 1.997 10 20 JDCD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)N1CCN(C)CC1 1830238183 MJANAFNBPZZULV-XLIONFOSSA-N 459.591 1.362 10 20 JDCD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1832228607 ZKNPUZCXQHMSRD-WMZOPIPTSA-N 477.656 1.999 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835134203 AYXLCVBMCYSKFB-UHFFFAOYSA-N 491.596 1.707 10 20 JDCD O=C(/C=C/c1cccs1)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1835969393 GOWNOWUPEINZKX-YADGQWAMSA-N 481.621 1.078 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1 1836418944 ISKRTFPREPAHSG-QFIPXVFZSA-N 454.439 1.018 10 20 JDCD CCC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CCC1 1836741693 QTPGQKOOBDTTDS-SXBBHYFQSA-N 460.527 1.853 10 20 JDCD Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)o1 1838009233 LVKYAXIZFLRINM-DOHLAZSCSA-N 473.482 1.192 10 20 JDCD C[C@H](Cn1cncn1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838029722 GDPHYRDDHHFWHB-OAHLLOKOSA-N 458.519 1.033 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3cnn4ncccc34)CC2)CC1 1838031501 JAFATQPKVKOAPU-UHFFFAOYSA-N 466.498 1.462 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839287830 AQYBJDIOHVVDOH-NRFANRHFSA-N 467.400 1.294 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c(C4CC4)c3F)C2)C1 1839431672 HJZFSDLLNPQULQ-QFIPXVFZSA-N 494.907 1.875 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839522411 CYZDPGGIGFPECF-FQEVSTJZSA-N 494.620 1.160 10 20 JDCD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)ccc1F 1840682069 QXAVSCXAKGTKEM-QFIPXVFZSA-N 461.446 1.024 10 20 JDCD C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)CC1(F)F 1840825833 ROTVWGGKRLQCDO-YADHBBJMSA-N 476.480 1.281 10 20 JDCD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c(O)c1 1840881549 GUGWHJCEOOYXLT-OGPASDKVSA-N 484.505 1.601 10 20 JDCD CCN1CCC(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CC1 1840881882 TZODBISDJSVSCW-SKFGKQHZSA-N 489.569 1.005 10 20 JDCD Cn1ccnc1C(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1842511784 WJORBIAWGUTYJU-LJQANCHMSA-N 482.585 1.955 10 20 JDCD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442304 KUODVYSTQMLVQE-MRXNPFEDSA-N 469.542 1.896 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1 1844197147 JNEVWGGIJCQPFT-DEOSSOPVSA-N 473.489 1.717 10 20 JDCD CC[C@H](NC)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251495 CLYHLWHONVBEJR-ZWKOTPCHSA-N 490.601 1.735 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)CCNS(=O)(=O)c3cccc(Cl)c3)CC2)cc1 742948009 KWLSOYQESNFUET-UHFFFAOYSA-N 481.018 1.955 10 20 JDCD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)C[C@@H](C)O1 916624532 DULGHHKHQPLMCG-KDURUIRLSA-N 497.687 1.421 10 20 JDCD CN1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918462510 BOQDJOPFCUPULF-FQEVSTJZSA-N 478.597 1.395 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(Cn4cncn4)cc3)cc2)C1 918463039 HDRUHAIQAAUXSU-IBGZPJMESA-N 461.526 1.283 10 20 JDCD CON(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1 919840584 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O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)c1cccc(F)c1 1836263153 PBOKIPPZNIGGRM-UHFFFAOYSA-N 478.615 1.871 10 20 JDCD O=C(c1ccc2cc[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836418184 FMPVOHUOUYAMJK-QHCPKHFHSA-N 452.467 1.358 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4sccc4c3O)C2)C1 1836419174 WUJPGOQXKFEFIF-QHCPKHFHSA-N 485.518 1.797 10 20 JDCD CN(C)c1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1836419694 UOBUTABONGMBTG-RUZDIDTESA-N 484.553 1.262 10 20 JDCD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)C(C)(C)C 1839432600 RMPPMIQXEHFXEZ-CVDCTZTESA-N 497.976 1.372 10 20 JDCD CC(C)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)C(C)C 1839434338 ZOSKXMISCJUWDQ-XXBNENTESA-N 483.993 1.844 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517973 BXNRMIPPVNYHHW-JOCHJYFZSA-N 492.916 1.114 10 20 JDCD O=C(c1ccc(I)c(O)c1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251217 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O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)c1ccc(O)nn1 1805263941 BJLVMONWVQIWPR-UZUQRXQVSA-N 485.504 1.690 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CCCn2ccnc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807998559 LFHKGOOECNVEHF-HTAPYJJXSA-N 450.499 1.884 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@@H]1ON=C(c2ccccc2)O1 1810170073 LFDUIQJIORMSOI-ADSMNUKGSA-N 489.488 1.942 10 20 JDCD NC(=O)c1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811189308 USMRBIXFKUOIGG-BFUOFWGJSA-N 496.911 1.669 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1 1814184536 ALWHEZOFRAOYHI-FZKQIMNGSA-N 489.535 1.763 10 20 JDCD CCN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)CC1 1814242882 SKVMIBRZJNIUFU-XMSQKQJNSA-N 453.543 1.939 10 20 JDCD O=C(Cc1ncccn1)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817364626 WJITWTXFTUQQKK-CQSZACIVSA-N 475.534 1.881 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1[nH]nc2ccncc12 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Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)cc1C 1832397964 TZFOJMGKTFCAND-XMMPIXPASA-N 455.511 1.422 10 20 JDCD N=C1NCCN1CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877513 OZYAKHSMAARSDQ-SUQGKYDKSA-N 471.558 1.276 10 20 JDCD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cn1 1832908396 JBXIUIGYMCXNMA-MDRWGITRSA-N 497.548 1.609 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccsc1)CCO2 1833963309 KYOCZFDPCUTYMZ-QHCPKHFHSA-N 468.535 1.611 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)c1cnccc1Cl 1835861031 FFGJDCZZNCRINU-UHFFFAOYSA-N 496.058 1.781 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1nc(-c3ccccc3)ns1)CCO2 1836248275 LJYYDQLTMWEYAL-QHCPKHFHSA-N 497.533 1.395 10 20 JDCD O=C(COc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1836526192 NBODROARQGCFSE-SANMLTNESA-N 492.532 1.315 10 20 JDCD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)nn1C 1838504223 LXDKBKAHGBNJKT-UHFFFAOYSA-N 493.655 1.455 10 20 JDCD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)n1cccn1 1838809851 DLUATGRNHUBFMT-OAHLLOKOSA-N 479.628 1.303 10 20 JDCD Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)o1 1840880948 VHIWBIZUXYPYGW-DOHLAZSCSA-N 473.482 1.192 10 20 JDCD Cc1ccc(C(=O)C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1 1840881068 BGALFZZEZRENCC-QGVYAHRCSA-N 496.516 1.464 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1840896148 ISASXQCVBYPFJZ-HXUWFJFHSA-N 495.604 1.425 10 20 JDCD Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)cc1 1843443251 STAWBSQJIJVRMQ-UHFFFAOYSA-N 473.533 1.721 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cc(N3CCCC3)ccn2)C1 1843508027 PYRPVROJKDLZQG-UHFFFAOYSA-N 459.597 1.359 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1 1844739893 ISGFFPOYPYNEIW-UHFFFAOYSA-N 485.884 1.874 10 20 JDCD Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)c3cc(O)c(O)c(Cl)c3)C2)c2ccccc21 1845501412 MSOLROSKLKGZJF-UHFFFAOYSA-N 470.913 1.922 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2n[nH]c3c(Cl)cccc23)C1 1845592639 WLBOPGJLNRBZMH-UHFFFAOYSA-N 463.972 1.894 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)Cc2cc[nH]n2)C1 1845827131 JVIJJIOKEPRNFT-SFHVURJKSA-N 499.568 1.703 10 20 JDCD CN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cc(O)nc(O)c3)cc2)CC1 1847242135 OLUREGVPUMQHTA-PMACEKPBSA-N 451.527 1.374 10 20 JDCD C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)n1cnc2c1c(=O)n(C)c(=O)n2C 24906720 BFNWTBBESJWTDH-GFCCVEGCSA-N 457.446 1.409 10 20 JDCD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)CC2)cc1 746989865 IDXJVJXKXNLFAF-UHFFFAOYSA-N 481.553 1.842 10 20 JDCD Cc1cc(C(=O)COC(=O)C2=COCCO2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 766867370 GGWHEIXIVIPVAK-UHFFFAOYSA-N 490.534 1.729 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(C)c(NS(C)(=O)=O)c3)CC2)cc1 907582492 GPSURMBKJWBKIZ-UHFFFAOYSA-N 461.540 1.881 10 20 JDCD CN(C)C(=O)CN1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 914439743 MTQNWMJEJSUFJF-DTQAZKPQSA-N 466.654 1.962 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)C(=O)N(C)C4=O)cc2F)C[C@@H](C)O1 918286631 JDSPTSIOJUTXDO-ZIAGYGMSSA-N 468.485 1.920 10 20 JDCD O=C(COC(=O)CCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 918790712 DHUYMWPVDQHGHA-UHFFFAOYSA-N 469.469 1.508 10 20 JDCD Cc1ccc(NC(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1S(=O)(=O)N(C)C 920638425 ZIGJVJUXILKXRN-UHFFFAOYSA-N 485.540 1.118 10 20 JDCD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 920739575 MVUUOXREYLGUSF-KGENOOAVSA-N 470.530 1.670 10 20 JDCD COc1ccc(N2CCC(NC(=O)N3CCC(C(=O)N4CCC(C(N)=O)CC4)CC3)CC2)cc1 1318345662 HVPLFRSQZGNPGS-UHFFFAOYSA-N 471.602 1.810 10 20 JDCD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777851659 OAEYMRPJODTTGM-MZNJEOGPSA-N 492.573 1.925 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1noc2c1CCCC2 1777865542 YAVSRXSNAURNFA-UZUQRXQVSA-N 456.499 1.801 10 20 JDCD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)n(C)n1 1779623137 UXEUWLBMAWLGPN-XMMPIXPASA-N 464.526 1.219 10 20 JDCD CCOc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783244323 RJUHEFMEMNOKHP-OPAMFIHVSA-N 492.623 1.468 10 20 JDCD CCc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)cn1 1783245364 UKFBJMGUXXWXGR-VGOFRKELSA-N 476.624 1.632 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccn3cn1)C2 1783247856 DDXMSKDODCIDSL-VGOFRKELSA-N 487.607 1.322 10 20 JDCD CCc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)s1 1783247903 HNRDMYAVXCWWDO-JLTOFOAXSA-N 482.653 1.693 10 20 JDCD CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cn1 1785509120 SJKPWHCULXHEOC-COIATFDQSA-N 470.526 1.912 10 20 JDCD CC(C)N[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)C(C)C 1785509559 WRNFSEFLPZMMIY-ANWYUNHFSA-N 461.559 1.669 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1785545495 YLOVDEXKTSYCBA-LJQANCHMSA-N 455.508 1.269 10 20 JDCD CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1786339460 AZFHTVGDWPRKCX-CYBMUJFWSA-N 498.652 1.309 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnccn3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787541499 RFPGBYNWIDVRCQ-UMPGPGGJSA-N 474.521 1.262 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787541666 YXBNUEUTIVATAS-ZRCAFCQKSA-N 463.494 1.173 10 20 JDCD Cc1cccc(F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792245474 WDYRQXYSESCTKB-DZKIICNBSA-N 465.572 1.588 10 20 JDCD C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796479114 GKXHAPIMVMNMPT-FLFXDLLNSA-N 490.564 1.374 10 20 JDCD CN(C)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1798883647 RDGHJFNMFXEMTA-NHKMSHSESA-N 475.549 1.749 10 20 JDCD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1F 1805145560 RRFKTHSQDUSJBG-KUHUBIRLSA-N 454.462 1.702 10 20 JDCD COc1ncc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)cc1F 1807568503 PWAZCBWICZRXHN-UHFFFAOYSA-N 480.587 1.934 10 20 JDCD CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808465758 YJYMIQCFRNROGH-ZCVJKFOLSA-N 490.564 1.795 10 20 JDCD CC(=O)NCC(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808469173 IYLHSCAAAQLDIZ-MBSDFSHPSA-N 462.510 1.016 10 20 JDCD O=C(Cc1ccccc1O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1812706028 CXUOIJJDRLUSAA-HTAPYJJXSA-N 484.603 1.896 10 20 JDCD Cc1nccn1CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814190352 XZNAEXWTNQISEF-OXJNMPFZSA-N 472.596 1.153 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2)c1cc(O)nc(O)c1 1816726747 YQNVVIWURCPCBD-NSHDSACASA-N 456.484 1.468 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1819422922 GPIILQLWCRHTCQ-OCCSQVGLSA-N 488.599 1.553 10 20 JDCD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1820996797 XTZGPYQDBXSTGU-OAHLLOKOSA-N 475.600 1.845 10 20 JDCD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1)n1cnnn1 1822860163 IJPTUNIRSOJRIA-XIACAKRESA-N 468.474 1.480 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2Cc3ccccc3CN2)[nH]n1 1823498745 VQOQUCACNVFCCA-MSOLQXFVSA-N 498.634 1.977 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)CCc2cncnc2)CC1 1827136644 ZBDYLPHTYANIMN-GOSISDBHSA-N 475.640 1.889 10 20 JDCD Cn1ncnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715692 XQIRGHOYWHPFMR-FQEVSTJZSA-N 463.542 1.841 10 20 JDCD O=C1C[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CCN1 1827717451 ICXZAEMMZFRHHI-UGKGYDQZSA-N 479.581 1.925 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1nnsc1C1CC1)CC2 1828244483 IVZHPMMFTRLRJS-SECBINFHSA-N 494.649 1.958 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2 1828244641 MTOUEHJGWQPWJP-JTQLQIEISA-N 487.592 1.272 10 20 JDCD 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O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cccn2ccnc12 1809896653 NWDGWUJMYMMEAI-OXJNMPFZSA-N 494.602 1.909 10 20 JDCD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810156425 HBJQCRGDJNZPJT-DAIWTFCYSA-N 451.527 1.548 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)OCO4)sc2C1 1817977966 OQUXNNNIVFDNPF-LLVKDONJSA-N 490.588 1.958 10 20 JDCD CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)n[nH]1 1823497630 GEJHHNQHCDSHPG-CQSZACIVSA-N 461.573 1.861 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)CC1 1828251269 MJYDVPQNFYDUME-INIZCTEOSA-N 486.623 1.823 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)c1nccs1)CCO2 1834434223 AIGYTTRFKRWFCU-QFIPXVFZSA-N 469.523 1.006 10 20 JDCD Nc1c(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)sc2nccnc12 1834779451 GONYWTZNZOMESK-UHFFFAOYSA-N 497.581 1.579 10 20 JDCD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)on1 1835134317 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O=C(Cn1cncn1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715333 LOJBSHZDKQERKY-OAQYLSRUSA-N 463.542 1.691 10 20 JDCD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1828878786 QFCRGEZIBXLGLJ-HOCLYGCPSA-N 483.660 1.174 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1)c1cc(O)nc(O)c1 1834986852 BMXXUTCYKATNAL-FQEVSTJZSA-N 465.554 1.887 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838222512 CQJDSNNDNFEGTM-IBGZPJMESA-N 453.904 1.592 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)n3)C2)C1 1840881031 ZJOHBLUKRWCYPU-NKOINVLESA-N 473.457 1.121 10 20 JDCD O=C(c1ncn(-c2ccccc2)n1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039172 USGCWUHGQAFSKE-CSKARUKUSA-N 461.478 1.915 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(NC(C)=O)cc3)CC2)cc1 12069569 UBBVAXZZKLXEKU-UHFFFAOYSA-N 453.543 1.921 10 20 JDCD O=C(COC(=O)Cn1nnc2ccccc2c1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 16258381 VNEAVJCNQDTZOB-UHFFFAOYSA-N 468.425 1.749 10 20 JDCD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F 731408447 LNCTWURYQJCZCE-UHFFFAOYSA-N 492.573 1.948 10 20 JDCD C[C@@H](OC(=O)[C@@H]1CCCN1S(C)(=O)=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 750446456 QWWPACUWYAOHDN-YJYMSZOUSA-N 470.503 1.756 10 20 JDCD CS(=O)(=O)Nc1ccc(N2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 857479522 VHKZTZYQINBRCK-UHFFFAOYSA-N 468.557 1.098 10 20 JDCD CC(C)NC(=O)CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916633993 UJUOIFFJYYARPW-UHFFFAOYSA-N 471.524 1.894 10 20 JDCD CCNS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 916676802 TYLYKGJXKMIWGP-UHFFFAOYSA-N 451.570 1.150 10 20 JDCD Cc1cc(C)n(-c2nnc(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2N)n1 917204836 NKCMGUGIEGSOGC-UHFFFAOYSA-N 460.539 1.179 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 917707473 JCALHWUATRRARJ-UHFFFAOYSA-N 481.521 1.752 10 20 JDCD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(CC(=O)N4CCN(C)CC4)cc3)CC2)cc1 918461767 KWNFQSLNOJEURM-UHFFFAOYSA-N 493.608 1.689 10 20 JDCD CCc1ccccc1NC(=O)CN1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 919808684 FKFJLBYGBODUFP-UHFFFAOYSA-N 460.556 1.723 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csnn1)C2)C1=NN(c2ccccc2)C(=O)C1 1778126696 JWFICWAXIZSTID-XMSQKQJNSA-N 468.539 1.459 10 20 JDCD Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1778722352 WAGVVZYRMBJIKJ-OJZQOFKYSA-N 484.534 1.978 10 20 JDCD CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cc3ccc(O)c(O)c3)NC(=O)OC(C)(C)C)C2)C1 1779002333 NLKKUGJEIKJXND-BXKMTCNYSA-N 477.558 1.774 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1 1780029233 WJWFNBFSUHDHKH-NRFANRHFSA-N 461.858 1.632 10 20 JDCD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1780894590 RSAWYFILRHCIRB-JOCHJYFZSA-N 499.655 1.435 10 20 JDCD O=C(/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)NCc1ccco1 1782007148 KSOQDXQNCMLJIB-CRTIWDKESA-N 489.912 1.660 10 20 JDCD COc1c(C)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1C 1785545463 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Cc1nc2sccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792239064 JRISBYXQPUNWIH-IHRRRGAJSA-N 493.636 1.158 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3F)C[C@@H]21 1792245044 JNCBOFLOXHXVKL-BQFCYCMXSA-N 479.599 1.598 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(F)cc1F)C2)c1cc(O)nc(O)c1 1796140690 WQCSYPJXJKFFHT-XGISUXEOSA-N 453.829 1.941 10 20 JDCD COc1cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)cc(OC)c1OC 1796141202 PIMYHNMUPZCQDQ-FUUZJDILSA-N 499.520 1.435 10 20 JDCD CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)o1 1796480953 WXZIRNSBRWGCLK-MFKICJERSA-N 479.493 1.234 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)nc(O)c2)[C@@H](O)C1 1796597451 BZVUKNOJIBNIHX-ADHGMGHFSA-N 490.557 1.363 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnn1)C2 1796749215 QLKPVMKICNIEFA-PLACYPQZSA-N 497.600 1.635 10 20 JDCD Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)cnc2c1 1797067349 AKMJBLIODYELJK-YVWYUNDQSA-N 498.923 1.585 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3cncc13)C2)c1cc(O)c(O)c(Cl)c1 1799769151 BPFCEWVDDZPOFP-HBCWATKFSA-N 456.886 1.916 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(OCC2CC2)cc1 1801822484 SBAMOXRLHHRSJW-OPMZPASUSA-N 453.495 1.799 10 20 JDCD NC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1 1803490215 GCCSCCLOYGPZTG-FNLKRUPLSA-N 459.506 1.830 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cccc(O)n1 1805679133 WFTVUVJZBQABJH-AUUYWEPGSA-N 471.564 1.362 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996640 XXHJACJKXZYDFT-HJPURHCSSA-N 488.504 1.890 10 20 JDCD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c2c1CCC2 1809371141 SWULAZYQEQVSTQ-QVKFZJNVSA-N 498.634 1.484 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1ccn2ccnc2c1 1809880790 DBQPNBZCSLERKN-UTKZUKDTSA-N 494.602 1.909 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810035966 LFDHNAXTPJAQBT-KSFYIVLOSA-N 473.489 1.765 10 20 JDCD O=C(/C=C\C(=O)NC1CC1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1810129563 PJHQVSLYOITXNS-CDNAXBDKSA-N 451.483 1.042 10 20 JDCD CS(=O)(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(O)nc(O)c4)C3)CC2)cc1 1810543990 UYYPIOMPVPYDLL-UHFFFAOYSA-N 487.578 1.984 10 20 JDCD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814188796 AICFNLSZTZEPNY-GDGOIWHQSA-N 482.653 1.106 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2)c1cc(O)nc(O)c1 1816729059 QBBMAHPDQOEPND-GOEBONIOSA-N 454.508 1.779 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)c3ccncn3)sc2C1 1817439441 GURWCQSGXSIFAE-RDNKVPPGSA-N 453.480 1.989 10 20 JDCD CCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497358 WYVPEUVQJNKTNJ-CYBMUJFWSA-N 461.573 1.792 10 20 JDCD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830652320 NPECNYXAWJSVMN-XMMPIXPASA-N 484.484 1.357 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(Cl)cn1)CCO2 1833792057 KVZXCTIPSUJCTL-WYAMSBGYSA-N 490.900 1.030 10 20 JDCD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)n(C(F)F)n1 1834988693 FQZBRKNEWYBDOQ-UHFFFAOYSA-N 478.500 1.892 10 20 JDCD Cn1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1Cl 1836042958 MEVJWEKPRZNFDQ-UHFFFAOYSA-N 462.938 1.379 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)n(C)n4)C3)C2)cc1 1839348803 NAAKFKVTHMOPCH-SANMLTNESA-N 493.564 1.917 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nonc4c3)C2)C1 1840880750 IWQJINHJKTXDNN-FBUBFAHDSA-N 496.476 1.123 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4ccnc34)C2)C1 1840880923 TXHMVEIVBQPINQ-SKFGKQHZSA-N 494.504 1.235 10 20 JDCD C[C@@H](NC=O)C(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1845178021 OHNDFWTZSAOIAR-VQIMIIECSA-N 473.574 1.043 10 20 JDCD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/c1ccc(O)c(O)c1O 1847436864 AVZOEVDMDWMQSW-RZVWWCORSA-N 495.532 1.198 10 20 JDCD C[C@]1(c2ccc(CNC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)NC(=O)NC1=O 726235244 XZRXKOPIPODIEM-RUZDIDTESA-N 465.554 1.949 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc([C@@H](C)N4CCOCC4)c3)CC2)cc1 729787808 NSCVEIZOPLNABY-OAQYLSRUSA-N 495.624 1.965 10 20 JDCD CN(Cc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCS(=O)(=O)C2)cc1 916674082 NFZBHUKNYYXCGJ-INIZCTEOSA-N 453.542 1.522 10 20 JDCD CN(C)C(=O)COc1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918013297 PXKOUIOKTKBGCZ-FQEVSTJZSA-N 467.570 1.855 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)CCNS(=O)(=O)c3ccc(C)c(C)c3)nc12 918805106 KZTKVYXSSNIINX-UHFFFAOYSA-N 476.511 1.640 10 20 JDCD CC(C)c1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnc2ncnn12 919274070 ITFSISICCXKWKG-UHFFFAOYSA-N 456.478 1.697 10 20 JDCD C[C@@H](C(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)S(=O)(=O)c1ccc(F)cc1 920535423 YJBYDRSSGMIDRV-HNNXBMFYSA-N 482.505 1.823 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)c1 920637381 AXILAIDOJDZVQG-GOSISDBHSA-N 452.460 1.660 10 20 JDCD O=C(COC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCS(=O)(=O)C1 1321579519 VAUNOAFIGZEVIQ-ZMTLZGASSA-N 488.634 1.576 10 20 JDCD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1)N1C[C@H]2C[C@H]2C1 1778127813 MXLRKLKLBIGNRF-BXUDIZFDSA-N 493.608 1.633 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1781690619 BLZFTGNLDDRZGZ-LJQANCHMSA-N 471.963 1.783 10 20 JDCD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008670 GGFIWTVGPAETNE-DEOSSOPVSA-N 486.956 1.592 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1 1782043679 ZCBALXWTXRTPBA-XMMPIXPASA-N 464.478 1.334 10 20 JDCD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1)n1ccnn1 1783221670 KIELSNHEFWACNV-LINUZTIBSA-N 471.514 1.183 10 20 JDCD Cc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783245448 WMBDQEUAPMEFQN-IIBYNOLFSA-N 462.597 1.378 10 20 JDCD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1784419351 FIFWYIOOJYHUQA-VLIAUNLRSA-N 480.637 1.252 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1785506258 WWJNPFDYSKHARP-UKKYDJSUSA-N 457.508 1.644 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2 1785508997 PHPUYXMNQKCKRK-SKFGKQHZSA-N 491.504 1.541 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1)CCO2 1785541260 XZIAOZQGYIAQIJ-OAQYLSRUSA-N 459.549 1.737 10 20 JDCD CNc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)cc1 1786830354 BRNHZCVDPLNDCU-XIRDDKMYSA-N 462.597 1.182 10 20 JDCD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)nc1 1787539051 IJMJNUNFPXKQBV-JLMWRMLUSA-N 461.522 1.776 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(O)nc(O)c1 1793399876 LJKHPJRLWCIRKW-YSTOQKLRSA-N 464.522 1.793 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)nc(O)c1)c1ccc(-n2c(O)nnc2O)cc1 1796601409 DSGNSTBAHAZYJF-RBVVOMGSSA-N 466.454 1.050 10 20 JDCD CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)c1F 1799767248 GTJCUIYXKUWPRB-CULMDFNYSA-N 452.870 1.693 10 20 JDCD COc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802077663 KHWOFJQFVAVVLF-JLMZWKBBSA-N 484.505 1.494 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2 1802079227 ZLHORBHESSUQFJ-FJQXNTCZSA-N 478.505 1.297 10 20 JDCD Cn1c(C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)cccc1=O 1805317582 AJAJBFUPVGFXNJ-AEBTWKCKSA-N 490.516 1.930 10 20 JDCD Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3c3cccnc3)cnn2c1 1807995953 LEOCVCWPBSWSHT-IIBYNOLFSA-N 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Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(F)c1F 1840702849 UCHNLEYMRQNFOP-NRFANRHFSA-N 499.561 1.204 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccn4ccnc4c3)C2)C1 1840880920 SXRWDPHPNNSFRR-DBTPONLISA-N 494.504 1.235 10 20 JDCD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)CC1=O 1843248891 FDCQOOCNTVAGIV-SFHVURJKSA-N 464.522 1.980 10 20 JDCD O=C(CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)Nc1ccc(F)cc1 1844992846 VYASXILZQJDQNX-UHFFFAOYSA-N 464.544 1.218 10 20 JDCD COC(=O)[C@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)C1 1846353975 VOOIKEQZIFLSKT-NNTYKDFWSA-N 458.511 1.999 10 20 JDCD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037240 HTPBFGOOPWQEHI-FHVRUZERSA-N 497.523 1.907 10 20 JDCD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1847079272 FFFYKAUOIBFSDR-SOUVJXGZSA-N 494.639 1.448 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2CCS(=O)(=O)CC2)cc1 1848073635 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NC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)cc1 1839435628 UFMHEWKEGTUGOG-HSZRJFAPSA-N 489.912 1.234 10 20 JDCD O=C(c1cccc(OC2CCOCC2)n1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250139 OXOFWPVYVWUUTH-UHFFFAOYSA-N 454.483 1.576 10 20 JDCD O=C([C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250689 DNLIEDPURSXHKO-SNVBAGLBSA-N 451.405 1.467 10 20 JDCD COc1nccc(C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1F 1843442075 VITMUSZHALDYOV-UHFFFAOYSA-N 451.458 1.839 10 20 JDCD COC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)Cc1ccccc1 1846259606 BPWMMYMUZLCOKS-UHFFFAOYSA-N 454.483 1.578 10 20 JDCD N[C@@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)c1cccc(Cl)c1 1847056387 COAISDMZMCTWEF-MRXNPFEDSA-N 452.989 1.404 10 20 JDCD Cc1cc(C(=O)COC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)c(C)n1-c1ccccc1 22002275 ICBBPFAIQZJZAJ-GOSISDBHSA-N 471.535 1.986 10 20 JDCD C[C@H](CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)S(=O)(=O)c1ccc(F)cc1 729325845 FMGRQNJWJUOCNE-MRXNPFEDSA-N 468.572 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CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1Cl 1794425949 FBUBYCFGYSAWHL-BTRCDTFPSA-N 490.944 1.669 10 20 JDCD NC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccc1 1795672933 HWTRKSCWEVJMIM-ORVPSHMPSA-N 475.549 1.111 10 20 JDCD COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cc1 1796479345 NIJPOTWULXNOBJ-VBVDBJQASA-N 492.532 1.111 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ccnn3c1)C2)C1=NN(c2ccccc2)C(=O)C1 1796480721 GWSFJARVYPFRBC-FEJSZKPUSA-N 472.505 1.330 10 20 JDCD COc1cccc(N2C[C@@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)CC2=O)c1 1796597660 NWGXGIVSGXSEKG-DKKFBQAASA-N 480.521 1.806 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2)c1cc(O)c(O)c(Cl)c1 1799769287 GBTKKTFSPOQYDF-ZSBFGKGUSA-N 457.874 1.311 10 20 JDCD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1800957014 URAXLDCAZHUWCC-LBQWBERBSA-N 494.548 1.124 10 20 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cncn2)CC1 1827191002 BLKRAWMDGKKUOI-NRFANRHFSA-N 463.542 1.691 10 20 JDCD O=C([C@@H]1CCc2nc(O)nc(O)c2C1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426826 JKIWJWIZBCBEMT-DNVCBOLYSA-N 497.552 1.732 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccncn1)CC2 1828199189 PAAIUIAUYJFDKC-QSLRECBCSA-N 453.480 1.989 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(Cl)ncn1)CC2 1828246598 DDVWYFMVOKOZEY-QMMMGPOBSA-N 483.000 1.673 10 20 JDCD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)C1(O)CCC1 1829743825 MZYMSFXTHBOBEL-QKKBWIMNSA-N 468.934 1.372 10 20 JDCD O=C(CN1CCCCC1=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899377 GROKFWHETMQIHS-KRWDZBQOSA-N 480.656 1.479 10 20 JDCD CCS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1833453696 VVHHUPBSWFHTOM-UHFFFAOYSA-N 488.006 1.371 10 20 JDCD Cc1nscc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1833745261 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477.612 1.579 10 20 JDCD CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837003732 YWSDXXFFZJLGQD-CYXJOQHWSA-N 473.570 1.909 10 20 JDCD COCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)CCO2 1839348146 DGZRBYVTWREURW-SANMLTNESA-N 485.581 1.827 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1839433998 IKYMUCYVKROJLT-JOCHJYFZSA-N 487.900 1.178 10 20 JDCD Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)s1 1840400974 JTLAAGYRPIADMA-UUCGHWEQSA-N 489.550 1.281 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)C2(C)COC2)C1 1841131715 JYCMFRPRWAUCRI-KRWDZBQOSA-N 489.569 1.774 10 20 JDCD COCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251723 TUIXCGLWLDZLNI-INIZCTEOSA-N 463.531 1.383 10 20 JDCD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)c3cc(O)nc(O)c3)C4)[C@H]2C1 1846161259 KGRQOPMSRSLFQE-BRWVUGGUSA-N 488.541 1.192 10 20 JDCD NS(=O)(=O)Cc1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 748838012 RVMDVRXQVDEERY-UHFFFAOYSA-N 484.557 1.661 10 20 JDCD O=C(COC(=O)C[C@@H]1CCCO1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 915561880 GKRJUKVCBIXPPZ-VEJKBTLKSA-N 478.548 1.845 10 20 JDCD CCCCNC(=O)CN1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 916986140 KIGPFTREJVZOHH-WOJBJXKFSA-N 477.625 1.589 10 20 JDCD O=C(COC(=O)CCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(N2CCOCC2)c(F)c1 918997630 KMRGXJPJBIGGGT-UHFFFAOYSA-N 476.505 1.076 10 20 JDCD O=C(COC(=O)CN1C(=O)CCOc2ccccc21)NCc1ccc(N2CCOCC2)c(F)c1 919012217 YGBNBZFNWPEUCR-UHFFFAOYSA-N 471.485 1.637 10 20 JDCD O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919698245 YPEAAYQSLODHAW-UHFFFAOYSA-N 495.559 1.813 10 20 JDCD CNC(=O)COc1ccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OC 919737772 GFPUNFRFKQTOSK-UHFFFAOYSA-N 471.510 1.334 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cccc2c[nH]nc12 1777891117 UDEWKCOZQYGDOU-OPAMFIHVSA-N 487.607 1.551 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1ccncc1F 1778385500 UJMXUKCIMPYJOK-FOIQADDNSA-N 466.560 1.209 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cnc2ccccc2n1 1778432767 HWEUWRVRNZXIGS-WZONZLPQSA-N 499.618 1.618 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1c(F)ccc(O)c1F 1781092575 DVUJEECNCONFRR-SPLOXXLWSA-N 499.561 1.658 10 20 JDCD Cc1ccc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)c1 1781653466 KACOCZADURUKIO-HXUWFJFHSA-N 451.545 1.438 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CN4CC(=O)NC4=O)CCO3)C2)cc1 1781751751 WOZQZEKWTVFLEH-VWLOTQADSA-N 479.537 1.089 10 20 JDCD O=C(/C=C/c1cnc[nH]1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1782428840 KJPHJABEXVJDKK-RXMIYNDUSA-N 476.537 1.730 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3sccn3c1)C2 1783246402 SHOHZZMJDPZECF-QVKFZJNVSA-N 492.648 1.989 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1783810573 FSOSAFCQFOQQLU-GSHUGGBRSA-N 459.593 1.480 10 20 JDCD O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1785162093 WJDUKNOHOQFXMZ-PKAIXSLNSA-N 485.562 1.984 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1785507209 LDRVHQDWSMZKBE-ZGVNINRLSA-N 469.450 1.084 10 20 JDCD COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1785509612 YHQQYMQBWFFCPP-UVXPNCNTSA-N 468.506 1.898 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787540202 NNUZRKVSYYBYSY-GMYOYGJASA-N 466.563 1.634 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc(C(F)(F)F)ccn1 1788966108 GRDAESDAVMAVBS-PJODQICGSA-N 466.416 1.814 10 20 JDCD CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790246342 ZIBQNEQTPSMGJU-ONQXIZJVSA-N 458.964 1.459 10 20 JDCD COc1cc(Cl)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1790710073 DHXKPTFLNCPEML-FNHZYXHNSA-N 475.929 1.991 10 20 JDCD CSCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792237390 HYOIMEHRFIURIN-IHRRRGAJSA-N 459.659 1.216 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F)C1=NN(c2ccccc2)C(=O)C1 1798340086 MFJAIIZLXOVGEZ-YOWGUQMCSA-N 466.416 1.523 10 20 JDCD C[C@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)CCN1C(=O)OC(C)(C)C 1802249137 KIHQSCZUDJYJAA-SVKXURNBSA-N 490.557 1.342 10 20 JDCD Cn1c(C(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)cccc1=O 1805309571 SBNNJENOOFZUHZ-KBMIEXCESA-N 498.543 1.893 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991299 OTAPZWOAIIGUEJ-UGSOOPFHSA-N 454.874 1.965 10 20 JDCD Cc1nnc(CC(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)o1 1810058479 OWKBBYYGAUJCID-UHFFFAOYSA-N 451.574 1.012 10 20 JDCD O=C1COc2ccc(C(=O)N3CCC4(CCCN(C(=O)c5cc(O)nc(O)c5)C4)CC3)cc2N1 1810546518 HZZGNTCUWPLKJU-UHFFFAOYSA-N 466.494 1.982 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cnn2c1CCC2 1812144500 CUIOOOVCTCGWBS-YWZLYKJASA-N 484.607 1.404 10 20 JDCD Cc1nc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)co1 1814186550 RYZDSMMYLACSOZ-KDOFPFPSSA-N 459.553 1.558 10 20 JDCD O=C(CN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1817152005 PMWXZVPITKQBDE-QQOXCAACSA-N 471.514 1.564 10 20 JDCD Nc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)cs1 1817392013 IUEDERRRBAXQHM-LLVKDONJSA-N 465.586 1.615 10 20 JDCD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC3)CCC2 1824246069 BZVURTVLYHKNKC-JTQLQIEISA-N 490.636 1.451 10 20 JDCD Cc1noc(CC(=O)N[C@H]2CCc3nc(NC(=O)/C=C/c4ccc(O)c(O)c4O)sc3C2)n1 1828198779 IYABNNCBSNCQEK-QBODLPLBSA-N 471.495 1.819 10 20 JDCD NC(=O)[C@@H](N)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736794 JQRSPUVCEYIZQB-DLBZAZTESA-N 466.966 1.577 10 20 JDCD CC(C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1832321053 XNQOHIPAQQKJPI-BVBLWJPBSA-N 464.515 1.088 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccsc1)CCO2 1836104769 QUTWILZHEHGTOQ-KFVKGYIZSA-N 474.535 1.577 10 20 JDCD CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837638337 BTLSZJYZNHDBCV-CMDGGOBGSA-N 496.564 1.897 10 20 JDCD CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)s1 1837721399 ULGVWDIKEASFJV-XMMPIXPASA-N 497.577 1.568 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1839433481 JEUWWYNAYSVSJG-JOCHJYFZSA-N 491.884 1.259 10 20 JDCD C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840469771 WKOKKRGSVVDEKP-BCHFMIIMSA-N 494.548 1.708 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2 1840878195 YUBXFZHOHUDPNI-LHSJRXKWSA-N 454.907 1.248 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1 1840896784 UIZIQJMAZJNORJ-HXUWFJFHSA-N 483.999 1.270 10 20 JDCD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251135 YXGMXKJDYBVLIK-OAHLLOKOSA-N 454.483 1.625 10 20 JDCD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)cc1 1847394283 FBGBJYHJZQLLNE-QNWVGRARSA-N 462.506 1.723 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3cccc(N4C(=O)CCC4=O)c3)CC2)cc1 774902875 WYIUHBSZRYYCMT-UHFFFAOYSA-N 451.479 1.854 10 20 JDCD CC(C)[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)N[C@@H]1CCS(=O)(=O)C1 913223665 CBLCCPXQEDIFCJ-DMZKTXOQSA-N 484.530 1.529 10 20 JDCD O=C(CN1CCC2(CC1)OCCO2)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 914573416 QKDVJWMSCLCECJ-PDGQHHTCSA-N 491.591 1.572 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(CC(=O)N2CCOCC2)cc1 918284682 NVEYMJATMULJBY-UHFFFAOYSA-N 484.528 1.319 10 20 JDCD CCS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918464162 RVPQKSCWUGQJKE-KRWDZBQOSA-N 472.567 1.437 10 20 JDCD CCS(=O)(=O)N1CCC(C(=O)OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 919012432 GNFBWKIFLMXNIL-IAGOWNOFSA-N 499.605 1.660 10 20 JDCD 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COc1ccc(N2CCN(C(=O)CN3CCN(S(=O)(=O)c4ccc(F)cc4F)CC3)CC2)cc1 727241692 ZHJFYJNYWKZCCU-UHFFFAOYSA-N 494.564 1.629 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(NC(=O)[C@@H](C)OC)c3)CC2)cc1 743433200 YXJWSXJIILAMJM-GOSISDBHSA-N 483.569 1.546 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N=c4cc[nH]cc4)cc3)cc2)C1 918371086 DKUUVYGLONZSFN-HXUWFJFHSA-N 493.589 1.936 10 20 JDCD CCNC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918441362 ZFQJAKWWCCODHS-UHFFFAOYSA-N 472.517 1.557 10 20 JDCD NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918967135 FOWMUNFRPVIBSC-UHFFFAOYSA-N 485.921 1.436 10 20 JDCD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 919840544 QWSJQIWNOYRDJN-FQEVSTJZSA-N 493.607 1.631 10 20 JDCD C[C@H](NC(=O)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1)c1ccc(N2CCOCC2)cc1 920923204 OJZQDCHOCIRFBN-KRWDZBQOSA-N 472.567 1.879 10 20 JDCD COCCN1C(=O)/C(=C\Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)C(=O)NC1=S 920978758 PDIKUAIPDIQDPQ-SSZFMOIBSA-N 479.584 1.123 10 20 JDCD O=C(COC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCS(=O)(=O)C1 1321579518 VAUNOAFIGZEVIQ-OJLMPMFISA-N 488.634 1.576 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2)C1=NN(c2ccccc2)C(=O)C1 1778127761 YYKNQMNLZFHEAG-RXMIYNDUSA-N 476.537 1.730 10 20 JDCD O=C1Cc2cc(C(=O)N3CC[C@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)ccc2N1 1778395549 JXGPSPQWYUYCGZ-XRRTUJGPSA-N 479.489 1.455 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778931838 HZCYLYCZRRLCKA-PNZFGTNVSA-N 495.532 1.910 10 20 JDCD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc1OC 1780656721 GRYVFBRAFQWFME-NRFANRHFSA-N 479.580 1.008 10 20 JDCD CCOC(CC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1)OCC 1784168816 LLXKDDGHZACEFU-DRGXBFSJSA-N 464.515 1.436 10 20 JDCD Cc1nn2cc(CC(=O)N3CCO[C@@]4(CCN(C(=O)/C=C/c5ccc(O)c(O)c5O)C4)C3)nc2s1 1785503917 TYVFMDOTLQWBTF-UUCGHWEQSA-N 499.549 1.302 10 20 JDCD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)nn1C(F)F 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O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2 1785505882 OLLMDYBUGHRMCS-KSBKHAFUSA-N 461.421 1.634 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cccc(N2CCOCC2)c1 1790118975 JGFNVMFAVNISCK-YYWHXJBOSA-N 482.537 1.237 10 20 JDCD Cn1ncc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CN5C(=O)CSC5=S)[C@H]4C3)cccc21 1792239167 QRIQMDREHDHURH-OWQGQXMQSA-N 487.607 1.027 10 20 JDCD Cc1nc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2s1 1797032360 UZNHWBMVXISCCO-YVWYUNDQSA-N 454.508 1.928 10 20 JDCD Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cc(O)nc(O)c3)C4)c2n1 1800138369 UPXIBSGOOMFRBP-CWPLJXCYSA-N 451.483 1.274 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C2 1802105092 RUXIJAOLRYSNMU-ACSCVQKFSA-N 477.583 1.379 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)c1nc[nH]n1 1807870508 OGGOUVIYZZIGMD-UZLBHIALSA-N 458.482 1.312 10 20 JDCD Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)c1=O 1808464406 LOOZBWCGEIYOJL-CYFREDJKSA-N 498.543 1.893 10 20 JDCD O=C1COc2ccc(C(=O)NC[C@H]3CCN(C(=O)c4cc(O)nc(O)c4)[C@@H]3c3cccnc3)cc2N1 1809878125 PZEFMDALYJOQAN-WAIKUNEKSA-N 489.488 1.852 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)c3cnccc3F)C2)CC1 1810337923 DRZHONMDZKWRBT-UHFFFAOYSA-N 450.561 1.926 10 20 JDCD CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1812663240 OZCJJFRSOPKBOR-OPWPMMOYSA-N 468.510 1.444 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1 1814166871 UWEFPBQDPURLPL-AKVVTYHKSA-N 478.509 1.599 10 20 JDCD O=C1Nc2c(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cc(O)nc(O)c5)sc4C3)cccc2C1=O 1816726691 XIVFSNYLWBMEIT-SNVBAGLBSA-N 479.474 1.624 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H]1Cc2ccccc2CN1 1818049102 SIISDJBMBLKBPV-QZTJIDSGSA-N 498.634 1.977 10 20 JDCD CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823441476 STBUBJUENILJCZ-UKRRQHHQSA-N 480.616 1.567 10 20 JDCD O=C(CCCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830693831 IUSNCHWGKVHRJI-DEOSSOPVSA-N 473.501 1.725 10 20 JDCD O=C(CCCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1832258357 PWMLSPBFNJCLSX-QFIPXVFZSA-N 496.486 1.968 10 20 JDCD NC(=O)CC[C@H](N)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877443 KXTBNTZLWZVMFB-MXDAGHGGSA-N 474.558 1.029 10 20 JDCD COc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)cn1 1832898160 CLGFPKUULUZSPN-MRXNPFEDSA-N 477.612 1.579 10 20 JDCD C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834986886 GKBCFHFQAPFGPT-MRXNPFEDSA-N 468.558 1.574 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1 1836418900 FSWSRFPASVMMBM-QFIPXVFZSA-N 454.439 1.018 10 20 JDCD O=C(Cc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839070515 UDUGGYYUHLDAIB-DEOSSOPVSA-N 466.494 1.287 10 20 JDCD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1839661972 QWVUHGRZHLOVLV-KXBRKGMBSA-N 497.548 1.547 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1 1840879757 CVCLFNDFDASXDM-KSBKHAFUSA-N 478.498 1.787 10 20 JDCD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)s1 1840880568 WEDWNQAKAPLDBB-ILHLOOHCSA-N 474.535 1.957 10 20 JDCD CCN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1840929891 DGKKCLADUCBYSQ-SKFGKQHZSA-N 489.569 1.005 10 20 JDCD Cc1ccc(C(=O)OCC(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)c(O)c1O 727003759 FFGGUJIWEOEOKJ-UHFFFAOYSA-N 452.460 1.235 10 20 JDCD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccc(S(=O)(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1 729033805 RQLWSTIJQCBXKI-HIFRSBDPSA-N 483.568 1.749 10 20 JDCD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1 747011207 NCURYSHSSCRFBP-UHFFFAOYSA-N 494.545 1.176 10 20 JDCD O=C(CN1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1)N1CCCCC1 918219731 OTHKKDOVRINHGF-UHFFFAOYSA-N 461.582 1.627 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 918284392 DUOBBDGQWSWKBD-UHFFFAOYSA-N 476.530 1.358 10 20 JDCD CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)CC1 918438680 GPNBHSFUIYWNKL-UHFFFAOYSA-N 495.649 1.811 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(N4CCS(=O)(=O)CC4)c3)cc2)C1 919911364 PLTQTJDQPJUSQY-IBGZPJMESA-N 485.610 1.945 10 20 JDCD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(S(=O)(=O)N2CCN(C)CC2)c1 920190145 XYJXPDZOFKNPOM-UHFFFAOYSA-N 487.626 1.676 10 20 JDCD Cc1ccccc1CN1CCN(C(=O)COC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 920634974 AFOKKEMQFAUYNZ-UHFFFAOYSA-N 461.540 1.573 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)NCc2ccc(CN3CCCC3)cc2)c1 920637433 FKYIXDURIGDWGT-UHFFFAOYSA-N 461.540 1.833 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2)c1cc(O)nc(O)c1 1777849020 ILAJUJLEDJVARW-WZONZLPQSA-N 466.498 1.065 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCSCC1)C2 1783246628 BJJCNFHLNYJJRW-FOIQADDNSA-N 471.670 1.504 10 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CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1 1795699042 BOSOGEFRFUCWHM-HGJUEJDCSA-N 499.612 1.621 10 20 JDCD C[C@H](NC(=O)c1cnccn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798550576 XHLJIWFIXSAYMM-DKKFBQAASA-N 489.536 1.026 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccc1F)C2 1802103611 CGYBAKSNOZNSLQ-YQYWCBKUSA-N 471.963 1.543 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C2 1802103850 FBJHGUXHDRHHBT-DNEZFVSUSA-N 494.038 1.893 10 20 JDCD Cc1nn(C)c(C)c1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994207 SUELKNPDKRTFSM-IERDGZPVSA-N 450.499 1.872 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807999597 MCTCSBJEXULRAR-QRWLVFNGSA-N 464.482 1.500 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000619 NVTPDMJJKRZLNC-ZQYRFBGISA-N 479.537 1.608 10 20 JDCD Cn1c(=O)n(C)c2cc(C(=O)N3CCC4(CCCN(C(=O)c5cc(O)nc(O)c5)C4)CC3)ccc21 1810551324 HBAXOMYPVXSTCV-UHFFFAOYSA-N 479.537 1.842 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cccc2nccn12 1812178282 RZPMCMSBKTVKFR-IERDGZPVSA-N 494.602 1.909 10 20 JDCD O=C1C[C@H](C(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)CCN1 1813133896 JUUFUNIPPHNQLH-YJLYGGOZSA-N 488.548 1.407 10 20 JDCD O=C(/C=C/c1cnccn1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813485269 GFWYWHILPOXIBG-DMDWLKPBSA-N 482.591 1.451 10 20 JDCD CC(C)(C)[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814185232 NTXCJDSFKYYSRB-BMGDILEWSA-N 464.613 1.355 10 20 JDCD Cc1ncoc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814185681 DWAKYVQWOMVIKN-WMLDXEAASA-N 459.553 1.558 10 20 JDCD CC(C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814185956 VWXCDKMNVMRAAP-KXBFYZLASA-N 464.613 1.763 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2C2CC2)[C@H]1c1cccnc1 1814186010 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479.546 1.594 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1cc2n(n1)CCC2 1779121430 KKEQHKREYKHZMG-ATIYNZHBSA-N 490.564 1.750 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)cn3)C2)C1 1779477004 QUZLNQCHMIAKIX-QHCPKHFHSA-N 467.913 1.971 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1779630990 KVCCVJCDXCCKIV-PIITYICYSA-N 491.504 1.745 10 20 JDCD Cc1nc(C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)sc1C 1779950194 XPUYLFVLIMAMAT-SFHVURJKSA-N 454.599 1.064 10 20 JDCD CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781123015 MCKSMFCTLWOCOT-LKNMKHRSSA-N 453.923 1.403 10 20 JDCD Cc1cc(F)ccc1C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1785253778 OIRTTYJDHQSHIF-FQEVSTJZSA-N 451.545 1.438 10 20 JDCD NC[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)c1ccccc1 1785508685 JZPMGSABNACPFP-SKEHMEGCSA-N 467.522 1.389 10 20 JDCD 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O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3cccnc13)C2 1802103898 HZOZBAMXULUTNO-CCWDJLKJSA-N 470.576 1.298 10 20 JDCD COc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN2C(=O)CSC2=S)cc1 1802104811 JIMYUUOGFGAAIT-DQJZQPOSSA-N 489.619 1.249 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1nnc(-c2ccccc2)o1 1804333830 YWBAAMILEHFHLF-QDMKHBRRSA-N 471.564 1.849 10 20 JDCD Cc1ncccc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1805503642 UOLHCMZFOYJEMI-OXQOHEQNSA-N 469.592 1.965 10 20 JDCD CC(C)(O)CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1806779539 CKSHKEYGQUNOKO-KBXCAEBGSA-N 450.586 1.109 10 20 JDCD O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1807413384 YMEDYWZKCIXAKB-LIRRHRJNSA-N 493.014 1.498 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994576 IOIKWGQBHLQWOZ-YJYMSZOUSA-N 454.874 1.965 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cn2ncccc2n1 1809365858 VCNOQAOQAYIZGO-MGPUTAFESA-N 495.590 1.304 10 20 JDCD O=C1NC(=O)[C@H](CC(=O)N2CC[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)N1 1811798382 NYUVFUTXATWKAD-QITLCBANSA-N 487.900 1.064 10 20 JDCD CNC(=O)CC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814162562 UKYWYEAHEMPRCG-LXBVETIDSA-N 454.483 1.054 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2cscn2)[C@@H]1c1cccnc1 1814186732 WONJSKPSNDKPPP-CXAGYDPISA-N 461.594 1.718 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1 1814189833 IERSBHPLFSKBGF-AUUYWEPGSA-N 473.555 1.796 10 20 JDCD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1817103164 WTFNEEZDHIUNRR-LLVKDONJSA-N 493.505 1.363 10 20 JDCD CC(C)CNC(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1818132773 GXRVBLRDICKVDP-IBGZPJMESA-N 479.541 1.967 10 20 JDCD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1819838651 GNKWKIBJIJILPJ-QWRGUYRKSA-N 491.624 1.206 10 20 JDCD NC(=O)c1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)[nH]n1 1820024936 KBAHLPNZLSINBJ-ZDUSSCGKSA-N 485.888 1.983 10 20 JDCD NC(=O)c1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1825402778 UWYHDNXYYVQBQQ-MRXNPFEDSA-N 489.623 1.274 10 20 JDCD Cc1[nH]nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)c1F 1828239952 MIMDDWMJHXWBFK-MRVPVSSYSA-N 468.561 1.400 10 20 JDCD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1829114096 HAQLMMQFIFLKPO-XZOQPEGZSA-N 497.596 1.550 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@@H](O)c1ccccc1 1834582217 JJWGFUIBBJPGKV-QFIPXVFZSA-N 454.527 1.412 10 20 JDCD CC(C)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1835888588 UIUMPUVAIHQOLA-OAQYLSRUSA-N 455.939 1.209 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1 1837080852 UQYHDAZORJUDGC-NRFANRHFSA-N 483.521 1.945 10 20 JDCD Cc1cnc(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)s1 1837361997 RKRFQQUASPVKGY-UHFFFAOYSA-N 482.653 1.924 10 20 JDCD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)N1C[C@H]2C[C@H]2C1 1838369645 BUIIIYDSRFYVIH-ZACQAIPSSA-N 494.683 1.186 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)c1)CCO2 1838935849 SFQUWCROBQOGMH-NRFANRHFSA-N 481.427 1.895 10 20 JDCD Cc1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)c1 1839431846 QUITZQLVWVOQSA-QFIPXVFZSA-N 461.902 1.838 10 20 JDCD Cc1cc(C)nc(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840880329 JGFIVGLAICIOKW-SKFGKQHZSA-N 483.521 1.599 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1 1840881177 HGMFYHNOKNSPPS-UVXPNCNTSA-N 495.488 1.728 10 20 JDCD O=C1Cc2cccc(C(=O)N3CC4(CCCN4C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)c2N1 1843442624 XBKYUTXUMSCMQG-UHFFFAOYSA-N 457.490 1.791 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCCC12CN(C(=O)c1ccncn1)C2 1844251491 CGYHGZQJVJBRJX-SFHVURJKSA-N 497.552 1.841 10 20 JDCD O=C(c1ccc([N+](=O)[O-])cc1F)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054965 YGNMLFDCRSPJHU-UHFFFAOYSA-N 452.489 1.411 10 20 JDCD CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)CCOCC1 1847710657 FJWZYHARECIOBI-IRXDYDNUSA-N 490.557 1.630 10 20 JDCD COc1ccc(N2CCCN(CC(=O)Nc3cc(C)nn3[C@@H]3CCS(=O)(=O)C3)CC2)cc1 108092898 FGTXHWURBCLHJS-LJQANCHMSA-N 461.588 1.711 10 20 JDCD Cn1nc(Br)c2c(=O)n(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cnc21 727164411 NNGJJPISPKWUDQ-UHFFFAOYSA-N 493.337 1.309 10 20 JDCD CCN(CC)c1ccc(C=c2sc(=CC(=O)C3CC3)n(CC(=O)NC[C@@H]3CCCO3)c2=O)cc1 914580083 WOLHOAFULIYKTB-NRFANRHFSA-N 483.634 1.640 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(C2CC2)nc2c1c(O)nc(=O)n2C 914645858 PXPDIVRYVKZXAV-UHFFFAOYSA-N 465.510 1.793 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)cc1 915298234 BUXRDULIJCQPGM-UHFFFAOYSA-N 456.524 1.933 10 20 JDCD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)[C@H]3COCCO3)c2C)c1 915413547 YADHPJBLZICBBQ-HXUWFJFHSA-N 459.451 1.809 10 20 JDCD O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 918294905 MSYKAVQPGHJALN-QFIPXVFZSA-N 496.564 1.809 10 20 JDCD CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1 918429483 JBGOXZZAMSTEBF-UHFFFAOYSA-N 492.573 1.948 10 20 JDCD O=C(COC(=O)CNC(=O)c1ccc(Br)o1)NCc1ccc(N2CCOCC2)c(F)c1 918977222 HMHVXRUTFWETJH-UHFFFAOYSA-N 498.305 1.607 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)CCn3nnc4ccccc4c3=O)cc2F)C[C@@H](C)O1 919020394 GRBKPLGFADUKNG-IAGOWNOFSA-N 497.527 1.794 10 20 JDCD NC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)=NN1c1ccc(F)cc1 919969193 HJCGZDXAILOJAW-NRFANRHFSA-N 457.481 1.662 10 20 JDCD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970990 CAHUOHZQPAKWQF-UHFFFAOYSA-N 473.549 1.676 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1 920196316 PMVTWDXYEOCXJW-UHFFFAOYSA-N 485.566 1.249 10 20 JDCD COCCN1C(=O)/C(=C\Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C(=O)NC1=S 920979127 XBWDVWOFQYOSLY-VKAVYKQESA-N 466.585 1.437 10 20 JDCD C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777847828 BJCACLWSWROUOC-NTKDMRAZSA-N 469.494 1.919 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2)c1cc(O)nc(O)c1 1777851016 SUFLKKWCZTYSIW-UMEGOILYSA-N 479.537 1.387 10 20 JDCD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127913 QCAXAFKULUSEHP-FLPMJASOSA-N 498.584 1.001 10 20 JDCD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)N1C[C@H]2C[C@H]2C1 1779254730 WWQDAYSEQOYMAZ-BXUDIZFDSA-N 493.608 1.633 10 20 JDCD COc1ccc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1780861975 MRBQZXRLZAJMSH-HXUWFJFHSA-N 483.999 1.652 10 20 JDCD C[C@](O)(C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)C(F)(F)F 1782004093 TTXPYIMETMGCPY-IRXDYDNUSA-N 452.813 1.508 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1782607673 QLCTVYBSKBAYCU-WNEWMZQESA-N 492.532 1.413 10 20 JDCD 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COc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)ccc(F)c1F 1839382312 QQQWJLGIAPVMEN-JOCHJYFZSA-N 479.436 1.163 10 20 JDCD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)ccc1O 1839433626 MIRAKYZRWOHKDT-HSZRJFAPSA-N 492.912 1.849 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC=CO3)C2)C1 1839433745 RXKVTVBXQWRHAK-UTKZUKDTSA-N 452.891 1.514 10 20 JDCD O=C(CSc1ncccn1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433977 GZTNIGLXHNUGSN-OAQYLSRUSA-N 494.957 1.404 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(O)c1)CCO2 1840062896 BSPAQDQTPNVRGL-NRFANRHFSA-N 463.874 1.236 10 20 JDCD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)C[C@H]2C[C@H]21 1841362382 FFFYKAUOIBFSDR-RBSFLKMASA-N 494.639 1.448 10 20 JDCD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1845859496 FLAOCNIFGDREHB-IBGZPJMESA-N 498.540 1.567 10 20 JDCD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055325 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1781812904 QGHKSABHIKYRSG-XMMPIXPASA-N 480.477 1.040 10 20 JDCD O=C(CCc1cccc(O)c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2 1782323175 CEAXHHKULBAGQL-WZONZLPQSA-N 491.635 1.699 10 20 JDCD CN(C)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)cc1 1783246005 MGVXQHYYPXEKQT-WZONZLPQSA-N 490.651 1.740 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1785505813 QJGHBXVSONNOOZ-DLMBFZKISA-N 465.466 1.003 10 20 JDCD Cn1c(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc2ccccc21 1785540329 XFDUMJPITNTDKB-HSZRJFAPSA-N 486.619 1.411 10 20 JDCD COc1cccc2c1C[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C1)CC2 1787294117 AFGUYTQSXLCVAS-TZLLFPAYSA-N 481.549 1.900 10 20 JDCD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)c(O)c1 1787540150 JQIIZOYOOBYRMH-GRWTVWFQSA-N 492.532 1.787 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cnc2ccc(F)cn12 1790473949 BZMVLIJKOQODCP-DMBVJFSPSA-N 496.495 1.897 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2)c1cc(O)nc(O)c1 1796138489 AJJYJQKIVMBBHR-DHAILBGBSA-N 453.520 1.584 10 20 JDCD CC(C)(C)c1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cn1 1796763157 ZVVFDYNMVBNZKT-GSNLVNFQSA-N 482.537 1.808 10 20 JDCD O=C(Cc1ccc(Br)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1800438580 XHOMOLAKERJCLO-VTEUUUEMSA-N 494.317 1.840 10 20 JDCD CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O)N(CC)CC 1802078991 NZFUDVQRHHKHLB-RWDBHQLVSA-N 461.559 1.527 10 20 JDCD O=C(CCc1cnc[nH]1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1804430388 QTPBXOZJRXXPOC-FOIQADDNSA-N 472.596 1.304 10 20 JDCD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)n[nH]1 1805265064 ULBPSSIYTFTKKE-LIRRHRJNSA-N 486.579 1.187 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993588 YWPMOZZPDAEKSA-QMHKHESXSA-N 464.478 1.992 10 20 JDCD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807993860 OMYDIWHVXUPJIG-CEQIKUNHSA-N 450.499 1.740 10 20 JDCD O=C(Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807995311 PJPYLEVFLFSWFV-MGPUTAFESA-N 462.466 1.241 10 20 JDCD O=C(Cn1nccn1)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1808964209 GELBETJEXZNEIJ-VYHZTRRPSA-N 464.482 1.209 10 20 JDCD NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361767 FYBNOOWMEDVJCB-LBPRGKRZSA-N 454.512 1.114 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)c1cc(O)nc(O)c1 1817846277 OMYXJULIRDWAJG-NSHDSACASA-N 457.365 1.627 10 20 JDCD CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1822121400 LSSFZQJLGLWSKI-ZDUSSCGKSA-N 496.615 1.787 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CC[C@H](O)CC2)n[nH]1 1822543863 SRIDYMILLVSZQU-YDHLFZDLSA-N 465.601 1.813 10 20 JDCD CS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715981 XZGSXZMANCHPAZ-FQEVSTJZSA-N 474.583 1.444 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2 1828199203 PTAXKGUJLXDRDX-HSVJCBRXSA-N 474.539 1.218 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2 1828249124 FOATUHHCMHYJHW-DZGCQCFKSA-N 490.632 1.519 10 20 JDCD O=C(c1cnc(O)[nH]1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901142 OPUJOENRAVSPSX-CQSZACIVSA-N 451.574 1.209 10 20 JDCD CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)co1 1833344512 FRALQMLZSUVRSE-RUZDIDTESA-N 495.536 1.661 10 20 JDCD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n1 1833768672 MTLJLLQGPCLRKW-QFIPXVFZSA-N 477.901 1.539 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cn1 1834002129 XDDUJHMSKBFSCK-SXBBHYFQSA-N 469.494 1.290 10 20 JDCD Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1835974124 PBRBIXUEVXUHEM-HWKANZROSA-N 481.553 1.800 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1836418050 WWVXZBKHQRIAQV-SFHVURJKSA-N 488.444 1.352 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1836418426 TWVHFWFMFZBSLC-QFIPXVFZSA-N 487.900 1.406 10 20 JDCD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)ccn1 1837979657 QXGAHCWLGVBPNC-QFIPXVFZSA-N 477.901 1.539 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3coc(Cl)n3)C2)C1 1839431629 DVLPMCAQHLRGKW-IBGZPJMESA-N 472.281 1.776 10 20 JDCD C[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)O1 1839433995 IDTFCABTJVOYSK-QKAVXHIFSA-N 454.907 1.389 10 20 JDCD O=C(CCc1cncnc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839434009 IZICVXCCYKHTOJ-QFIPXVFZSA-N 476.917 1.244 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2 1840247743 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C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1)c1ccccc1 1840897703 RDUPVMXQPXMVHA-ZHRRBRCNSA-N 477.608 1.107 10 20 JDCD C[C@H](NC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 115953563 JCJNICNZXPWGCZ-INIZCTEOSA-N 462.528 1.977 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=S)NCc3ccc(S(N)(=O)=O)cc3)cc2)C1 726471028 DAJFPYNMDYTOBS-KRWDZBQOSA-N 461.613 1.200 10 20 JDCD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3cc(F)cc4c3OCOC4)CC2)cc1 729781493 BWINNIZJQANAND-UHFFFAOYSA-N 464.515 1.964 10 20 JDCD COCCOC(=O)c1c(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)sc(C(N)=O)c1C 747018198 WQSZGAJPCYJBFJ-UHFFFAOYSA-N 488.566 1.596 10 20 JDCD Cc1cc(CC(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 749985217 HEHDELLTEMNDGL-QGZVFWFLSA-N 481.958 1.846 10 20 JDCD Cn1ncc2c(O)nc(CCC(=O)OCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)nc21 900690623 HIULJCVAINHCDC-UHFFFAOYSA-N 485.456 1.959 10 20 JDCD O=C(Cn1cnc([N+](=O)[O-])c1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 914530727 QUNGHUQXHTWDKI-NSIKDUERSA-N 461.481 1.538 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(CN4CCOC4=O)c3)CC2)cc1 915744081 VUEHYDLLTPFDPG-UHFFFAOYSA-N 495.580 1.914 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)NC[C@@H](C(C)C)N3CCN(C)CC3)CC2)cc1 916196342 BJLTUYWCMIRKOH-DEOSSOPVSA-N 460.667 1.779 10 20 JDCD CCOC(=O)N1CCN(S(=O)(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 919945578 LZCYIWBGJJCCON-HOTGVXAUSA-N 458.556 1.548 10 20 JDCD CN1CCN(C(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2)CC1 920188862 OIQAMPBXAKOTMW-UHFFFAOYSA-N 479.581 1.508 10 20 JDCD Cc1cc(NC(=O)CN2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)no1 920869541 RCDRYAGZJKAJMO-GOSISDBHSA-N 456.547 1.847 10 20 JDCD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)nn1C(F)F 1777850661 CSUMKKCWUZZMEV-QVKFZJNVSA-N 465.457 1.834 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1 1778597568 HUBUVLGLWBURAQ-NRFANRHFSA-N 457.874 1.551 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779404393 PHMSOKJQCLSMQL-GOSISDBHSA-N 499.412 1.148 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cccnc1S 1783548636 FABFPEWQZGFAAX-DEMFTJLTSA-N 471.535 1.794 10 20 JDCD O=C(CCc1cnc2[nH]ccc2c1)N1CC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1783679637 LXDFMZMWCLXNDU-JOCHJYFZSA-N 487.607 1.186 10 20 JDCD O=C(CCc1cnc[nH]1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1785226860 MJKJKDSFHORREP-OHWDGTCCSA-N 456.499 1.152 10 20 JDCD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)C(=O)OC(C)(C)C 1785508249 CHZQVQNSEPNMDP-YFTVHVBSSA-N 491.541 1.513 10 20 JDCD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785546920 LYYGZZIXTUEGDO-NYHFZMIOSA-N 479.599 1.695 10 20 JDCD Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)cc1 1787541413 MPQZQTMGHNYJHJ-RRPUWOKSSA-N 488.544 1.950 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1cnn2ccccc12 1787851879 GRUOBLRUEGOQEV-NYDSKATKSA-N 486.532 1.721 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cccc(OC2CCOCC2)n1 1789105286 IFIFKFWTAUGLJN-QSFXBCCZSA-N 498.536 1.353 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246345 ZWJRWWUYUIMBES-CHIMOYNISA-N 479.839 1.023 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1nc2ccc(F)cn2n1 1790528337 OTMMGQIUEFVJSK-YLVFBTJISA-N 489.891 1.840 10 20 JDCD COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)C5=NN(c6ccccc6)C(=O)C5)C[C@@H]43)(C1)C2 1791016580 CRPCQAFPMNEJHD-CIVKJWIBSA-N 494.548 1.102 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21 1792238993 GAZMTCOTGXWEPI-ZVZYQTTQSA-N 485.591 1.083 10 20 JDCD COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)c(OC)c1OC 1793091136 WKTVKFSLNCLEGO-MBQWOLKWSA-N 499.520 1.435 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2)C1=NN(c2ccccc2)C(=O)C1 1796479576 JHGSHXJXIRJCLH-FEJSZKPUSA-N 474.517 1.618 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)c(F)c1)C2)C1=NN(c2ccccc2)C(=O)C1 1796481200 UVTUCDCYCOIQKH-MFKICJERSA-N 468.460 1.961 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cc2ccsc2[nH]1 1799945024 IBHPSYYTCDYECW-DRXBFXEBSA-N 464.594 1.293 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C(=O)c1ccco1 1804330725 HVFGGIIDUMZVDV-KDOFPFPSSA-N 472.548 1.424 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)c1ccnnc1 1805485644 GPHNNYUXMVVPPT-JPYJTQIMSA-N 469.505 1.984 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)n1 1808301173 VGJICXWOFBAKCY-XIKOKIGWSA-N 485.884 1.981 10 20 JDCD O=C1CC[C@@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)CC3)N1 1814047843 MKPUMXKLUJVQRR-DOMZBBRYSA-N 466.523 1.127 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1 1814189427 PPWGTPVKFQTAPG-AUUYWEPGSA-N 495.590 1.533 10 20 JDCD C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816731399 IUCLGBOIIRIKIP-WFASDCNBSA-N 481.534 1.994 10 20 JDCD CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818128076 WHFGXVFWNZAQTG-BXUZGUMPSA-N 466.589 1.129 10 20 JDCD Cn1c(=O)n(C)c2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cc(O)nc(O)c3)CC4)ccc21 1818356524 BMCYQLCBKQMROD-CYBMUJFWSA-N 494.533 1.679 10 20 JDCD O=C(CCN1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1823573949 HJLVAEZKVRGNQQ-HNNXBMFYSA-N 464.617 1.748 10 20 JDCD CC[C@H](C)[C@H](N)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826849110 MMPDZAWGSVREHC-GMBSWORKSA-N 454.662 1.840 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)Cn2cncn2)CC1 1827191003 BLKRAWMDGKKUOI-OAQYLSRUSA-N 463.542 1.691 10 20 JDCD O=C1NC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)O1 1827714862 IMKXVHIZJBAPHN-PMACEKPBSA-N 467.526 1.507 10 20 JDCD O=C1C[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CN1 1831422372 MRMBDCGHRAQAPG-KEEVIKFDSA-N 457.527 1.572 10 20 JDCD Cc1noc(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1832562468 SNZDHABHYVFCEU-WUQPGSQJSA-N 487.509 1.121 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)CC2)CC1)c1cc(O)nc(O)c1 1834988679 CQFRKHRFQFVIEW-UHFFFAOYSA-N 491.552 1.777 10 20 JDCD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)nn1C 1834988716 IBUXRFGXKQFLKR-UHFFFAOYSA-N 456.547 1.288 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1836419108 RVVPIYXDVJGZCM-QHCPKHFHSA-N 489.475 1.573 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3F)C2)C1 1836525902 CSJBSOSDYIXCJF-XMMPIXPASA-N 481.484 1.084 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2 1837894844 CFLAWAWDYLWSNB-XMMPIXPASA-N 497.939 1.598 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1839545099 MFSPLKSGVCIAFR-JOCHJYFZSA-N 454.439 1.018 10 20 JDCD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)s1 1840879957 PPVQIVNKADGNBQ-YVRWJWEHSA-N 490.534 1.657 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c[nH]3)C2)C1 1840881569 WMOPNNASDYUOFH-WYAMSBGYSA-N 461.446 1.054 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(-n3cccn3)nc2)C1 1844522274 BDHVXQJLBTXBCJ-UHFFFAOYSA-N 469.505 1.877 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1Br 104991239 QCHRVWHTRIFCNP-UHFFFAOYSA-N 484.372 1.978 10 20 JDCD C[C@H]1COCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 729538821 VHBVREGGOUATHM-AWEZNQCLSA-N 464.500 1.552 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]34)cc2)C1 742355794 WEFQLNVFUKAHBE-BOFXEDATSA-N 459.616 1.730 10 20 JDCD CN(C)c1ccc(CNC(=O)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1F 747010457 FQIFEMPEPNOGAD-UHFFFAOYSA-N 464.519 1.168 10 20 JDCD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(C(=O)NCC(=O)O)cc3)CC2)cc1 748961324 UQAKVHHGNYNJCJ-UHFFFAOYSA-N 490.582 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10 20 JDCD C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)CC1(F)F 1840825832 ROTVWGGKRLQCDO-VXKWHMMOSA-N 476.480 1.281 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)C1 1841445256 RJAKXBIIYIJXJK-DUXPYHPUSA-N 450.498 1.265 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)c2nc[nH]n2)C1 1843189604 ZQTLWRHKKMLXJA-OAHLLOKOSA-N 486.529 1.169 10 20 JDCD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1847077855 CWNQIPBFVKZUMZ-CWRNSKLLSA-N 458.515 1.708 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)[C@@H](F)C1 1847723781 BVDKWIONTBNASK-QZWWFDLISA-N 478.521 1.903 10 20 JDCD Cn1nncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1848277630 CDJXBUWNYAUYNN-QYZOEREBSA-N 483.573 1.349 10 20 JDCD CC(=O)N1c2ccc(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2C[C@@H]1C 726976068 IFTMTHHSNAJXSH-INIZCTEOSA-N 477.608 1.697 10 20 JDCD Cn1cccc1C(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 825117179 ODTLBGPYUHMLHY-LICLKQGHSA-N 473.532 1.928 10 20 JDCD CN(Cc1ccccc1O)C(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 917309866 IBVUQHFNSQCKAY-KRWDZBQOSA-N 474.988 1.786 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCNS(=O)(=O)c3ccccc3)cc2)C1 918117523 NCEWQRVGRNRXPC-GOSISDBHSA-N 459.572 1.166 10 20 JDCD COc1ccc(OC)c([C@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918118347 ZGYZTRBALBQBMA-DYESRHJHSA-N 456.543 1.938 10 20 JDCD CCN1C(=O)c2ccc(C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)cc2S1(=O)=O 919581702 UEVYUFYCAOJIHL-UHFFFAOYSA-N 487.534 1.365 10 20 JDCD COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 920194564 GEORZBLHHMFXNN-KRWDZBQOSA-N 490.582 1.091 10 20 JDCD CCN1C(=O)C(=CNc2ccc(S(=O)(=O)N[C@H](C)COC)cc2)C(=O)N(CC)C1=S 920979864 LASIFNNYKTXEME-CYBMUJFWSA-N 454.574 1.291 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c4ncccc34)C2)C1 1777712841 OGVXRRZEMFUIGP-JIBKAZCMSA-N 464.478 1.837 10 20 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O=C(/C=C/c1cc2ccccc2o1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1797136813 JCKSQBSNCWEEPY-OUALTBDCSA-N 485.587 1.896 10 20 JDCD COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)C1 1799766867 BPXIKKXVMKMCMM-VQYVRKMMSA-N 466.918 1.544 10 20 JDCD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CC1 1802572844 FXCJYHXTVIQSFI-YLJYHZDGSA-N 475.640 1.290 10 20 JDCD C[C@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1803670635 KSGLFDCBGHPCNL-UHYGZKCKSA-N 460.918 1.977 10 20 JDCD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)n(C)n1 1804928545 KCTDMTCRSRSLND-IFXJQAMLSA-N 488.595 1.004 10 20 JDCD O=C(CN1CCCC1=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1806929805 VSURKDRYYWUCKY-VREWFTFGSA-N 480.521 1.540 10 20 JDCD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)o1 1807469245 SAQNLFUMUMUAQJ-HOYKHHGWSA-N 487.520 1.814 10 20 JDCD O=C(Cc1ccc(F)cn1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807480997 UGTIGTDZGYVGAI-OYHNWAKOSA-N 451.458 1.984 10 20 JDCD Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)n1 1807531707 VYLGSSRPXAWTLY-HOYKHHGWSA-N 487.520 1.814 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)[C@@H]1C=CCN1 1808223214 KTEYULZGJHGUJM-ZSHPTUGOSA-N 450.495 1.446 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808361274 OODVAJAAOHSQQZ-JLMWRMLUSA-N 462.510 1.172 10 20 JDCD CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1810093213 CYMURDZSUQLECL-YXKFXFPPSA-N 492.916 1.530 10 20 JDCD O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)CCN1 1813137816 CQQIVMRFFNRJCC-ZMOXQMTPSA-N 480.521 1.444 10 20 JDCD C[C@H](C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)n1cccn1 1813431142 UNMRFIKDHCVCAY-OGWOLHLISA-N 472.596 1.405 10 20 JDCD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1F 1814186750 WSLJELFTOFSBCW-KDOFPFPSSA-N 490.586 1.443 10 20 JDCD Cc1nc[nH]c1C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189053 KJIONZVMRMSUBP-KDOFPFPSSA-N 458.569 1.293 10 20 JDCD Cn1c(=O)n(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c2ccccc21 1817845734 VQKNASDNCSRDAS-INIZCTEOSA-N 491.508 1.875 10 20 JDCD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)nc2nccn12 1821481449 YAXWTEGFYWDNJL-OAHLLOKOSA-N 498.594 1.927 10 20 JDCD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)n1cccn1 1822807302 MCQCDSLTERLQFU-TZMCWYRMSA-N 461.573 1.720 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)CCc2cn[nH]c2)CC1 1825189690 HVCKQLCDZXEHQZ-QGZVFWFLSA-N 463.629 1.822 10 20 JDCD COC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1826506807 QMYMSMVAOVLDMT-VIFPVBQESA-N 454.892 1.790 10 20 JDCD CN[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C(=O)O 1826945845 DMNGQFPWKXGUJH-NKXVPCSKSA-N 475.542 1.499 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn3ccnc13)CC2 1828244315 AOBWRXOVUFEGAN-NSHDSACASA-N 486.604 1.877 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ncc[nH]1)CC2 1828250599 WJILTCYIJVJSHM-SNVBAGLBSA-N 464.598 1.271 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1829165043 UPQWNSKXZAPBHH-ZDUSSCGKSA-N 480.572 1.412 10 20 JDCD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1832138103 IQLPESFBPHQVBF-WOJBJXKFSA-N 484.557 1.197 10 20 JDCD Cc1cc(C)n(CC(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)n1 1834986038 VYXPFGDQBKUIIQ-UHFFFAOYSA-N 456.547 1.192 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1c[nH]c2ncccc12 1835318296 GYSUAZMILJMXLK-UHFFFAOYSA-N 464.526 1.868 10 20 JDCD COc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cc(O)nc(O)c5)C4)C3)cc2c1 1836818728 PGADRUMXIMEVKH-DEOSSOPVSA-N 483.477 1.631 10 20 JDCD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)n1cccc1 1840355521 HNNFOHMPMHVHPU-WSVYAWPASA-N 471.510 1.336 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1 1840879812 HBFKHIMCVNQHJA-BSBODGDASA-N 488.562 1.967 10 20 JDCD CC(C)(C)OC(=O)N1CC(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)C1 1843842720 JQJMWJHWMIRBLS-SOFGYWHQSA-N 473.526 1.887 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3C[C@@H](O)CN3C(=O)c3ccc(F)cc3)CC2)cc1 725954896 XEXMPCZOMVAHHI-IRLDBZIGSA-N 485.512 1.302 10 20 JDCD O=C([C@@H]1CN(C(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc2O1)N1CCCCC1 728221777 XBAPDMWTHXCBCP-IBGZPJMESA-N 456.524 1.291 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)N3CCN(C(=O)c4ccc(O)cc4)CC3)CC2)cc1 743363692 VXERXFXHPRTBRV-UHFFFAOYSA-N 467.570 1.690 10 20 JDCD CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 751346137 OGSNEXCZPOQFPD-KRWDZBQOSA-N 455.602 1.848 10 20 JDCD CC(=O)N1CCc2cc(S(=O)(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)ccc21 917929939 JVLWILLEINOXNU-LJQANCHMSA-N 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10 20 JDCD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)C1CC1 1796136999 RLZGAVHKVFRDMX-DLRJPAPCSA-N 490.557 1.389 10 20 JDCD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1797587384 LCGJBZBQJPXNJF-MHXAIHSWSA-N 484.553 1.362 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cnc(Cl)c(Cl)c1 1798074984 HICFCOJNDXRRGU-DRXBFXEBSA-N 453.282 1.712 10 20 JDCD C[C@@H](Cc1ccncc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802079742 VORFLDFWLFMTPF-GYTKACBSSA-N 467.522 1.680 10 20 JDCD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)n(C)n1 1805646715 SXAWHVCXFYNJRD-KXBFYZLASA-N 472.596 1.303 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994680 AGRXHWASWDLIMF-MGPUTAFESA-N 459.466 1.564 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1808000246 ZNQRNNPPCQUOAW-UGSOOPFHSA-N 455.500 1.118 10 20 JDCD 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Cc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1 1840666151 HXTCJTBITHYHJO-QFIPXVFZSA-N 477.608 1.234 10 20 JDCD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CN2C(=O)CSC2=S)CCO3)s1 1840895823 OTUDUFZQQWXINK-NRFANRHFSA-N 497.664 1.306 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1 1845042824 UGJDUSGMVIHXKQ-INIZCTEOSA-N 498.424 1.546 10 20 JDCD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(S(=O)(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1 109984547 ZNWNVRYPMXXWNG-IBGZPJMESA-N 479.624 1.677 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCc3ccc([C@@]4(C)NC(=O)NC4=O)cc3)CC2)cc1 726249374 WHJMQELLDLXNGU-RUZDIDTESA-N 480.569 1.371 10 20 JDCD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)C3CC(=O)NC(=O)C3)c2C)c1 726819635 BYLCMPZBTOOYGV-UHFFFAOYSA-N 484.461 1.446 10 20 JDCD Cc1cc(CC(=O)N[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 728700155 YEDSQJULJLXNKT-LEWJYISDSA-N 466.003 1.904 10 20 JDCD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)N3CCCN(C)CC3)c2)c1 729061517 GPOVQQOJSJNPAP-MRXNPFEDSA-N 490.582 1.543 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 918285057 VOBRPVALJUVBFH-UHFFFAOYSA-N 471.457 1.914 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(N4CCCS4(=O)=O)c3)cc2)C1 918465627 QDVUNVYFSKWLBP-SFHVURJKSA-N 499.593 1.183 10 20 JDCD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)CN3CCS(=O)(=O)CC3)c2C)cc1 919136890 ROPGMSPGHAOXQE-UHFFFAOYSA-N 462.524 1.337 10 20 JDCD CCNS(=O)(=O)c1ccc(F)c(C(=O)OCc2cc(O)n3ncc(C(=O)OCC)c3n2)c1 919412795 QXJZPCXTUVCCPA-UHFFFAOYSA-N 466.447 1.406 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CCCC3)C2)c1cc(O)nc(O)c1 1777848135 KHCAIVZNFJEJQD-UZUQRXQVSA-N 455.515 1.536 10 20 JDCD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1779013052 ZKKATTLNPOKHHO-CKUSHTOWSA-N 495.532 1.676 10 20 JDCD O=C(CCN1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1792312290 KNJGRTJNSJLKDT-VCOUNFBDSA-N 467.570 1.245 10 20 JDCD O=C1CC[C@H](C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)CN1 1792314795 XURSFBFVQJEULL-ZDUSSCGKSA-N 460.581 1.507 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2)C1=NN(c2ccccc2)C(=O)C1 1796479760 QPUCAPPQJRAXNE-FAQVEIGNSA-N 472.505 1.559 10 20 JDCD COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796480823 VTGYJEGPFCCNOD-HBNMSFMJSA-N 491.548 1.405 10 20 JDCD O=C1Nc2c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C3=NN(c4ccccc4)C(=O)C3)cccc2C1=O 1796934473 IMVJGVGCZBYDCI-ACHSLPGTSA-N 485.500 1.866 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cccnn2n1)C1=NN(c2ccccc2)C(=O)C1 1799103228 MAMRYZRZNYEXSR-VBUUOAMHSA-N 457.494 1.774 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1 1799360158 MLMBRLUHMVUPCN-GPZMKHAHSA-N 467.316 1.334 10 20 JDCD CCN1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1802174105 LLAULPNKZZFNDU-NURUXFMTSA-N 459.543 1.138 10 20 JDCD O=C1CC[C@@H](C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)N1 1806639645 ONFRQDITGYDPCU-KFQVLHAWSA-N 466.494 1.196 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996495 TXJJVDGITTVCEY-BTYIYWSLSA-N 459.466 1.564 10 20 JDCD O=C1Nc2c(C(=O)NC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)[C@H]3c3cccnc3)cccc2C1=O 1810028558 VNGLIMGGSSSZAN-QKKBWIMNSA-N 487.472 1.656 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC2(CCN(C(=O)C(O)O)CC2)C1 1810800716 CFBNTGMFFLYDDO-LJQANCHMSA-N 490.601 1.247 10 20 JDCD CS(=O)(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1813577071 JYEAKENHTFAJKJ-AUUYWEPGSA-N 481.958 1.901 10 20 JDCD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1F 1814186752 WSLJELFTOFSBCW-KSSFIOAISA-N 490.586 1.443 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(O)[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818147362 YTNBJCHTXQIPHO-QGZVFWFLSA-N 462.470 1.937 10 20 JDCD O=C(COc1ccc(O)nn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1821664311 JDPVSKOLKJGEFX-ZDUSSCGKSA-N 455.431 1.096 10 20 JDCD CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)nn1 1821754507 SEACPOZWFQEMPD-NSHDSACASA-N 456.484 1.678 10 20 JDCD CC(=O)C[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1822341075 FVKFSYBAKONIPR-RISCZKNCSA-N 451.574 1.877 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1 1823477052 YNCQXAFRUVIEPJ-KEDPEKRHSA-N 471.470 1.684 10 20 JDCD CC(=O)N[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1)C(C)(C)C 1823497392 VQUNCZYZGKLQAF-KSSFIOAISA-N 494.643 1.813 10 20 JDCD Cn1ncnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1825722806 SGAUSBDRVCQHFH-JKNJVXJCSA-N 455.515 1.879 10 20 JDCD C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195518 PBJKPQGUEWKYGU-NILIMZSLSA-N 495.579 1.566 10 20 JDCD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1831157467 MJEMIFWFRUJJEK-QMHKHESXSA-N 473.551 1.744 10 20 JDCD O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)N1 1832877506 OYEJEILYPJMAPT-LUUOPXGJSA-N 457.527 1.715 10 20 JDCD CN(C)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1833665293 JZALGIJPHPEAMR-HSZRJFAPSA-N 490.944 1.596 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)c1ccno1 1834183802 KGEMTJUIIQJIDC-UHFFFAOYSA-N 464.526 1.653 10 20 JDCD O=C(Cn1cc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1835976575 LSKPQBJPENVOFT-FQEVSTJZSA-N 485.324 1.371 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cnn2cccc(F)c12 1836498273 JYTXUCSDLMKLBO-UHFFFAOYSA-N 482.516 1.779 10 20 JDCD CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1838066693 NRDXNVLHTXWDMY-HXUWFJFHSA-N 498.584 1.225 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3cccnc3)cc1)CCO2 1839247193 WOAVLTTVWXVAER-SANMLTNESA-N 490.516 1.939 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ncn(C)n4)C3)C2)cc1 1839348723 IKFGNDZZZZTYPO-VWLOTQADSA-N 478.553 1.606 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)cn1C 1839434109 NQIGOPPCULQALN-QFIPXVFZSA-N 463.918 1.782 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2 1840580518 GTYPDCCKKZFHLH-OUWGLZAPSA-N 464.540 1.169 10 20 JDCD CC(C)(C)OC(=O)NCC1(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)CC1 1841095498 PHJPPWTVTSPEMS-UHFFFAOYSA-N 482.628 1.355 10 20 JDCD CCN(C)C(=O)Cn1c(=CC(=O)C(C)(C)C)sc(=Cc2ccc(N3CCOCC3)c(F)c2)c1=O 727464587 MCTHKYQHUOFGPM-UHFFFAOYSA-N 489.613 1.588 10 20 JDCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 727613349 UVQGWMSZMLSQKW-UHFFFAOYSA-N 467.494 1.802 10 20 JDCD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NCc1ccccc1O 748349635 JADOKZISNPZNQG-UHFFFAOYSA-N 465.959 1.975 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](CN3CCN(c4ccccn4)CC3)C2)c1 748358231 QAVYLTXDNZIZBU-SFHVURJKSA-N 473.599 1.833 10 20 JDCD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cn1c(=O)oc2cc(S(N)(=O)=O)ccc21 914602906 ILYSBIDJKVOVBG-UHFFFAOYSA-N 458.540 1.891 10 20 JDCD COc1ccc(S(=O)(=O)NCc2ccc(N3CCSCC3)cc2)cc1[C@@]1(C)NC(=O)NC1=O 917912248 OCOAQAFPVZOCEJ-JOCHJYFZSA-N 490.607 1.782 10 20 JDCD CSC[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 918334558 HTIHWSNSAFYKSF-VAMGGRTRSA-N 493.651 1.444 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(S(=O)(=O)NC4CC4)c3)cc2)C1 918465168 HYLBHOWVLVXTLF-KRWDZBQOSA-N 499.593 1.084 10 20 JDCD Cn1c(=O)nc(O)c2c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc(C3CC3)nc21 918645405 SZILNBBWRXVHAC-UHFFFAOYSA-N 483.550 1.076 10 20 JDCD O=C(O)c1cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc2c1OCCO2 919728520 DETFCUGLSBEKET-UHFFFAOYSA-N 452.460 1.610 10 20 JDCD COc1cc(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)ccc1OCC(=O)N(C)C 919815611 PTROZTLQUFHMLS-UHFFFAOYSA-N 451.501 1.169 10 20 JDCD Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(S(=O)(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1C 919986030 GATMYPYRXOXLJJ-IBGZPJMESA-N 479.624 1.677 10 20 JDCD CCN1CCN(c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CC1 920194502 DQBCNFOINSCECI-UHFFFAOYSA-N 451.571 1.920 10 20 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O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1804349629 UKTYBBKRTWFWAM-HNJNHCNJSA-N 487.900 1.064 10 20 JDCD N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cccnc1 1807259629 LSGJAHSLCMEYPN-GWJPWWOOSA-N 462.510 1.693 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)c3cncn3-c3ccncc3)C2)CC1 1807750862 YQIPZLXBUNLDMG-UHFFFAOYSA-N 498.634 1.972 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cccnn2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808466840 AOGFGOAVAYMKCO-WZONZLPQSA-N 469.505 1.984 10 20 JDCD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)c4cc(O)nc(O)c4)[C@H]3c3cccnc3)c(C)n2n1 1809185374 FBCURURQZXKDQR-ZHRRBRCNSA-N 488.508 1.576 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ncccc1F 1811120042 QMJWKSLTFNCPTC-IFXJQAMLSA-N 473.555 1.796 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811619659 IQHMEKSNRLSQCD-FZKQIMNGSA-N 488.551 1.498 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccns2)[C@@H]1c1cccnc1 1814186366 OCJIVYXNVFQMER-SUMWQHHRSA-N 461.594 1.718 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2c(F)cncc2F)[C@@H]1c1cccnc1 1814189269 DFXZDSUAGRYFEN-BFUOFWGJSA-N 491.545 1.935 10 20 JDCD NC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)cc1 1814192718 WTXFGOVXSGEFQI-PXNSSMCTSA-N 497.602 1.360 10 20 JDCD O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1)c1cccnc1 1825089356 PCNNRVUGOAFURS-LJQANCHMSA-N 467.526 1.551 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccccn1)CC2 1828242232 FOXJRBCZRLOCEK-LBPRGKRZSA-N 461.594 1.553 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)C1=COCCC1)CC2 1828250601 WLCWDXBRRWIPAS-NSHDSACASA-N 452.583 1.610 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3snnc3C3CC3)CC2)CC1)c1cc(O)nc(O)c1 1834987055 UEVKEHIMMPVYQR-UHFFFAOYSA-N 472.571 1.721 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1836419049 OLVWLPVFSQCFHX-JOCHJYFZSA-N 487.900 1.406 10 20 JDCD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836419578 MWIKPJWXSCAWRY-UPCLLVRISA-N 473.501 1.581 10 20 JDCD O=C(NCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccco1 1837962253 FVWHBUSXHWELMG-UHFFFAOYSA-N 472.498 1.128 10 20 JDCD COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n1 1839431859 RHYVPUBSVSHUGZ-JOCHJYFZSA-N 477.901 1.539 10 20 JDCD CS(=O)(=O)Cc1ccc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cn1 1843215661 TVOSFOUUYMTSBF-UHFFFAOYSA-N 495.561 1.236 10 20 JDCD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442290 IUYQBSYUDQHUFC-UHFFFAOYSA-N 463.450 1.910 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CCNC(=O)c3[nH]nc4ccccc34)CC2)cc1 110505293 ZTAKVMUUPNRQLH-UHFFFAOYSA-N 465.510 1.583 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCNC(=O)c2cccc(Br)c2)c1 116478156 LBZYJRKBMNTLIM-UHFFFAOYSA-N 456.318 1.686 10 20 JDCD C[C@@H]1COCCN1CCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 729538822 VHBVREGGOUATHM-CQSZACIVSA-N 464.500 1.552 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(S(C)(=O)=O)cc3)CC2)cc1 915744690 RALYKMKIJZHUGT-UHFFFAOYSA-N 474.583 1.366 10 20 JDCD Cc1cc(C(=O)Cn2cnc([N+](=O)[O-])n2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 917254054 FRRCFQJJMFTGRR-UHFFFAOYSA-N 474.499 1.498 10 20 JDCD Cc1cc(C(=O)COC(=O)[C@H](CO)NC(=O)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 917502289 MPBMYIIWWOSCIJ-NRFANRHFSA-N 499.545 1.258 10 20 JDCD CON(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 917832853 IKVAOHQHCQXAMT-GOSISDBHSA-N 460.556 1.500 10 20 JDCD CSc1nc(C)c(CCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(O)n1 918339286 DYDBBWAWEYKAMZ-UHFFFAOYSA-N 450.586 1.696 10 20 JDCD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 919814694 LGHSMHKSCHQQLL-AWEZNQCLSA-N 464.519 1.688 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1 1779501270 IXHJICHYEMHMKU-JOCHJYFZSA-N 468.901 1.366 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2 1782007840 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C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)C[C@@H](C)O1 920867713 XYBFTLISCXNQKC-ZCNNSNEGSA-N 495.646 1.265 10 20 JDCD Cc1nc2ncccn2c1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1777897450 PCXJVOXHLVTYIW-RUZDIDTESA-N 487.520 1.274 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1779421763 LQABIOCGMOOWSY-SFHVURJKSA-N 489.406 1.692 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1cc[n+]([O-])cc1 1779943119 QWTSVKMWZWEDCS-PXDATVDWSA-N 477.521 1.240 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1781052913 CKLFBFJKBONEHU-MVYHEMRASA-N 493.564 1.010 10 20 JDCD C[C@H](Oc1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783245835 HRBPPQFKUJODFY-PRCFCKQXSA-N 491.635 1.828 10 20 JDCD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)c(O)n1 1783248261 XVLQDVNPEUGCJW-QVKFZJNVSA-N 478.596 1.083 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1785505966 VOCNTNHBNCBSJD-UUCGHWEQSA-N 465.466 1.003 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)COc1ccccc1)CCO2 1785509511 RYZKRZZFVJHPAE-RXVLNYDTSA-N 454.479 1.726 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21)c1cc(O)nc(O)c1 1787291826 GSCCXGNFOXSVDZ-NUTKFTJISA-N 471.901 1.701 10 20 JDCD CN1CCN(CCC(=O)Nc2ccc(C3(NC(=O)c4cc(O)nc(O)c4)CCC3)cc2)CC1 1787909821 SDURUMJUNCMRBS-UHFFFAOYSA-N 453.543 1.878 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3F)C[C@@H]21 1792239951 PINCBCJIGRZZLL-WHOFXGATSA-N 469.535 1.418 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)[C@H]1CC(c2ccccc2)=NO1 1793282785 IXHSXWYRCFUAHN-CQMQNPFBSA-N 493.516 1.599 10 20 JDCD NC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1ccccc1 1795675845 SFFRIOOLWUZGBE-AXVVYFOYSA-N 459.930 1.697 10 20 JDCD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796136013 GEJZMIOXULTBDI-KYFSNAEOSA-N 490.557 1.486 10 20 JDCD Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cc1 1796482512 DEVGFABTDZAXCR-BBIADKPPSA-N 474.517 1.560 10 20 JDCD COc1nn(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767546 XNPCWKYPMJDLDK-DRXBFXEBSA-N 450.879 1.010 10 20 JDCD C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801323388 ZEZBEFZDXVAOAJ-FCMNNSAISA-N 485.562 1.982 10 20 JDCD CN(C)c1ncc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)o1 1805347722 ZJOOBHYZGQQOHV-KBXCAEBGSA-N 488.595 1.316 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1ccncc1 1805481613 DABBHPBKZDDKMK-APWZRJJASA-N 455.565 1.657 10 20 JDCD CC(=O)N(C)CCC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1806560395 HWXMHPGZHRVVOO-UHFFFAOYSA-N 467.570 1.879 10 20 JDCD Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)n1 1807513949 QQEQDOMUNSOMIU-CLOONOSVSA-N 485.548 1.857 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC2(CCCN(C(=O)c3ccc(O)nn3)C2)CC1 1807946085 CTICDJZALPKVQT-UHFFFAOYSA-N 462.510 1.820 10 20 JDCD COc1ccc([C@H](O)C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cc1 1807992238 MJKLOTGHDBHMTF-IMRHEYAYSA-N 478.505 1.950 10 20 JDCD C/C(=C/C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)C(=O)O 1808470575 XFALVKLOVQGRLC-AZAXHVJKSA-N 475.505 1.911 10 20 JDCD O=C1C[C@H](C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)CCN1 1813137809 CQQIVMRFFNRJCC-PVQBSWBJSA-N 480.521 1.444 10 20 JDCD C[C@]1(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)CC1(F)F 1814081788 XUXWVEQPQQQTDJ-VVFCZOMOSA-N 468.551 1.993 10 20 JDCD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)o1 1814162986 UDQSUXRMFQHWNL-CJOSSSAMSA-N 479.493 1.852 10 20 JDCD CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814165091 BVAXUBXVFAFOKB-VFGASAJRSA-N 468.510 1.442 10 20 JDCD COCCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)n1 1816725151 LGAGZGQGBVRSIU-LBPRGKRZSA-N 458.500 1.332 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)N1CCOCC1)CC2)c1cc(O)c(O)c(Cl)c1 1823711106 VLFVPWKDNVPZSJ-WLRWDXFRSA-N 482.946 1.084 10 20 JDCD CC[C@H](C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1831051039 JTBSMCUEVDPGSO-UUOWRZLLSA-N 456.543 1.672 10 20 JDCD NC(=O)[C@@H](N)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1832877682 YPHYCIZIVVLFBZ-FPONKKPDSA-N 474.558 1.029 10 20 JDCD O=C(Cc1ncccn1)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1833877713 ZGSZEAUBKNDKIT-UHFFFAOYSA-N 473.961 1.969 10 20 JDCD CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834015859 VFHFYXBYZTYFPN-UHFFFAOYSA-N 468.558 1.453 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1ccc(O)nn1 1834071661 ZSBUHSNOEGTLRX-UHFFFAOYSA-N 475.933 1.746 10 20 JDCD Cc1ncncc1C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132760 LAPYCGIIXMGMRW-UHFFFAOYSA-N 489.580 1.763 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)c1ccc(Cl)o1 1835268733 GUHFDLZAQVBDAT-UHFFFAOYSA-N 485.031 1.979 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2 1835291494 RWRJCSPMEGGFCX-WMZHIEFXSA-N 476.913 1.555 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cnc2ccccn12 1835347980 HQMLNMAXTNJKHK-UHFFFAOYSA-N 464.526 1.640 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncsc34)C2)C1 1836418356 PLVFUZJZTUSSFM-QFIPXVFZSA-N 470.507 1.486 10 20 JDCD O=C(C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)C1CC1 1836688918 QWTITCYFQWVWFC-GQCTYLIASA-N 458.511 1.794 10 20 JDCD COc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837295720 QSFOQDSLOIALDG-HWKANZROSA-N 498.536 1.928 10 20 JDCD Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1838031718 HIQHKHFOQFFOMH-INIZCTEOSA-N 457.531 1.871 10 20 JDCD Cc1n[nH]c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433323 RHTMRLKZICRRLT-QFIPXVFZSA-N 478.933 1.404 10 20 JDCD Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1 1840699734 WOUMAYGDAKKNIW-OAQYLSRUSA-N 498.026 1.579 10 20 JDCD COc1ccc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840881231 JQIOMISHDVLDFS-OZJHFHSKSA-N 498.532 1.904 10 20 JDCD CC(C)n1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)n1 1840881292 NPQNDFGXOLYYPE-WUQPGSQJSA-N 486.525 1.364 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)Cl)C2)C1 1840881414 SYWZRHPJJRYZHZ-ROVVAWJSSA-N 462.833 1.105 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(-n4cncn4)c(Cl)c3)CC2)cc1 750361400 LFVYGSBRAWTZKG-UHFFFAOYSA-N 483.960 1.806 10 20 JDCD COc1ccc(N2CCN(CCCN/C(C)=C3\C(=O)NC(=S)N(CC(C)C)C3=O)CC2)cc1 814397920 FNYAAHPPDHDQOT-DYTRJAOYSA-N 473.643 1.970 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C(=O)c4ccco4)CC3)CC2)cc1 916196352 BXHUMRXTECPBDH-UHFFFAOYSA-N 455.559 1.968 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)CN3C(=O)c4ccccc4S3(=O)=O)cc2F)C[C@@H](C)O1 918633330 MXJILNXGNRGWJS-GASCZTMLSA-N 461.515 1.900 10 20 JDCD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920881692 XDRNRQLMYSOBMJ-KRWDZBQOSA-N 455.559 1.974 10 20 JDCD Cn1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c(C(F)(F)F)n1 1779543132 MHTWRJDTIJTXOX-LAEWNIMASA-N 496.442 1.713 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1782940866 UJIYAXMROMGZSC-RUZDIDTESA-N 496.564 1.543 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)F)C2 1783245508 YVPVQIJZQKDYJH-QLJPJBMISA-N 471.498 1.261 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(O)cc4)CC3)[C@H]2C1 1784141963 BFNZIACYOZEAES-WBAXXEDZSA-N 489.619 1.264 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc(CO)c(F)c1)CCO2 1785511845 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1[nH]cc2c1CCC2 1789165183 YUYCNVPRVLPWGB-AXQFQNRHSA-N 467.522 1.927 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cn[nH]c4cn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790244836 CXXXOJJVBKPEEH-KLRAXDNASA-N 471.901 1.930 10 20 JDCD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790245004 LJDINNCCOMFNHR-GWIFVGGISA-N 451.907 1.035 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C[C@@H]21 1792239168 QVYSQRVHUOSBJE-DEYYWGMASA-N 485.591 1.083 10 20 JDCD Cc1nccn1[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796482729 UICAEQUUWXOVKD-YDGKCNFYSA-N 464.526 1.135 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1c[nH]c2cnccc12 1797565993 SKJXQLFPCKCVMI-GAKFLWOGSA-N 464.478 1.596 10 20 JDCD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)c(O)c(Cl)c1 1800718786 FMRZTUCLKYKWJF-NOVWEMISSA-N 475.933 1.474 10 20 JDCD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1802078985 NYPDVPJWSLGWBX-XWSCZXBVSA-N 455.467 1.124 10 20 JDCD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN2C(=O)CSC2=S)cc1F 1802105454 XSFZEGDNVQALMB-ZSBFGKGUSA-N 451.545 1.198 10 20 JDCD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)C(=O)c1ccccc1 1804334536 NXTMKKZOYKMZQV-BJWYYQGGSA-N 474.608 1.257 10 20 JDCD C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340372 KYLLEAPGRYDGFY-MXASKKJJSA-N 474.608 1.303 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cnnc(Cl)c1 1804728766 ANNMWYNBXDOKBD-ACJLOTCBSA-N 490.998 1.705 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC[C@@H](CNC(=O)CN)[C@H]1c1cccnc1 1807033026 RJEHVYJKTPMOTO-XKCSPQBFSA-N 496.612 1.764 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992598 OTTHKYNMTWFMEY-HRAATJIYSA-N 457.556 1.256 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995702 TWPTWZPQAYTVIU-BFUOFWGJSA-N 477.506 1.921 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cc(O)ccc1O 1811901091 QECCDEFLMBIBLT-LHSJRXKWSA-N 450.451 1.932 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cnn2cccnc12 1819021772 DRFIMGZRZRRVAS-AWEZNQCLSA-N 484.567 1.619 10 20 JDCD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)n1ccccc1=O 1819576075 IOMAKQHJXUWURF-ZFWWWQNUSA-N 488.595 1.685 10 20 JDCD COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)CC3)CC1 1825276224 VCLRRKKQRBWXJV-ZDUSSCGKSA-N 481.534 1.801 10 20 JDCD O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827716448 MPDMSZJTGDZTBH-HXUWFJFHSA-N 492.536 1.914 10 20 JDCD Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)/C=C/c4ccc(O)c(O)c4O)sc3C2)cccc1=O 1828195812 WSNBAXMOXSWNOP-BCRSCGJKSA-N 482.518 1.898 10 20 JDCD CCOC(=O)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1831255329 KQZKXCDUTXPICJ-MRXNPFEDSA-N 481.640 1.810 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)c1ccc(=O)oc1 1834341400 PCTPRUVYVYCPBK-UHFFFAOYSA-N 491.548 1.618 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(Cl)ccc(Cl)c3O)C2)C1 1836418841 AXWUNBQNKHFPAZ-NRFANRHFSA-N 498.319 1.889 10 20 JDCD CC(C)O[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1837601730 GKTTXIHQFGTWCO-LHSJRXKWSA-N 456.923 1.635 10 20 JDCD O=C(/C=C/c1cnccn1)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1838811628 UCBUKGPNXKTUPP-OWOJBTEDSA-N 489.623 1.349 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1 1840880163 ZHSXDFQGSNPGCW-ZQCVDQNESA-N 498.532 1.671 10 20 JDCD CC(=O)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1842611094 YUFDWLJBMXXRMU-INIZCTEOSA-N 461.515 1.326 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CNC(=O)O1)C2 1843330591 HUGBKUDCMYYDLP-MSOLQXFVSA-N 487.557 1.016 10 20 JDCD Cc1cc(C(=O)COC(=O)c2ccc(OCC(N)=O)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 18822594 QIGXAUOFEIFHTA-UHFFFAOYSA-N 485.518 1.645 10 20 JDCD Cc1cc(C(=O)COC(=O)CN(C)c2ncccn2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 43766239 UJIWAKYKJSVFAH-UHFFFAOYSA-N 457.512 1.394 10 20 JDCD O=C1CCc2cc(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c(F)cc2N1 726976733 OCQHVXHECLKINM-UHFFFAOYSA-N 467.544 1.424 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCNC(=O)Cc3cccc(F)c3)cc2)C1 749015502 ZMKVPCUJGDLQDP-IBGZPJMESA-N 455.534 1.686 10 20 JDCD Cc1cc(CC(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1-c1ccc(Cl)cc1 749985362 JHOAADHVSGSTLD-UHFFFAOYSA-N 458.902 1.696 10 20 JDCD COCCS(=O)(=O)CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 915556713 FDDJRUKPXLMZAJ-ZDUSSCGKSA-N 459.476 1.393 10 20 JDCD COc1ccc(C(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284840 RGSGOJWTJXRNNT-UHFFFAOYSA-N 458.490 1.628 10 20 JDCD CSCC[C@H](NC(=O)c1ccco1)C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918339035 APMHCDUIZDVXSO-SFHVURJKSA-N 465.597 1.682 10 20 JDCD CCN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)N(C)Cc3ccccc3O)c2)CC1 918444993 ZCNZZWPRJOGXDR-UHFFFAOYSA-N 460.556 1.316 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(S(=O)(=O)N(C)C)ccc3F)nc12 918960139 INYPEDDPZSSOLQ-UHFFFAOYSA-N 466.447 1.358 10 20 JDCD O=C(COC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)NCc1ccc(N2CCOCC2)c(F)c1 919093218 KIPOVTIDDYRHQC-AWEZNQCLSA-N 461.412 1.233 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c1 919808727 GLSKVQDMEOJORC-UHFFFAOYSA-N 467.569 1.868 10 20 JDCD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCc1ccc(N2CCOCC2)cc1 919859643 DEIQBLZPVSTIFM-UHFFFAOYSA-N 465.597 1.465 10 20 JDCD C[C@@H](NS(=O)(=O)CCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccc(N2CCOCC2)cc1 920866093 WDBLBFIFFILKMI-QGZVFWFLSA-N 485.603 1.963 10 20 JDCD CC1=c2c(nc3n(c2=O)CCC3)=S=C1c1nnc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 1326139818 CALOBWGBLHLVRZ-UHFFFAOYSA-N 483.575 1.413 10 20 JDCD CCc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN2C(=O)CSC2=S)C3)c1 1777782010 BFSUFXUVTMOCPT-VGOFRKELSA-N 476.624 1.632 10 20 JDCD 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COCCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)n1 1804286611 XAJDLDXZSLZLJH-ZURAMSNBSA-N 456.499 1.612 10 20 JDCD Cn1c(=O)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)nc2ccccc21 1804333653 VYBLUJHHHWNOLV-BTTYYORXSA-N 485.591 1.046 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H]1Cc2ccccc2CN1 1804333862 VKWFGFHIJMHAEK-XMTFNYHQSA-N 458.609 1.199 10 20 JDCD O=C(O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ncn1 1804965053 CZEFLVMZBKMNNF-YJYMSZOUSA-N 464.438 1.009 10 20 JDCD O=C1CC[C@@H](C(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)N1 1806637835 UEJJCNGMDVHITF-FHJLPGHOSA-N 474.521 1.159 10 20 JDCD CN(C)CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1806892922 GZYRZKUHTFNDMQ-DVECYGJZSA-N 462.554 1.832 10 20 JDCD O=C(NCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cccnc1 1807992799 BQHUHXYTQVEGIY-ZHRRBRCNSA-N 476.493 1.032 10 20 JDCD CC(=O)C[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189185 BQBGAWVZMCKSKQ-IYJAJMOOSA-N 462.597 1.563 10 20 JDCD Cn1nncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1816038206 NPLHKKIVASSKSF-OWNNVSBGSA-N 453.459 1.674 10 20 JDCD O=C(Cn1ccccc1=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362275 JTQXCUSXDSESQW-OAHLLOKOSA-N 490.545 1.710 10 20 JDCD O=C(CCn1ccnn1)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817366773 FZLZEOVKKQBDBB-CQSZACIVSA-N 478.538 1.530 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1)c1cc(O)nc(O)c1 1819447621 GLPHLGDHCMEHIM-NSHDSACASA-N 451.468 1.760 10 20 JDCD CC[S@@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1819522045 MZOHPVOXPRSSMI-XUQHIXODSA-N 474.655 1.074 10 20 JDCD CCc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)nn1C 1819991565 HLJYHTFPAIXSHR-OAHLLOKOSA-N 475.600 1.872 10 20 JDCD COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1820201396 QLAADLJMSUAABS-SMDDNHRTSA-N 482.946 1.585 10 20 JDCD O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1824482674 AOCBSZDRPOJPPQ-LBPRGKRZSA-N 456.484 1.304 10 20 JDCD Cc1nccn1CCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1826703735 FXJRPCHEAUPKOF-ZDUSSCGKSA-N 492.652 1.901 10 20 JDCD O=C1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)N1 1827715761 ROWXTELILFWOJK-CTNGQTDRSA-N 465.554 1.678 10 20 JDCD Cc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)n1 1828240156 OGTPLUWFBAOSSE-NSHDSACASA-N 461.594 1.933 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H]2CCC(=O)N2)CCO3)cc1 1835123918 JKDGECFJPGYPBI-NVQXNPDNSA-N 480.565 1.443 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(COCCN(C(=O)c3cnccc3F)C2)C1 1836526624 ZKRYMUWDHNIAMB-DEOSSOPVSA-N 481.484 1.084 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ncsc1Br)CCO2 1836529146 RMWNUWVTSKCIRT-GOSISDBHSA-N 499.343 1.096 10 20 JDCD COc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)n1 1837350070 JNYCGNLMLJKLPZ-UHFFFAOYSA-N 456.499 1.822 10 20 JDCD COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)CC1 1838111551 BMYOTOLGLSTLDN-UHFFFAOYSA-N 496.564 1.731 10 20 JDCD CCCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)cc1 1839012580 IXECIUZQIOSSBI-DEOSSOPVSA-N 471.510 1.665 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@]1(F)Cl)CCO2 1840247745 HYMYPWAGUROBQD-ZUSMLRIVSA-N 463.289 1.746 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)C3CCC(CO)CC3)C2)C1 1840879814 HEFJTXACDNHLTG-NXYGIASQSA-N 490.553 1.072 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccnc3c(O)cccc23)C1 1845703828 OFAJLFBFKSEWIX-UHFFFAOYSA-N 456.549 1.618 10 20 JDCD CCN(C(=O)COC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)[C@H]1CCS(=O)(=O)C1 10959520 NSNZFUAGKWVHKZ-ZDUSSCGKSA-N 470.503 1.237 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CSc3ccc(S(N)(=O)=O)cc3)CC2)cc1 747283815 AJRQHBYWXGGEAF-UHFFFAOYSA-N 479.580 1.327 10 20 JDCD CCOC(=O)c1cnn(-c2cc(C)cc(C)c2)c1N/C=C1\C(=O)NC(=S)N(CCOC)C1=O 747828772 XBBDVDAMXKASPP-GZTJUZNOSA-N 471.539 1.851 10 20 JDCD CNC(=O)c1sc2[nH]c(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)nc(=O)c2c1C 824035937 GILWEDKUYXFYKB-UHFFFAOYSA-N 455.540 1.553 10 20 JDCD CCO[C@@H](C)C(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 915501991 SRHHFGZAKYTWFY-PFSWGADMSA-N 466.537 1.701 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3cccc(-n4nnnc4C)c3)CC2)cc1 915744984 YABXXTMKVZLMMA-UHFFFAOYSA-N 478.557 1.246 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)NCc3ccc(S(N)(=O)=O)s3)CC2)cc1 915906159 NQFZFZRCLKIZTK-UHFFFAOYSA-N 467.617 1.416 10 20 JDCD O=C(CN1CCC(C(=O)NCC(F)(F)F)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917007584 AEGCBPGJNSZSDM-UHFFFAOYSA-N 460.472 1.669 10 20 JDCD COc1cccc(/C=C(\C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n2nnnc2C)c1 920738907 ITCOYKQKKXZUOZ-PXLXIMEGSA-N 482.566 1.539 10 20 JDCD Cc1c(F)ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1N 1777847817 APSUEQNNWQBDAS-UZUQRXQVSA-N 458.490 1.964 10 20 JDCD Cn1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1Cl 1778127347 ICRFBSMLIDMTKP-NTKDMRAZSA-N 498.971 1.994 10 20 JDCD CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN2C(=O)CSC2=S)C3)cc1C 1779835950 UOXPBUDKWHUNBW-IIBYNOLFSA-N 479.628 1.199 10 20 JDCD CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN2C(=O)CSC2=S)C3)CC1 1783301086 XDKBQMHPEIZXJJ-VGOFRKELSA-N 482.672 1.093 10 20 JDCD COc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1783776867 SWGKXMGUBWKAHD-BCTDBEARSA-N 498.532 1.884 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1785506257 WWJNPFDYSKHARP-LHXJMTLCSA-N 457.508 1.644 10 20 JDCD O=C(C[C@H]1OCCc2ccccc21)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785539780 PBBNZGPTRWOYSQ-WZONZLPQSA-N 489.619 1.381 10 20 JDCD COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(C)c1 1785545956 CLROUNYMYSHGGE-QFIPXVFZSA-N 491.591 1.085 10 20 JDCD CN1CCC(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1792605983 PNRLSWUQNVKKAG-CWPLJXCYSA-N 451.951 1.686 10 20 JDCD CCS(=O)(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1793320259 QGXFSAGQCWLWMR-JHDGKUDLSA-N 473.595 1.732 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2)c1cc(O)nc(O)c1 1796137416 GVUQEJDQHSKDFR-DBWKPXFBSA-N 457.874 1.311 10 20 JDCD C[C@@H](Nc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770802 ISKXFBJTFPJJRL-NFWAQSGPSA-N 460.918 1.850 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1nc2ccc(F)cn2n1 1800134504 ZHSVOFZSUFMJTE-DPIQGUFMSA-N 475.864 1.450 10 20 JDCD O=C(Cc1ccc2c(c1)CCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1800688221 GKVGHGRLEHDRIO-ZJZZYZHZSA-N 488.544 1.547 10 20 JDCD O=C(CCc1cccc(O)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801126528 LIPBJMWZUJLBTJ-IGDSGAALSA-N 468.506 1.745 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2 1802079717 SYWXPAQXFGZYFY-PQUZVILCSA-N 458.442 1.565 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1F)C2 1802080457 OHWBHAXRJDTSEM-OQSDGASISA-N 460.433 1.998 10 20 JDCD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CC1 1802572842 FXCJYHXTVIQSFI-XLIONFOSSA-N 475.640 1.290 10 20 JDCD CS(=O)(=O)c1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cc(O)nc(O)c4)CC3)C2)c1 1807478685 BNBYZTAMKAJFSX-UHFFFAOYSA-N 474.539 1.450 10 20 JDCD CN1CCN(CC(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)CC1 1809604014 TYMOBJPUUGOAOL-VGOFRKELSA-N 487.988 1.713 10 20 JDCD C[C@H](Oc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813443422 MBRISQOWDMOJGW-LUQKVYGDSA-N 499.618 1.810 10 20 JDCD COCC1(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CC1 1814184749 FJLZFDPWKZSTIW-CRAIPNDOSA-N 462.597 1.374 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C2CCOCC2)[C@H]1c1cccnc1 1814186577 SOGKUGQOCXYNHJ-APWZRJJASA-N 462.597 1.374 10 20 JDCD 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COc1ccc(N2CCN(CCCNC(=O)CNS(=O)(=O)c3ccc4c(c3)COC4)CC2)cc1 726374667 JNFCWQYYSSKTPV-UHFFFAOYSA-N 488.610 1.332 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cc(C(=O)N(C)C)ccc3OC)CC2)cc1 743433022 VGJBZOHLWXQNOL-UHFFFAOYSA-N 483.569 1.283 10 20 JDCD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NCc1ccc(N(C)C)c(F)c1 746864620 NBTBTUFSJPKYFP-GOSISDBHSA-N 465.547 1.750 10 20 JDCD Cc1cc(C(=O)CN2CCN(C(=O)C(=O)N3CCOCC3)CC2)c(C)n1-c1cccc(F)c1 765864520 CTRIPZAOHHUSJP-UHFFFAOYSA-N 456.518 1.419 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CNS(=O)(=O)c3cccc(F)c3)CC2)cc1 786575338 KOJHXYPIQYWKPN-UHFFFAOYSA-N 465.503 1.005 10 20 JDCD O=C(NC1CC1)C(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916631809 YFCUCLWNBUKTNZ-UHFFFAOYSA-N 483.491 1.174 10 20 JDCD O=C(CN1CCN(S(=O)(=O)Cc2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917004470 UZIOPIRSFCYJFY-UHFFFAOYSA-N 490.601 1.426 10 20 JDCD CNS(=O)(=O)c1ccc(CCC(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 917244046 WJCYBIHAFAUAGU-UHFFFAOYSA-N 475.567 1.428 10 20 JDCD COc1ccc(N2CCCN(S(=O)(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2)cc1 917759769 YNQAKVLEIZTWCX-UHFFFAOYSA-N 453.586 1.847 10 20 JDCD O=C(O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)C1 917918477 RGWILDDQBZCRNA-INIZCTEOSA-N 477.514 1.578 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)c1 919813356 SLOFGPVXXDELMW-UHFFFAOYSA-N 471.532 1.486 10 20 JDCD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895413 KUTDRJHSAZJJKT-UHFFFAOYSA-N 499.637 1.955 10 20 JDCD CN1CCCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1781026412 HOIRHKFHGXTILT-RDPSFJRHSA-N 453.543 1.094 10 20 JDCD CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)c(O)c(Cl)c2)C1 1781119626 RDXWYHYTWBCQIL-AQOAWAETSA-N 467.950 1.793 10 20 JDCD Cc1ccc2nc(C(=O)N3CCO[C@]4(CCN(C(=O)CN5C(=O)CSC5=S)C4)C3)sc2c1 1785537938 DKUVRXNEPHHUIU-NRFANRHFSA-N 490.632 1.909 10 20 JDCD Cc1cc2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CN5C(=O)CSC5=S)C4)C3)c2[nH]1 1785541374 YTLBSNUHMJSKJZ-JOCHJYFZSA-N 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O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1ccc2c(c1)OCO2 1808990628 SZONJLWRORXLFN-KKSFZXQISA-N 498.586 1.990 10 20 JDCD C[C@H](C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)n1ccnn1 1812400735 PDAYHZHCCIJUDI-IYIFAXMJSA-N 478.509 1.770 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1 1813324794 XEDMNFAIBZMVKP-DDVAMESESA-N 462.510 1.736 10 20 JDCD O=C(CN1CCCC1)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817358401 XDAJSFUHRGDWNR-OAHLLOKOSA-N 466.567 1.944 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)C2CCOCC2)[nH]n1 1823496214 HWRWIUXVHALKAW-CQSZACIVSA-N 451.574 1.689 10 20 JDCD COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828194970 FNEYMUJVKGGYLD-WNPFHQFXSA-N 485.522 1.941 10 20 JDCD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1)n1ccnc1 1828241721 BNXPUADAYFDYIZ-QWRGUYRKSA-N 464.598 1.373 10 20 JDCD CCC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896980 XIXDMLTXBLWJBY-GDBMZVCRSA-N 468.645 1.381 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1834571216 KKEHRNQNBICSMI-SFHVURJKSA-N 488.444 1.352 10 20 JDCD Cc1noc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839431704 HXYDFWJELBMJPQ-OAQYLSRUSA-N 465.890 1.740 10 20 JDCD O=C(c1ccc(F)nc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433761 SKVVBXJPNUOVAP-OAQYLSRUSA-N 465.865 1.669 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C2)C1 1840896882 ABXLNPVGLCVSIZ-IUKKYPGJSA-N 489.619 1.107 10 20 JDCD O=C(NCC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1cccs1 1842064432 SGBNKCBPGIXHJD-UHFFFAOYSA-N 465.535 1.474 10 20 JDCD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)[C@H]2C1 1843251021 OCNICZYNMPRREO-BRWVUGGUSA-N 488.541 1.192 10 20 JDCD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846230490 QAIKJBDQKRKDHI-OYHNWAKOSA-N 476.530 1.070 10 20 JDCD CC[C@]1(C)NC(=O)N(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1=O 9946055 YZTVCMZAPHRIMW-DEOSSOPVSA-N 463.446 1.664 10 20 JDCD COc1ccc(N2CCN(CCCN/C=C3/C(=O)NC(=S)N(CC(C)C)C3=O)CC2)cc1 29003447 UOSISOFAIAUKSQ-HKWRFOASSA-N 459.616 1.580 10 20 JDCD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 726238536 ZGFTWYCHSBWNEZ-SFHVURJKSA-N 475.615 1.786 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCCNS(=O)(=O)c3ccccc3)CC2)cc1 742940609 VWGKUCIARHWSNW-UHFFFAOYSA-N 461.588 1.095 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(N4CCOCC4)CCSC3)cc2)C1 918006426 LEOFJVFVPYEUQP-XXBNENTESA-N 461.632 1.395 10 20 JDCD NS(=O)(=O)c1ccc(NCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 918631867 VLJCWXHWVVKGMH-UHFFFAOYSA-N 481.506 1.336 10 20 JDCD CON(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919971394 VGFXZTICRBAIAT-UHFFFAOYSA-N 451.520 1.899 10 20 JDCD CN1CCN(S(=O)(=O)c2cccc(NC(=O)C(=O)N(C)Cc3ccc(N(C)C)cc3)c2)CC1 920190097 UYTISJZKHFAFHA-UHFFFAOYSA-N 473.599 1.286 10 20 JDCD CN1CC(=O)N(c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)c2)C1=O 920195591 VXTGXXLSLRHEPR-UHFFFAOYSA-N 451.483 1.177 10 20 JDCD CC(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 920638420 ZCEJQIGBJPWHFY-ZDUSSCGKSA-N 499.567 1.634 10 20 JDCD Cc1nc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2 1779905722 VOJBKZQWYYWNPU-QVKFZJNVSA-N 480.587 1.517 10 20 JDCD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)n1ccnn1 1781551046 ZMKRWBHIAPNOJX-QKAVXHIFSA-N 463.922 1.731 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nccn13)C2 1783246308 YTRXASHQGXKFKO-OPAMFIHVSA-N 487.607 1.322 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CNC(N)=O)C2)cc1 1783288643 WHTKRZWTMNIUNM-PXDATVDWSA-N 467.570 1.890 10 20 JDCD COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1784089247 RNAZPXPHJIOLBH-NRFANRHFSA-N 481.571 1.067 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cccc3nc[nH]c13)CCO2 1785508905 KVRCKOUGKAPDCA-COIATFDQSA-N 464.478 1.837 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1785545446 ULPBVDMNRBCTCO-LJQANCHMSA-N 471.963 1.783 10 20 JDCD COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787537379 QUDRJJIJFZDJRT-LRQRDZAKSA-N 477.521 1.476 10 20 JDCD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccc(O)cc1 1799300160 FNULQOGLJXCCAD-OUUWSNIPSA-N 468.506 1.916 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C[C@@](C)(O)CC(=O)O)cc1 1801006875 LQNKNCRETAPPKA-RFRNZTGYSA-N 483.565 1.913 10 20 JDCD COc1c(Cl)ccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802080290 MWLXVBVMZDWAHV-JOFXJVFDSA-N 489.912 1.777 10 20 JDCD CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1803897166 CVCIGUNWQZNVPN-BTYIYWSLSA-N 456.499 1.939 10 20 JDCD CC(C)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1810438072 ZGJFJGRSEUIKKV-ALKREAHSSA-N 464.613 1.761 10 20 JDCD CN1CCC(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)CC1 1814184769 FUGQFQFAEAITFJ-FXAWDEMLSA-N 475.640 1.290 10 20 JDCD CCS(=O)(=O)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1815175293 FPEARLNZSPSLDW-HEWZJLJBSA-N 478.527 1.667 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3C=CCN3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1816998758 AZTQUMVPEAXSDJ-BBRMVZONSA-N 450.524 1.376 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(CO)on1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817361629 AFESQTVACDYYDN-GFCCVEGCSA-N 480.506 1.642 10 20 JDCD Cc1cc2nnc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4cc(O)nc(O)c4)n[nH]3)c(C)n2n1 1817845607 RHYFVRQUJSRMRW-OAHLLOKOSA-N 477.485 1.890 10 20 JDCD O=C1CC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)[nH]n2)=NN1 1819341065 FUXDAHZUCCTIFH-KRWDZBQOSA-N 462.470 1.071 10 20 JDCD CCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1826101854 NFWZEIYOPHDRKL-MRXNPFEDSA-N 463.629 1.997 10 20 JDCD O=C1C[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)CC3)CCN1 1826219809 MSHIWSVPOKDZJS-KGLIPLIRSA-N 480.550 1.374 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@H]2CCCCN2C(=O)Cn2ccnn2)CC1 1827236300 RSRLXTOCXHVNKQ-OAQYLSRUSA-N 463.542 1.691 10 20 JDCD C[C@H](Nc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828244865 USRQQHBZOYSKHJ-NWDGAFQWSA-N 490.636 1.811 10 20 JDCD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1832173109 LNBVLHFURMDNMD-QHCPKHFHSA-N 486.481 1.104 10 20 JDCD COC(=O)C12CC(C(=O)N3CCC([C@@H]4CCCCN4C(=O)CN4C(=O)CSC4=S)CC3)(C1)C2 1832899381 GSFPCPVHCFAPBJ-BPURVQTLSA-N 493.651 1.810 10 20 JDCD CC[S@](=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902050 ILCHMOKUOKNAGZ-JTBPQFFMSA-N 473.686 1.625 10 20 JDCD CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1F 1833740220 DLQLERVKOSUROP-FIYNHDKVSA-N 490.488 1.011 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)C1CCCCC1)CCO2 1834701037 LUEMIQODYDLMTM-UMESLIDUSA-N 460.527 1.853 10 20 JDCD 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470.526 1.605 10 20 JDCD COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C[C@@H]32)C1 1784083232 RZRGKINMXNWBQF-SIXGNSJNSA-N 496.564 1.348 10 20 JDCD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1F 1785539274 LOCZMFOYHXZHNB-FQEVSTJZSA-N 467.544 1.138 10 20 JDCD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CN5C(=O)CSC5=S)C4)C3)c2c1 1785541554 WRNYHZVTVNTZFL-JOCHJYFZSA-N 488.591 1.480 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787540135 IDSBZKSSIVYQAY-LTMIRXACSA-N 494.523 1.977 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21 1792221101 BSLITULZYBMYFY-KPAXDALTSA-N 469.494 1.140 10 20 JDCD CC(C)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(C)C 1795719433 ZHZNSPYQDPTSGG-WTLGNFPFSA-N 453.967 1.977 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2)c1cc(O)c(O)c(Cl)c1 1799767916 AHCXYWNRUXILDH-YVWYUNDQSA-N 483.912 1.849 10 20 JDCD Cc1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CN3C(=O)CSC3=S)C4)ccc2[nH]1 1800117644 RZJAFHRAWZONEH-CWPLJXCYSA-N 472.592 1.540 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@@H]1C[C@H]1C1CC1 1802995373 QQAZESFFYBKYRF-MIALQEHNSA-N 458.609 1.994 10 20 JDCD O=C(/C=C1\C(=O)Nc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804333857 ZQLHLWKJCPYBNI-IPZOXVLMSA-N 470.576 1.521 10 20 JDCD C[C@@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1804356824 MPGNZCAHDBMOBC-MXASKKJJSA-N 474.608 1.303 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807994907 WDNYJJHXCHNYFB-LQBOVUBWSA-N 462.510 1.172 10 20 JDCD Cc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)cn1 1816412597 NFDPJHPJRHARLQ-CQSZACIVSA-N 459.557 1.674 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1819829667 YHAQHYXLUBZJAF-PWSUYJOCSA-N 455.500 1.466 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)c2ccco2)[nH]n1 1823496753 OSFFMLKEKKWACQ-SJCJKPOMSA-N 463.541 1.589 10 20 JDCD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)nc1 1823499007 ZCWVTRVNCFWELZ-HNNXBMFYSA-N 474.568 1.980 10 20 JDCD Cn1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cn1 1823501867 XCCPODPDLMWSIW-AWEZNQCLSA-N 461.573 1.238 10 20 JDCD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1)n1ccnc1 1824316626 MCHGRKREEJZUDC-NVXWUHKLSA-N 463.629 1.924 10 20 JDCD COCc1oncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827920785 UCBLQOGHYHMWPB-MRXNPFEDSA-N 480.612 1.915 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1)CC2 1828249414 HGPJJJNIANDREH-KOLCDFICSA-N 456.640 1.811 10 20 JDCD O=C(c1ccc(CO)o1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901914 VXQBZMDXDCUJSK-MRXNPFEDSA-N 465.597 1.866 10 20 JDCD C[C@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833084520 YYPJTTOCAYZKPV-KRWDZBQOSA-N 482.585 1.683 10 20 JDCD O=C(CNc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1834680663 IEPFKMSVLLGXLI-UHFFFAOYSA-N 471.533 1.929 10 20 JDCD CCOC(=O)O[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987115 CTBQAQXRJVKKBD-AWEZNQCLSA-N 464.519 1.240 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1)c1cc(O)nc(O)c1 1834987981 DVCSRDUBPQATMQ-UHFFFAOYSA-N 472.521 1.731 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c2cc(O)ccc2n1 1836418506 YCXDLRXJRAHYFB-VWLOTQADSA-N 494.504 1.439 10 20 JDCD CC(C)n1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1838026463 QPRVJXYYWVLVET-JIBKAZCMSA-N 486.525 1.364 10 20 JDCD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)C1(O)CCC1 1839432435 OLWUYCYOISKEFJ-SPLOXXLWSA-N 468.934 1.372 10 20 JDCD O=C(c1c[nH]c2nccc-2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839434084 LYZQFGVQBPOIBC-HSZRJFAPSA-N 486.912 1.963 10 20 JDCD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839988279 FZAROELLGQZFIB-JOCHJYFZSA-N 499.948 1.346 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H]2CCNC(=O)C2)CCO3)cc1 1840232292 STCUFNDOKGLMIO-AMGIVPHBSA-N 494.592 1.690 10 20 JDCD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1840298497 WGFJWBIJUUEIJO-OSPHWJPCSA-N 455.511 1.442 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1 1840880846 OPXWCDYZICHLOV-AOQYBADCSA-N 478.885 1.833 10 20 JDCD Cn1ncc2c(=O)n(CC(=O)OCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)cnc21 11557194 AQHTWKMEESXTQK-UHFFFAOYSA-N 471.429 1.087 10 20 JDCD C[C@H]1COCCN1CCNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729599351 FZPVDYMVARTFSW-SFHVURJKSA-N 457.554 1.462 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)CCNS(=O)(=O)c3cccnc3)cc2F)C[C@@H](C)O1 918140068 HUPIQXWPFURUGK-IYBDPMFKSA-N 450.536 1.819 10 20 JDCD CN1CC(=O)N(c2cccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)C1=O 918284724 QIXPBTZANCCKEB-UHFFFAOYSA-N 469.473 1.316 10 20 JDCD COCCN1C(=O)c2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3)cc2S1(=O)=O 919767950 QDGDJKWWTIIICT-UHFFFAOYSA-N 459.524 1.244 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cc2ccoc2cn1 1781206236 PXPNDVBWJOPIQI-VGOFRKELSA-N 488.591 1.816 10 20 JDCD Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221572 GFCKGYASHMCSFD-VKOGXBCZSA-N 468.510 1.743 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2 1785503572 LCDZKAULPYOQEN-WYAMSBGYSA-N 461.421 1.634 10 20 JDCD CC(C)c1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)co1 1785538005 OORTVTJVYRXVBY-LJQANCHMSA-N 452.558 1.102 10 20 JDCD O=C(Cc1cccc(Cl)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794196485 YAADAARTJIRDAR-RSQQPWMTSA-N 481.940 1.660 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cnnc(Cl)c1 1794217998 OSTBDZCMTSLWCX-UNALJEAJSA-N 460.874 1.163 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2)C1=NN(c2ccccc2)C(=O)C1 1796479329 BQBQBYCZYWSMEY-FEJSZKPUSA-N 472.505 1.559 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2)C1=NN(c2ccccc2)C(=O)C1 1796481041 KNDCETVDGVQLMS-NHKMSHSESA-N 467.570 1.245 10 20 JDCD Cc1cc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(O)c(O)c(Cl)c2)no1 1800717975 DZENGJLKTVUMTF-BTTYYORXSA-N 462.890 1.729 10 20 JDCD Cc1nccn1[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801461274 MFVLFGQLLICMPX-JLAVPVSKSA-N 456.499 1.172 10 20 JDCD O=C(Cc1cnc[nH]1)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1808257743 VTWMBFYUBBPEPV-OUWGLZAPSA-N 463.494 1.883 10 20 JDCD COc1ncccc1C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1808300727 FTSJRYGOISXWFR-UHFFFAOYSA-N 462.597 1.795 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468522 SAMBFBNGMORNGY-HRAATJIYSA-N 499.474 1.990 10 20 JDCD COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)CC1 1808468862 FMRMJQHLCSWHEH-GCJKJVERSA-N 489.532 1.834 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1 1819031170 CRFJYDQCQDKZFR-SNVBAGLBSA-N 487.592 1.272 10 20 JDCD NC(=O)[C@@H](N)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1826938151 KBOMJERWBXWESP-ZGCXVMDJSA-N 474.558 1.029 10 20 JDCD O=C(c1c[nH]c(=O)cn1)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827716390 JQPPIMDVHBEBEH-OAQYLSRUSA-N 476.537 1.796 10 20 JDCD CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1831540159 IKBZYBCTCFJMMQ-NKOINVLESA-N 480.583 1.662 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(=O)oc1)CCO2 1834596621 MMHIYUJKYYWDFJ-OAQYLSRUSA-N 464.858 1.088 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2 1836615984 RMSSUKGWEBLXBV-XMMPIXPASA-N 486.544 1.908 10 20 JDCD O=C(Cn1cncn1)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1837965357 OQIFNZOTEMELMK-UHFFFAOYSA-N 463.922 1.655 10 20 JDCD C[C@@H](Nc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839434030 JWRJIVZMHSVLOS-CMJOXMDJSA-N 490.944 1.717 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839522412 CYZDPGGIGFPECF-HXUWFJFHSA-N 494.620 1.160 10 20 JDCD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cs1 1840880596 ZWFBAKCCOUETHG-WTCGPSRQSA-N 475.523 1.352 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)Cn2ccc3sccc3c2=O)C1 1842021041 LPANKCDHHYOHLF-UHFFFAOYSA-N 476.605 1.127 10 20 JDCD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843849157 UBJQWGGQFZWZOY-AWEZNQCLSA-N 482.484 1.955 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cccc(C(F)(F)F)n2)C1 1844455047 UCGGZHJBRTYYKH-UHFFFAOYSA-N 458.487 1.778 10 20 JDCD Cc1cc(C)n2ccc(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)c2n1 1845732505 KSOMFRXGPQDBQD-UHFFFAOYSA-N 457.581 1.628 10 20 JDCD Cc1nc(S(=O)(=O)N2CCC(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)CC2)cn1C 109589940 ODGGTJFEXMRQPF-UHFFFAOYSA-N 475.615 1.624 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c1 116199936 OTSKRIOKTFCJDR-UHFFFAOYSA-N 467.569 1.594 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)C1 731051701 OVBJOUDPUJOWHD-HNNXBMFYSA-N 473.917 1.996 10 20 JDCD Cc1nc(S(=O)(=O)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1C 750871688 AQHZJTYLGCRMEN-OKILXGFUSA-N 453.540 1.076 10 20 JDCD COc1c([N+](=O)[O-])cc(N2CCN(CC(=O)NC(C)C)CC2)c([N+](=O)[O-])c1Br 835857635 MDKHFXURRWBYIW-UHFFFAOYSA-N 460.285 1.921 10 20 JDCD CNC(=O)[C@@H]1CN(C(=O)C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccccc2O1 918298286 YISFDBLDASLNEB-UWJYYQICSA-N 453.495 1.440 10 20 JDCD CNS(=O)(=O)c1cc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)ccc1C 918439120 SLZQIGJGNYMNQQ-UHFFFAOYSA-N 462.597 1.711 10 20 JDCD O=C(Cn1c(=O)nc(O)c2ccccc21)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919761851 PNEDHOFVTQTKHD-UHFFFAOYSA-N 489.511 1.674 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccc3[nH]1)C2)c1cc(O)nc(O)c1 1777852864 XZFYTELGSSJQPH-WZONZLPQSA-N 451.483 1.810 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c(F)c3)C2)C1 1781634584 LNOFUVYRWWBDPY-XMMPIXPASA-N 466.469 1.768 10 20 JDCD Cc1cccc2c(C(=O)N3CC[C@]4(CN(C(=O)CN5C(=O)CSC5=S)CCO4)C3)n[nH]c12 1782480326 XJGUZPAUTSBLLT-NRFANRHFSA-N 473.580 1.175 10 20 JDCD C[C@@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785508265 DCJVLSPRECNXLX-PSHUAGRUSA-N 474.539 1.604 10 20 JDCD Cc1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)c1 1786106727 OUBOZHUTQOXKGL-ZEJAEISRSA-N 453.495 1.814 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(F)c3F)C[C@@H]21)c1cc(O)nc(O)c1 1787294568 RJMVXPDQCUUPOZ-FSBGKCOPSA-N 451.401 1.817 10 20 JDCD CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)CC1 1787537447 VAABFDDYJFIVHC-SSPYTLHUSA-N 495.624 1.879 10 20 JDCD CC(C)c1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)co1 1794286958 PTOQEORXGZNDKM-LODQTJKBSA-N 457.483 1.831 10 20 JDCD CN(C)CCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1806892927 GZYRZKUHTFNDMQ-YADARESESA-N 462.554 1.832 10 20 JDCD CC(C)(C)NCC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1807102328 UQHQLHLGRXZBSY-HNAYVOBHSA-N 463.629 1.336 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2nc[nH]n2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468061 NRWKCMMKZNIHPJ-UZLBHIALSA-N 458.482 1.312 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811804220 SHSARNDKMHFNPO-PXAZEXFGSA-N 485.884 1.981 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2cccc(O)n2)[C@H]1c1cccnc1 1814185694 DYBNDJMHFPPJIN-KUHUBIRLSA-N 471.564 1.362 10 20 JDCD Cc1cc(/C=C/C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)no1 1814189784 YSRNQNNEHFITKV-ZAHAJLKSSA-N 485.591 1.958 10 20 JDCD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146178 VEWFMMIOCVVNQV-GOSISDBHSA-N 486.554 1.629 10 20 JDCD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)ccn1 1820494852 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COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)C[C@@H](C)N4S(C)(=O)=O)CC2)cc1 742927374 PMMKCDLZQOMPNL-GOSISDBHSA-N 472.611 1.958 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)cc1 742928617 YKBJPCWOAMYZJI-UHFFFAOYSA-N 451.527 1.413 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3cc(S(N)(=O)=O)ccc3Cl)CC2)cc1 819874328 RCXFLWUVSUUFIP-UHFFFAOYSA-N 467.931 1.502 10 20 JDCD C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC[C@@H](NS(C)(=O)=O)C1 917102525 NGOXDVYBKHZDLS-GOEBONIOSA-N 455.536 1.803 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(NC(=O)[C@@H]4CCCO4)cc3)cc2)C1 918463615 LRBMNSNWCNZTHL-AVRDEDQJSA-N 493.564 1.761 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3cccc(N4CCCS4(=O)=O)c3)cc2)C1 918465626 QDVUNVYFSKWLBP-GOSISDBHSA-N 499.593 1.183 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F 920195682 ZRMFXLWXZMDBOY-UHFFFAOYSA-N 476.530 1.457 10 20 JDCD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1)N1CSCSC1 1779148025 GZLQVJPHGQCJJS-VGRBDKTESA-N 495.623 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CO[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)c1ccccc1 1835285207 OLRBGPJORNVAOR-ZMSIXCCISA-N 498.532 1.661 10 20 JDCD O=C(CC[C@@H]1CNc2ccccc2C1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417260 JGAYVXYIAQYARN-HFJWLAOPSA-N 496.564 1.627 10 20 JDCD COc1c(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1C 1836418921 HPLSJXCGBWRINA-DEOSSOPVSA-N 471.510 1.502 10 20 JDCD O=C(/C=C/c1cnccn1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031779 MDVSLDWDBMMKIS-OWOJBTEDSA-N 453.499 1.608 10 20 JDCD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)c1 1838927538 NOQYVMDRFZLHAK-AREMUKBSSA-N 492.532 1.558 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1 1839434259 XIHQYTVCTUWSRC-QFIPXVFZSA-N 487.900 1.406 10 20 JDCD Cc1nccn1[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840492660 IZRSBJCKHQTLHN-PEBXRYMYSA-N 478.933 1.587 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CCCCO3)C2)C1 1840879941 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1.144 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1n[nH]c(C2CC2)c1F 1794480213 QFGGPWAHYQVNPG-YVWYUNDQSA-N 480.500 1.422 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)[C@H](O)c1ccccc1 1795385479 YLJNMHXGJFTTDJ-AAUAJYIVSA-N 462.506 1.103 10 20 JDCD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1SC(=N)NC1=O 1796880936 VIGUVWVNTNUCFL-JSIFIVKGSA-N 466.947 1.805 10 20 JDCD Cc1n[nH]c(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798014665 FCDBVVFPKZYXOG-VPTLXERWSA-N 450.499 1.023 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cc(-c2ccccc2)no1 1798137132 IPPJJKDIJDLVEU-VPTLXERWSA-N 450.451 1.665 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnc(O)nc2O)C3)cc1 1799620528 NVAONCFSVKRTES-RMFSNUHRSA-N 477.521 1.812 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cn[nH]c3cn1)C2)c1cc(O)c(O)c(Cl)c1 1799769520 VIYUEZXKPPKSMK-IVWMJMPLSA-N 457.874 1.540 10 20 JDCD COC(=O)C12CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)/C=C/c3ccc(O)c(O)c3O)C4)(C1)C2 1801879625 DYTIMVPNEPPBJY-ZIJNDNSISA-N 456.495 1.798 10 20 JDCD Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802078818 JPKXCXCROZKKAI-WEPPNNQVSA-N 467.522 1.742 10 20 JDCD COc1ccc(F)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802082574 UJAKYFWFHNDKCE-GCZWLPJRSA-N 472.469 1.868 10 20 JDCD O=C(Cc1ncccn1)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1804692756 WXYOKLMENIRTLE-KBMIEXCESA-N 483.532 1.913 10 20 JDCD Cn1cncc1C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808467000 CWXRPBFWWHPDJD-JPYJTQIMSA-N 471.521 1.928 10 20 JDCD CC(C)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1810438075 ZGJFJGRSEUIKKV-IDHHARJASA-N 464.613 1.761 10 20 JDCD COCCOCCOCCOCC(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810550506 MFPNSMSCFSLOJM-UHFFFAOYSA-N 495.573 1.034 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)c1ncon1 1811181313 FGKYTHWLTXMYLL-WFEZPHLISA-N 451.439 1.614 10 20 JDCD O=C(Cn1cccn1)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1815713507 YHBWVCPQRSFDLG-AWEZNQCLSA-N 463.523 1.745 10 20 JDCD O=C(Cn1ccnn1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1819703779 LSXVTPIDAOKEEW-ZKKXHLJNSA-N 453.459 1.524 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ncccn2)[nH]n1 1823496210 HWPBYQPDVFVJQW-ZDUSSCGKSA-N 459.557 1.295 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2ccc[n+]([O-])c2)CC1 1825382197 CGEJISWISBYTHD-QGZVFWFLSA-N 462.597 1.414 10 20 JDCD CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1)C(=O)O 1826945846 DMNGQFPWKXGUJH-VZUWTINFSA-N 475.542 1.499 10 20 JDCD CN(C)C(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715234 JPKFYGMNXIVFBM-HXUWFJFHSA-N 453.543 1.487 10 20 JDCD NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1831404373 DKJKHHMTMFGYOP-FQEVSTJZSA-N 453.543 1.665 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3occc3Br)C2)C1 1836417115 ARWQFQUDOZJIAU-IBGZPJMESA-N 482.287 1.232 10 20 JDCD CC(=O)O[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)C(C)C 1837223345 ZJMTVQKHXPGJEC-DENIHFKCSA-N 484.933 1.409 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)c3cnc[nH]3)CC2)CC1 1837451062 VWSBTNRANQVJSB-DUXPYHPUSA-N 456.499 1.852 10 20 JDCD COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1838878467 KNTOMQBATSXGBH-CFSVISAESA-N 484.505 1.595 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccc3o1)CCO2 1839503725 WHTBRNZGZGZMAL-UVXPNCNTSA-N 495.488 1.728 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1840897079 KVRVOJRQKKOJBL-QFIPXVFZSA-N 489.575 1.363 10 20 JDCD COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)CN4C(=O)CCC4=O)CC3)ccc21 487002686 TWTGASYTDKSGPI-UHFFFAOYSA-N 454.527 1.338 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 920635445 FVVAHSKZDRFOQZ-UHFFFAOYSA-N 475.523 1.798 10 20 JDCD O=C(CN1CCc2nc[nH]c2C1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 929074488 ZFKOWWQVDGMCLE-LSCVHKIXSA-N 471.564 1.514 10 20 JDCD O=C(Cn1c(=CC(=O)C2CC2)sc(=Cc2ccc(N3CCCC3)cc2)c1=O)NCC(F)(F)F 1317902095 IWBBRROMTQKJHW-UHFFFAOYSA-N 479.524 1.777 10 20 JDCD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)nn1C(F)F 1780162318 RVFCRHZLTIWVFX-QVKFZJNVSA-N 465.457 1.834 10 20 JDCD Cn1ncc2c(C(=O)N3CCO[C@]4(CCN(C(=O)/C=C/c5ccc(O)c(O)c5O)C4)C3)cccc21 1785505244 FCYGWERMZKLRTL-VQEXNLMWSA-N 478.505 1.847 10 20 JDCD CC(C)(C)c1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)cn1 1787788077 KKUZBNWBMHPAFN-DZKIICNBSA-N 491.639 1.228 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cc2cccnn2c1 1790435814 FXPJAFXNJJOUTL-IWSQUXHHSA-N 478.505 1.758 10 20 JDCD C[C@](O)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)C(F)(F)F 1793693214 MFUJJEAWWLJUDC-YDXZUZSKSA-N 452.813 1.268 10 20 JDCD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)C(C)(C)C 1796137776 GKVHKKPUAYFOOB-WTLGNFPFSA-N 492.573 1.635 10 20 JDCD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cs1 1796481049 LRNOWLDSHNYBOG-YVWYUNDQSA-N 453.524 1.448 10 20 JDCD CCCc1onc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1796616549 WOPPATWXVCWEHR-NXYNRBCBSA-N 471.510 1.969 10 20 JDCD Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C3=NN(c5ccccc5)C(=O)C3)C4)ccc21 1797084449 YEPODNWUXJQISC-NHKMSHSESA-N 486.532 1.569 10 20 JDCD C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)co1 1797728046 ZNGMSHXYPSDYKW-ZLSBKTEHSA-N 486.597 1.858 10 20 JDCD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)c([N+](=O)[O-])cc1O 1799306603 XTTRHRXKLFXIKA-CLLJXQQHSA-N 458.427 1.681 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1cccc2ccnn12 1799902342 AIZUZICXWRZGEA-GPVSGQMNSA-N 472.505 1.330 10 20 JDCD CC(C)NC(=O)OC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802080175 DVBNDOIZRQGAGO-GGCCTBHOSA-N 491.541 1.319 10 20 JDCD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807995825 JPBMBNSMSCFYRN-VLIAUNLRSA-N 453.455 1.656 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ccc(F)nc1 1810699704 DZEXRXYWEFMSIN-IFXJQAMLSA-N 473.555 1.796 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cc(Cl)ncn1 1811123136 LAPNCSYCBXUCMF-BFUOFWGJSA-N 454.874 1.965 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1812365590 QMJPBYPUUVXKDN-WTANOLMUSA-N 458.471 1.769 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cn3ccccc3n2)[C@H]1c1cccnc1 1814189604 UATIIZJMPORKFO-KKSFZXQISA-N 494.602 1.909 10 20 JDCD CS(=O)(=O)c1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c1 1816722364 YYNJPAMJPIFZQQ-LBPRGKRZSA-N 489.535 1.287 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(CO)on1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817361630 AFESQTVACDYYDN-LBPRGKRZSA-N 480.506 1.642 10 20 JDCD CNC(=S)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361772 GCAMOVNGXASAEP-CYBMUJFWSA-N 499.622 1.332 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cnn2ccncc12 1818737342 UMZNCNIAGMFNCN-AWEZNQCLSA-N 484.567 1.619 10 20 JDCD O=C(/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1)NC1CC1 1823499936 GTBNNSIYZRRYHB-AFNCTOJWSA-N 476.584 1.097 10 20 JDCD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1828134840 PIXDFMAEKJZKJI-YPMHNXCESA-N 483.641 1.220 10 20 JDCD Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cs1 1832971455 GEHDAXIAGOUXSK-OAQYLSRUSA-N 481.958 1.829 10 20 JDCD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)on1 1833735341 KSSFHNVMBYYEBV-HWKANZROSA-N 484.553 1.927 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(=O)oc1)CCO2 1834596620 MMHIYUJKYYWDFJ-NRFANRHFSA-N 464.858 1.088 10 20 JDCD CC(=O)Nc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988437 SKGYENBJELWXDZ-UHFFFAOYSA-N 481.553 1.950 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1 1835444709 YUPNELRMLGERTA-XFHMXUHZSA-N 451.951 1.707 10 20 JDCD C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)O1 1835463741 MICHXYQQLFRVQR-WZONZLPQSA-N 481.597 1.918 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c2cc(O)ccc2n1 1836418505 YCXDLRXJRAHYFB-RUZDIDTESA-N 494.504 1.439 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)c3cnccn3)CC2)CC1 1837411776 MMMMGCWTBCBBAY-UHFFFAOYSA-N 476.537 1.882 10 20 JDCD O=C(C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccccc1 1837621674 AVEJVUKAFBODPT-UHFFFAOYSA-N 453.495 1.988 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cc[nH]c4nccc3-4)C2)C1 1840880838 NWGAGPUPORVSNY-DBTPONLISA-N 494.504 1.415 10 20 JDCD Cc1cc(C)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)c1 1840896812 VTPVJPUWFDIGTK-QFIPXVFZSA-N 477.608 1.234 10 20 JDCD O=C(c1cccc(N2CCOCC2)n1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441609 KSIKGOUMROIODE-UHFFFAOYSA-N 488.548 1.528 10 20 JDCD COc1ccc(F)cc1CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1846448298 AYFJFNGWBNQRGY-UHFFFAOYSA-N 451.545 1.441 10 20 JDCD O=C1Nc2ccccc2/C1=C/C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055615 IZKXSUONHSRAOV-ZSOIEALJSA-N 456.549 1.086 10 20 JDCD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 729525627 ROJZUCRFUUKXFO-QGZVFWFLSA-N 450.543 1.851 10 20 JDCD CC(C)[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)N[C@]1(C)CCS(=O)(=O)C1 913224166 LRQGASCCAPIHKJ-RCZVLFRGSA-N 498.557 1.919 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)cc1)N1CCN(CC(=O)N2CCc3ccccc32)CC1 919790546 LHQTTXZGIQGJQE-UHFFFAOYSA-N 463.582 1.940 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cnnc2ccccc12 1778531017 MYCNAJDWOYNCCT-WZONZLPQSA-N 499.618 1.618 10 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MYLUEKKYKYOOJZ-NHEOTCHKSA-N 487.440 1.767 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2)c1cc(O)c(O)c(Cl)c1 1799768059 HWYYMHGMLNXTCW-CCWDJLKJSA-N 456.886 1.916 10 20 JDCD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1800232190 CJXGBLJOWSZIFF-VFFTVRQLSA-N 456.879 1.516 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccncc1)C2 1802079091 SNLIAHSURXBGRM-SLWNEACCSA-N 467.522 1.824 10 20 JDCD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[S@](=O)c1ccccc1 1804336239 LLBIDUNBMRSZLK-LXZJHJFCSA-N 479.649 1.681 10 20 JDCD Cc1cnn([C@H](C)C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1813382720 UOPGHRNCUQKPIQ-QLVMHMETSA-N 450.499 1.974 10 20 JDCD Cc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1F 1814186779 XAUHKPHHZNCXNU-FZKQIMNGSA-N 476.559 1.432 10 20 JDCD CNC(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1815140977 DRQAXBSBCGDOCC-QGZVFWFLSA-N 451.487 1.331 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nncn3c1)CC2)c1cc(O)nc(O)c1 1816725449 LAIKATWAGUOEJK-GFCCVEGCSA-N 451.468 1.532 10 20 JDCD Cn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)c2c1CCC2 1816725638 NRXMOARASJMOSG-NSHDSACASA-N 454.512 1.711 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1cnc2c(c1)CCNCC2 1824640436 XOZIMAUBOBSILF-OAHLLOKOSA-N 480.550 1.572 10 20 JDCD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827429063 PCXKELWQCGSZMP-UXHICEINSA-N 484.557 1.197 10 20 JDCD CC(=O)Nc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)o1 1828244671 NJHXQZIJHFYITK-JTQLQIEISA-N 493.592 1.781 10 20 JDCD CC[C@H](C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)N(CC)CC 1833539822 GNKCSJBJZISFJX-LJQANCHMSA-N 497.731 1.539 10 20 JDCD CNCCCC(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834714465 UMWQWKLFBRKTJV-FNORWQNLSA-N 460.575 1.388 10 20 JDCD COc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)n1 1834985343 ADFMVVLDYRBYCB-UHFFFAOYSA-N 483.569 1.714 10 20 JDCD Cn1ccc(=O)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838029967 WLPPBAQKJAGOPQ-UHFFFAOYSA-N 456.499 1.118 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1 1838703011 HXEIYSZAQSBQPG-UHFFFAOYSA-N 491.639 1.302 10 20 JDCD O=C(CCc1ccc[nH]1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433988 HXYHVUYUPMQJEE-JOCHJYFZSA-N 463.918 1.782 10 20 JDCD Cc1cc(F)cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c1 1840239712 IHPOHHLGRGWXQT-QHCPKHFHSA-N 459.474 1.253 10 20 JDCD O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441763 CYTWOEDQGRAFSV-UHFFFAOYSA-N 494.573 1.847 10 20 JDCD COc1ccc(N2CCN(C(=O)CN3C(=O)C(=O)N(Cc4cccc(OC)c4)C3=O)CC2)cc1 725793579 HRHSOWMKFRPBJJ-UHFFFAOYSA-N 466.494 1.343 10 20 JDCD COCCCNC(=O)[C@H](C)N1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 728949561 SMOSREPUUVLDIE-AQNXPRMDSA-N 493.624 1.808 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H]3CCN(c4ccc5c(c4)OCCO5)C3=O)nc12 730619635 DQHRTOLMBIWFHJ-HNNXBMFYSA-N 482.449 1.479 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4cnnn4)cc3)cc2F)C[C@@H](C)O1 918286851 LCNGQOWRIZZMFD-GASCZTMLSA-N 453.478 1.670 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 919766591 JDCJVHQNLVDOET-FQEVSTJZSA-N 485.562 1.777 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778931826 HZCYLYCZRRLCKA-DRVBZHRZSA-N 495.532 1.910 10 20 JDCD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1 1781753236 HCGMDSZKKHEIKI-SQJMNOBHSA-N 484.553 1.602 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781885527 WHARYQOKJYUWQY-JOCHJYFZSA-N 485.591 1.381 10 20 JDCD Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783218542 RRKMKSPGJXKMTD-WZKXNVEMSA-N 484.553 1.995 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)[C@@H]1C[C@@H]1C1CC1 1783941484 NEBFMQSIAIWOIG-VIKMOERWSA-N 450.539 1.805 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2 1785539764 AKCMDZOVMLUBCS-SFHVURJKSA-N 454.961 1.039 10 20 JDCD O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785546526 FTAYEGZBOIGGEK-JOCHJYFZSA-N 487.607 1.186 10 20 JDCD CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1 1785547331 XMODEJANOLBECN-HSZRJFAPSA-N 490.651 1.375 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1noc2c1CCCC2 1787306933 TWDMQVUMTFADRO-BPXKWBHBSA-N 491.548 1.940 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1ccc(Cl)cc1 1789585383 CJALLSNHCPYLAT-BPUTZDHNSA-N 468.000 1.794 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CNC4=O)C[C@@H]32)cc1 1790124272 JBGRZSPWPYQOET-BVSLBCMMSA-N 493.564 1.239 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1cccc(F)c1[N+](=O)[O-] 1790137166 LCECGIIUBBNFQR-WHOFXGATSA-N 496.542 1.188 10 20 JDCD CCOC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)CC1 1790724702 YCAYXFQIELCBOJ-OHLZFXOVSA-N 474.510 1.140 10 20 JDCD COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)/C=C/c5ccc(O)c(O)c5O)[C@H]4C3)(C1)C2 1792217997 MSGRQLRGHFYDEN-LOISDOMBSA-N 486.521 1.140 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)C1Cc2ccccc2C1 1792317892 BGVVDOITQVVGEG-WDSOQIARSA-N 473.620 1.241 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1793866480 PYIHSKGRLXJCHH-LXTVHRRPSA-N 482.628 1.494 10 20 JDCD COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1794029596 RRWYTNLHBLGIRQ-LWDWJGHZSA-N 491.548 1.405 10 20 JDCD CC(C)(C)n1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)c1Cl 1796137245 DLVZEAKKQBFIGX-FVCICTRLSA-N 463.922 1.615 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1 1796525393 DNSAOBYZXRIUTQ-KOUHRCEDSA-N 499.568 1.596 10 20 JDCD 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495.605 1.966 10 20 JDCD CN(CC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S)Cc1nccn1C 780375798 XEYJSLQGSOVGRZ-YVLHZVERSA-N 473.580 1.598 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)CC2)cc1 782192571 DCPUCBAECWBQTG-UHFFFAOYSA-N 482.449 1.091 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)OCCCO4)cc2)C1 918464442 WADFUNASSKOEAE-KRWDZBQOSA-N 452.511 1.805 10 20 JDCD Cc1cc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)CN5C(=O)CSC5=S)CCO4)C3)cc2s1 1782299718 XRLAIVJEVXNMTF-FQEVSTJZSA-N 478.621 1.842 10 20 JDCD CC(=O)C[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783223183 YSGIGSGLUASHKA-ZSGDWFQBSA-N 460.527 1.946 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1ccc(Cl)nc1 1783374960 OEGVWQIKPLHZRB-IHRRRGAJSA-N 468.988 1.189 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cccc3nccn13)CCO2 1785509940 JJSNVYSMEKIQDU-COIATFDQSA-N 464.478 1.608 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1785538988 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O=C(NC[C@@H]1CCN(C(=O)[C@@H]2ON=C(c3ccccc3)O2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996556 VIDWMCAZQWARTK-ADSMNUKGSA-N 489.488 1.942 10 20 JDCD O=C1C[C@H](C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)CN1 1812644683 DCKLSUMVHHCODH-YCHLZHKOSA-N 466.494 1.054 10 20 JDCD CC(C)(C)NCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814186666 VRXGYICBESKNLE-BEFAXECRSA-N 463.629 1.336 10 20 JDCD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190262 VHFDKTVJHRRGDC-KKSFZXQISA-N 486.623 1.530 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2)c1cc(O)nc(O)c1 1816724773 HKQSRPKFJGNZJK-NSHDSACASA-N 451.468 1.532 10 20 JDCD O=C(Cc1cnc[nH]1)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1817045674 ZRBIYWWWFMHHHO-ZDUSSCGKSA-N 463.523 1.814 10 20 JDCD Cn1cc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cn1 1823497995 KGKMPNZZBCYKNN-HNNXBMFYSA-N 475.600 1.628 10 20 JDCD COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)n1 1828239738 GIEHNDJVQSOGPA-JTQLQIEISA-N 477.593 1.633 10 20 JDCD O=C([C@@H]1CCc2nc[nH]c2C1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899575 JUXOMIIGACUFKO-APWZRJJASA-N 489.667 1.995 10 20 JDCD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900880 LSXSFZJVDFNTCJ-CYBMUJFWSA-N 480.572 1.412 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CC34CCCN3CCC4)CC2)CC1)c1cc(O)nc(O)c1 1834987403 QQWPROGHKOEARN-UHFFFAOYSA-N 471.602 1.697 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1noc2c1CCCC2 1834995807 DNJFMDGVTMYQDK-UHFFFAOYSA-N 469.542 1.859 10 20 JDCD Cc1ccc(SCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1836418480 WHIMAXBQGHCZJW-QHCPKHFHSA-N 473.551 1.664 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1836419107 RVVPIYXDVJGZCM-HSZRJFAPSA-N 489.475 1.573 10 20 JDCD CCC1(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)CCC1 1836735022 UQBVONPZDNBILZ-VWLOTQADSA-N 468.554 1.816 10 20 JDCD CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1838055730 JFCPTZBUYVORPQ-RUZDIDTESA-N 495.536 1.408 10 20 JDCD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843248877 DAMIQIRWHNQWKN-KBXCAEBGSA-N 476.530 1.334 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442289 KHONQPPWCSBDAB-RBUKOAKNSA-N 464.522 1.738 10 20 JDCD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502106 PJXDSRCIHJUGMF-ZDUSSCGKSA-N 458.902 1.782 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1846346005 QAACLASBJYGREJ-PFSJMHODSA-N 456.495 1.775 10 20 JDCD COC(=O)[C@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)C1 1846353686 GQFKJYZZXURBQP-KBPBESRZSA-N 453.586 1.030 10 20 JDCD CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)CNS(=O)(=O)c3cnn(C)c3)c2C)cc1 108761871 MUDVHFOEKVNNRR-UHFFFAOYSA-N 474.539 1.931 10 20 JDCD NC(=O)[C@H]1CCCCN1CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 727239067 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C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988512 LLEDXCYSWVTOBB-QGZVFWFLSA-N 495.580 1.497 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCO3)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835132711 GXQJJKGOCQPRFJ-JOCHJYFZSA-N 467.570 1.530 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1 1836526849 OMDZFQWDFFBXMJ-QHCPKHFHSA-N 497.464 1.051 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2 1838259717 JPESLSPMWABJHH-WYAMSBGYSA-N 490.900 1.030 10 20 JDCD O=C(CCc1ccc[nH]1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433989 HXYHVUYUPMQJEE-QFIPXVFZSA-N 463.918 1.782 10 20 JDCD CC(C)(C)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839434147 QWMDLIWANXLDPU-OAQYLSRUSA-N 455.939 1.209 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1 1840880636 BZEWSGIEUNVLCB-JWZSXRADSA-N 499.545 1.901 10 20 JDCD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1)n1cccc1 1840881546 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O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC2(CCCN(C(=O)CN3CCOCC3)C2)CC1 1809550819 HNIQMWIPGNNPFL-HWKANZROSA-N 459.543 1.380 10 20 JDCD CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)CC1 1812464824 KLPCJZKFFDCLCC-KXBFYZLASA-N 454.483 1.551 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1 1814162207 HLJYEXVJLCXRPT-MWMWCICHSA-N 480.521 1.540 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2cccnc2S)[C@H]1c1cccnc1 1814184754 FOYJOUBCOYNUHN-KDOFPFPSSA-N 487.632 1.945 10 20 JDCD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1F 1814186753 WSLJELFTOFSBCW-RDTXWAMCSA-N 490.586 1.443 10 20 JDCD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814190933 DYTGKCUHOKZVJP-FUHIMQAGSA-N 491.639 1.253 10 20 JDCD C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362204 QRKVVBFEYJVJSZ-ZIAGYGMSSA-N 480.550 1.539 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2 1830562720 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C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)Oc1ccccc1 1836419553 LYAUXVABYGYDNO-XDHUDOTRSA-N 471.510 1.420 10 20 JDCD CCCNC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1836820948 JABKQDCBYVEUPD-UHFFFAOYSA-N 462.547 1.411 10 20 JDCD CC[C@H](NC)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837914342 OJGJBGFOIJRASY-NRFANRHFSA-N 469.586 1.776 10 20 JDCD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1 1838992619 CFFVNQBJVCWYDV-QFIPXVFZSA-N 477.608 1.179 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2 1839317929 BIIULKUWXYAJPS-JGZGHEEISA-N 488.468 1.432 10 20 JDCD Cc1ccoc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881042 ZQQKRMDYVUAPJO-OJZQOFKYSA-N 458.467 1.488 10 20 JDCD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841890105 NLEYLCPAZMVOBK-QGZVFWFLSA-N 458.609 1.107 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1 1841987435 XNUXWTDRNAOVDB-UHFFFAOYSA-N 487.516 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JDCD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919971035 GQXTWTLOZWFIDN-UHFFFAOYSA-N 468.533 1.794 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2)C1 1118776894 PEILHOUKOYLSEF-FQEVSTJZSA-N 470.595 1.553 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc(-c2ccncc2)[nH]n1 1779742262 DXAZCRBHVDAYDX-NTKDMRAZSA-N 478.509 1.719 10 20 JDCD O=C(c1cnnc(Cl)c1)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782005126 UVZXHJOEMLIVTD-IBGZPJMESA-N 453.282 1.952 10 20 JDCD C[C@](O)(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1)C(F)(F)F 1783218123 BSMVPGRUDCTFFV-BSGJZSDASA-N 488.459 1.644 10 20 JDCD Cc1cccc(/C=C/C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)n1 1783243431 BYDBTRFYDGILRF-LJBSYDGDSA-N 488.635 1.777 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(F)cc1)C2 1783246626 ZMNSOXLLCVBWSG-VGOFRKELSA-N 479.599 1.742 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cccc(=O)n1O 1785631088 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10 20 JDCD Cc1onc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1C 1814185428 QRTPKWGSIYEJKV-HNAYVOBHSA-N 473.580 1.866 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190886 CVUWGMXIJYGFEI-WJPUGNRLSA-N 499.618 1.810 10 20 JDCD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)C4=NN(c5ccccc5)C(=O)C4)sc3C2)n(C)n1 1817363483 GZBRRXZLIFCYOL-ZDUSSCGKSA-N 493.549 1.904 10 20 JDCD C=CC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818147323 XMOYSIHEBKCOPF-HNAYVOBHSA-N 477.525 1.885 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1828943564 CATSEUCLRNMRNE-WBVHZDCISA-N 490.655 1.757 10 20 JDCD CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1829555827 HEPMLCCDMZRYMI-HXUWFJFHSA-N 499.636 1.077 10 20 JDCD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1832228603 ZKNPUZCXQHMSRD-FUHWJXTLSA-N 477.656 1.999 10 20 JDCD O=C(C[C@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1832340696 CIYHALKVRLQNOX-NLFFAJNJSA-N 484.553 1.195 10 20 JDCD CC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n[nH]1 1833826156 CSKYNCXKZWTDEH-OAQYLSRUSA-N 478.889 1.061 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)C4=NNC(=O)C4)CCO3)C2)cc1 1837363082 CAYOZHLAAHYTIZ-RUZDIDTESA-N 479.537 1.040 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2 1839005708 HNZYSMQOKBBIIN-VWLOTQADSA-N 498.486 1.828 10 20 JDCD CCN(C)[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839643947 YTOXBZTVIPAZAU-QKKBWIMNSA-N 455.939 1.161 10 20 JDCD Cc1cncc(CCC(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840879800 GJPBEKVGTQZHJK-KCROQMHPSA-N 497.548 1.609 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)C1CC1 1841412919 WDJCOVRIKFZLPE-HNNXBMFYSA-N 496.655 1.744 10 20 JDCD CN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cc(O)nc(O)c4)C3)cc2)CC1 1843248746 JUQULADFKUTCMU-UHFFFAOYSA-N 451.527 1.375 10 20 JDCD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1845441330 AOULUKDNWQVVKD-MOSHPQCFSA-N 475.505 1.753 10 20 JDCD COC(=O)NCC(=O)N1CCCC12CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1846511321 KDBCQYDLPVHGGN-GOSISDBHSA-N 489.573 1.264 10 20 JDCD COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)cc1 1847037316 JPSJQSKHDGPMEV-UXBLZVDNSA-N 482.489 1.886 10 20 JDCD CC(C)(C)OC(=O)NC1(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)CC1 1847146031 WPLKLBNACWYWPI-UHFFFAOYSA-N 468.601 1.107 10 20 JDCD CC[C@]1(C)NC(=O)N(CC(=O)OCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1=O 9945363 RHZFIXXANSHYCH-QFIPXVFZSA-N 490.538 1.188 10 20 JDCD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NCc1ccc(N2CCOCC2)cc1 108805582 SNVOCMPBGBQRGZ-UHFFFAOYSA-N 475.567 1.669 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)CC2)cc1 742927513 SPUCFUUOQIXPFJ-UHFFFAOYSA-N 458.584 1.569 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)c3ccc(CCNS(C)(=O)=O)cc3)CC2)cc1 742927532 UGPQBRGVFMFYLB-UHFFFAOYSA-N 460.600 1.339 10 20 JDCD CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1 751405349 LWYKZSHCCBGSLL-GOSISDBHSA-N 488.566 1.516 10 20 JDCD COc1ccc(N2CCCN(C(=O)[C@H]3CCCN3S(=O)(=O)c3ccc(C(=O)O)o3)CC2)cc1 917822118 CLZYCFUIUXSYHL-GOSISDBHSA-N 477.539 1.878 10 20 JDCD CN1CCN(C(C)(C)CNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 919782420 JKYHGFNKRAWDOS-UHFFFAOYSA-N 484.624 1.768 10 20 JDCD NC[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1)c1ccccc1 1777848377 RAGVMIWURKZHDX-XLNZFTOWSA-N 454.527 1.363 10 20 JDCD CCc1nc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)co1 1779705387 XHFVSYPORSGNKE-QHCPKHFHSA-N 451.483 1.473 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc2cccnn2c1 1781328170 KQDOXOXFWSUIJS-WZONZLPQSA-N 451.483 1.582 10 20 JDCD O=C(Cc1ccc2c(c1)CCO2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781949376 UKUSNBZZTQQGMK-CJFMBICVSA-N 467.522 1.798 10 20 JDCD O=C(Cc1ccc(O)cn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1782632416 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O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1836418466 VWHXPDXYTBGWQX-OAQYLSRUSA-N 458.496 1.419 10 20 JDCD O=C(c1ccc(OC(F)F)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836418952 IXOROTWPGFOJBF-QFIPXVFZSA-N 479.436 1.478 10 20 JDCD Cc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)n1 1836767882 WJMCUCYRFNXJDF-UHFFFAOYSA-N 490.651 1.791 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1839433357 SEEWAGPYJCOEFE-YKSBVNFPSA-N 490.940 1.425 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1840880632 BTJUDWBHXREWTM-KFVKGYIZSA-N 489.912 1.635 10 20 JDCD CCOc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895193 KNKRTPPEMWTGCD-FQEVSTJZSA-N 499.636 1.077 10 20 JDCD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1SC(=N)NC1=O 1843408338 NEPOIRMYMFSZAI-XPTSAGLGSA-N 452.920 1.371 10 20 JDCD CS(=O)(=O)c1c(F)cc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1F 727616617 YVQASQBVTMODLK-AWEZNQCLSA-N 494.520 1.325 10 20 JDCD CN(CCS(C)(=O)=O)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 728081512 GHXSRHUIRSASFX-UHFFFAOYSA-N 457.486 1.218 10 20 JDCD COc1ccc(O)c([C@H](C)NC(=O)C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1 729064138 PTTQKKYUENTFOB-KRWDZBQOSA-N 484.553 1.890 10 20 JDCD CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 729225008 BWXKKCGQBAQAGD-UHFFFAOYSA-N 479.534 1.008 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)NCCS(=O)(=O)N3CCSCC3)cc2F)C[C@H](C)O1 730580073 MBGNRRLCTXUFBC-HOTGVXAUSA-N 474.624 1.617 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)c3ccc(OC)c(S(=O)(=O)NC4CC4)c3)CC2)cc1 742927670 WYIAYFKZXHTMRK-UHFFFAOYSA-N 488.610 1.697 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(-c4noc(C)n4)c3)CC2)cc1 743432762 QOWNUSRPNDPEKV-UHFFFAOYSA-N 464.526 1.931 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CN(C)S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 756039484 LYGSYVFGAXXTLD-UHFFFAOYSA-N 495.985 1.861 10 20 JDCD O=C(COC(=O)c1ccc[nH]1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 825293549 ZRSTZVATVUNVID-CXUHLZMHSA-N 459.505 1.918 10 20 JDCD CON(C)S(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918033307 UROCIXDKTHNTQD-QGZVFWFLSA-N 475.571 1.892 10 20 JDCD O=C(CCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918334510 HHUDLZWEKDHSLF-UHFFFAOYSA-N 455.536 1.614 10 20 JDCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 918442755 NEEMRRGOTKMABM-UHFFFAOYSA-N 486.594 1.690 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(Cc3nc(-c4cccs4)no3)CC2)c1 919810254 LHVGQBYHIJENEF-UHFFFAOYSA-N 463.541 1.833 10 20 JDCD O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 919839182 GBBMOHNJHJDFHN-UHFFFAOYSA-N 479.580 1.195 10 20 JDCD COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920195401 RDFIZPAIWZVDAZ-UHFFFAOYSA-N 476.555 1.037 10 20 JDCD COc1ccc2nc(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)ccc2c1 1777894190 LRVGBTVRUIRGSI-DEOSSOPVSA-N 464.478 1.807 10 20 JDCD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778127262 HTIFTTFYOYPVHR-RQNQAMLKSA-N 497.596 1.598 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1 1779429225 MSDVNXDCQKQJFQ-QFIPXVFZSA-N 468.901 1.366 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1 1781137200 URZAHZOLUXNIEA-BFHGXFJZSA-N 471.554 1.665 10 20 JDCD C[C@@H](Cc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1784284206 SPPDOHFVQRTJFN-SIBVEZHUSA-N 475.549 1.883 10 20 JDCD CCCNC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1784372787 GSFICBOXECONIG-CUWPLCDZSA-N 483.569 1.065 10 20 JDCD C[C@@H](Oc1cccnc1)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1784546131 NTHQIUDPNZULRJ-CJAUYULYSA-N 477.521 1.472 10 20 JDCD O=C(/C=C/c1cnccn1)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510146 FINZUARIYYXKKW-ULDCPWSLSA-N 452.467 1.150 10 20 JDCD CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1)c1ccccc1 1785537961 FYSWELYVICGSSQ-NQIIRXRSSA-N 463.581 1.064 10 20 JDCD Cc1nc2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)CN5C(=O)CSC5=S)C4)C3)c2s1 1785539613 FEVXNEYUSCXVNV-NRFANRHFSA-N 490.632 1.909 10 20 JDCD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785545951 CLAVNVYRUIAPQG-VLIAUNLRSA-N 480.637 1.252 10 20 JDCD Cc1cc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(C)c1 1785545962 CWYNDCPTVXBNJE-QFIPXVFZSA-N 461.609 1.916 10 20 JDCD O=C(/C=C/c1cccc(O)c1)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785546946 MKGRQOOKFKIDQJ-FNEOHHHZSA-N 461.565 1.096 10 20 JDCD O=C(CN1C(=O)CNC1=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788671406 QEQNXCQNFWSUBW-UHFFFAOYSA-N 488.504 1.465 10 20 JDCD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)cc(Cl)n1 1789045886 ARAPZDSTCVNQDD-UBHSHLNASA-N 499.014 1.197 10 20 JDCD O=C(CNC(=O)C(F)(F)F)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791628858 RBWXASSABKVONA-UHFFFAOYSA-N 488.513 1.659 10 20 JDCD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)ccc1O 1792218342 SPYAPTDSVGTUSA-OUFAJUJOSA-N 484.505 1.824 10 20 JDCD COCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1795349241 URGAILVRZDZPIU-BAYUQKDNSA-N 490.601 1.331 10 20 JDCD CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cn1 1796479834 YNARHQQLWHLFQQ-GPVSGQMNSA-N 490.564 1.770 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cccc(C(F)(F)F)n1 1798087412 ZVPGTUVLEOUXLD-CULMDFNYSA-N 488.513 1.164 10 20 JDCD CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799687776 QIMYDUNFQWGARH-OPISRNFTSA-N 489.912 1.725 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccnc13)C2)c1cc(O)c(O)c(Cl)c1 1799769336 HGMLXWLXCFPCLZ-FVCICTRLSA-N 457.874 1.311 10 20 JDCD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1800167002 QIAMATOOMRFTDK-QKPAOTATSA-N 464.519 1.020 10 20 JDCD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)nc(O)c1)C2 1804300438 NIXMHHFTUCXBPE-BASYENTBSA-N 492.529 1.201 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cc(F)cc([N+](=O)[O-])c1 1804335694 DMFJKEDWSJJPCK-BTTYYORXSA-N 466.516 1.846 10 20 JDCD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c2c1CCC2 1809371143 SWULAZYQEQVSTQ-YCRPNKLZSA-N 498.634 1.484 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809858428 XCMZWRPIXXOLHC-VFNWGFHPSA-N 464.482 1.500 10 20 JDCD CC(C)N(C)CC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813601219 ASGJSFWWDDREJB-UZLBHIALSA-N 463.629 1.288 10 20 JDCD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1 1814188981 INRCAQNJQAKKDV-MGPUTAFESA-N 485.591 1.665 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@@H]1c1cccnc1 1814189744 XMJXDUAREBUFGZ-YCRPNKLZSA-N 498.634 1.863 10 20 JDCD CN1CCC[C@H](C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)C1 1814190388 ZARJNOSNBPTJTA-FUHIMQAGSA-N 475.640 1.290 10 20 JDCD NC[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1ccccc1 1815159425 FTQDXFRUASDDHS-LSDHHAIUSA-N 453.524 1.918 10 20 JDCD O=C1C[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)n[nH]2)CCN1 1818147810 KMIIDQGRDOJRDE-BEFAXECRSA-N 477.525 1.721 10 20 JDCD Cc1cnoc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1821136299 FCQDPHDRWMUTMR-VIFPVBQESA-N 451.555 1.526 10 20 JDCD Nc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)cs1 1828242528 KNPXCRQWXDHUPD-SSDOTTSWSA-N 468.611 1.268 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ccccc13)CC2 1828245114 ZCUYVRMZKZQWDV-NSHDSACASA-N 486.604 1.877 10 20 JDCD CN1CCC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)C1 1828246620 FZJJMWMWLYQGLG-VXGBXAGGSA-N 467.642 1.257 10 20 JDCD Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)n1 1834150884 BJHVFLFQAFSWTH-UHFFFAOYSA-N 475.640 1.436 10 20 JDCD CC(C)n1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)n1 1834986879 FYQXCSBQMGCILS-UHFFFAOYSA-N 457.535 1.164 10 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Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c(F)c1F 1840701141 ZYZODLOQRDFNFF-QFIPXVFZSA-N 463.437 1.463 10 20 JDCD CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840885959 JXDXDTAZKMUENE-QFIPXVFZSA-N 484.933 1.411 10 20 JDCD COCCn1nccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1843509159 UNBTZRKWWIZWDS-UHFFFAOYSA-N 450.499 1.139 10 20 JDCD O=C([C@H]1CC(c2ccccc2)=NN1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039417 MKXUKHPSSXQTIN-LHUXKHBRSA-N 462.506 1.786 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)C1 1847055363 CMGSNYAVWLDMAK-OAQYLSRUSA-N 496.655 1.697 10 20 JDCD CSc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3c(=O)c4c(ncn4C)n(C)c3=O)c2C)c1 25131516 HGXUDEHKSFDWGU-UHFFFAOYSA-N 495.561 1.989 10 20 JDCD CCS(=O)(=O)NCc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 857494302 MFQUBMMWMZDKRQ-UHFFFAOYSA-N 458.584 1.724 10 20 JDCD CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)NCCCN(C)S(C)(=O)=O 917191936 VOTMHFGLMIDZSF-UHFFFAOYSA-N 468.601 1.831 10 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470.526 1.981 10 20 JDCD NC(=O)c1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1781759515 USIXMMPVSQVJAM-VWLOTQADSA-N 475.505 1.022 10 20 JDCD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1O 1782134441 MWQXSBCSFRUQSV-OGPASDKVSA-N 497.504 1.624 10 20 JDCD O=C1CCc2ccc(C(=O)N3CC[C@]4(CN(C(=O)CN5C(=O)CSC5=S)CCO4)C3)cc21 1782314330 PLEVJJKJPWKBEP-QFIPXVFZSA-N 473.576 1.119 10 20 JDCD Cc1ccc([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc1 1783317139 GZJXSHAXMLLSIU-AOMKIAJQSA-N 461.609 1.789 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2 1785541495 VLOVZDNCVLNBRI-OZIGNCPNSA-N 489.644 1.565 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2 1789218118 FFGNXJRVIUWIFO-KKXDTOCCSA-N 484.465 1.243 10 20 JDCD O=C(CCc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1791768700 PEUKCUOZJSPVJP-BQFCYCMXSA-N 479.599 1.598 10 20 JDCD C[C@H](Nc1nccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796479477 GUNVFENWGBBSHN-MFCZKXCZSA-N 482.566 1.326 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cccc2c1OCC2 1796796926 WOWFCDOIYQQMPR-ZLSBKTEHSA-N 466.490 1.655 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1cnnc2ccccc12 1796888002 AJSMBYODKUGYPX-XHNJZIHCSA-N 484.516 1.626 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cncc(C(F)(F)F)c1 1798250147 PXYVCNQFAKXNPZ-FVCICTRLSA-N 452.389 1.424 10 20 JDCD Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)s1 1801488770 HMSKSEDIUHEHNO-QFIQAUFPSA-N 479.562 1.847 10 20 JDCD Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)c1=O 1803837262 GRORTIKUVJNFRK-BSIOYPLDSA-N 490.516 1.930 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnnc(Cl)c1 1804724355 QGBWSGXEJOUCPK-BFUOFWGJSA-N 454.874 1.965 10 20 JDCD Cn1ccc(C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)n1 1805735781 BYXNQHAUENUHPY-PQGDUDRBSA-N 463.494 1.965 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994456 SGABGUMBUJDNAN-SJKOYZFVSA-N 453.415 1.153 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995529 QUKWXUZSXFZXMN-BZNIZROVSA-N 477.403 1.658 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cc2ncccn2n1 1809768390 LBZXTQHWSPUGHU-QRWLVFNGSA-N 495.590 1.304 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cccnn1 1810725605 CCYTUCNMMZPMOK-KSSFIOAISA-N 456.553 1.052 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)CC2(O)CCC2)[C@H]1c1cccnc1 1814190904 DMXRVUDGTZYGMH-BEFAXECRSA-N 462.597 1.253 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)n3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1817103165 WTFNEEZDHIUNRR-NSHDSACASA-N 493.505 1.363 10 20 JDCD COCCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1818248729 VLWOMWBKWFKQFT-HNNXBMFYSA-N 455.475 1.679 10 20 JDCD NC(=O)c1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823495790 BYPRRCDILKCELI-ZDUSSCGKSA-N 487.567 1.070 10 20 JDCD COC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CC1 1823499492 ITVZXXYIQUZILP-LBPRGKRZSA-N 465.557 1.215 10 20 JDCD CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1829551699 QDDPQOMFIVHBQB-OAQYLSRUSA-N 463.512 1.337 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901582 FNVFKAQJOKXROS-OAHLLOKOSA-N 478.596 1.586 10 20 JDCD Cc1nnsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902030 IGGZUAHPPGMJNZ-CQSZACIVSA-N 467.642 1.940 10 20 JDCD N[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cccnc1 1834987000 QMDFUGYBPBUACD-HXUWFJFHSA-N 468.558 1.163 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2 1836803336 FRYSRCSWJRMJDG-HSZRJFAPSA-N 470.457 1.497 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)c3cscn3)CC2)CC1 1837493972 KGQLMUXKLWIIDR-UHFFFAOYSA-N 468.626 1.616 10 20 JDCD CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1837601733 GKTTXIHQFGTWCO-SZNDQCEHSA-N 456.923 1.635 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(C)c1 1838904446 DWFYEAOBQMRSKB-QFIPXVFZSA-N 477.608 1.234 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)cc1O 1839267387 OMSHPGQDZDIBOS-AREMUKBSSA-N 492.532 1.564 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1 1840881186 HVPBBCJGEAUJSA-ZNSATWQLSA-N 490.459 1.865 10 20 JDCD Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897790 WVEQSFIMKZCTIG-NRFANRHFSA-N 481.571 1.064 10 20 JDCD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)C1 1841339631 GMQNJSWZZFJEOJ-LSDHHAIUSA-N 467.613 1.420 10 20 JDCD CC(C)(C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)c1ncc(Br)cn1 1843248745 JTKJTBFFJIPARL-UHFFFAOYSA-N 476.331 1.840 10 20 JDCD O=C(c1cnc(OCF)cn1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441216 FCVNDDHVNNJPEY-UHFFFAOYSA-N 452.446 1.392 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441481 CDOOIOMUYOSKOJ-UHFFFAOYSA-N 484.516 1.776 10 20 JDCD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)C1 1843948841 CKGRNNDAZCHTKR-UHFFFAOYSA-N 482.628 1.307 10 20 JDCD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1845005125 WUUUMAKMYHLRDU-WGPYJDKQSA-N 483.496 1.978 10 20 JDCD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845502440 XOXNSOYDZZBGFU-MRXNPFEDSA-N 461.906 1.039 10 20 JDCD CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 729059305 YFUWMGHIJBARPT-UHFFFAOYSA-N 490.557 1.700 10 20 JDCD CCN(CC)c1ccc(CNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1F 731345795 JGRJGCZXHZAZPQ-UHFFFAOYSA-N 462.547 1.722 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)CN(C)S(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 742921624 WCWPMJKLWPETNM-UHFFFAOYSA-N 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O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1 1814165044 BFGIWDVEWQWXOZ-JGQKVYBRSA-N 465.506 1.810 10 20 JDCD O=C1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)C4=NN(c5ccccc5)C(=O)C4)sc3C2)CN1 1817364150 OLSVNDJUCKGUKN-KBPBESRZSA-N 480.550 1.374 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cnn2cccnc12 1819021773 DRFIMGZRZRRVAS-CQSZACIVSA-N 484.567 1.619 10 20 JDCD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)C1 1823496631 MTVDACIAXOOEQW-UMVBOHGHSA-N 493.611 1.851 10 20 JDCD Cc1nnc(CCC(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)s1 1828240489 VVGIRVSTMFRZBS-SNVBAGLBSA-N 496.665 1.708 10 20 JDCD O=C(c1cnn2ccncc12)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901600 FZKXCFOITXJCRY-KRWDZBQOSA-N 486.623 1.823 10 20 JDCD CCC1(C(=O)N2CCC(N3CCC(NC(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)COC1 1835133833 CABFXFYUEPPTNA-UHFFFAOYSA-N 481.597 1.778 10 20 JDCD Cc1cc(C)n(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)n1 1839433011 HAQCICHCYMLPJD-HSZRJFAPSA-N 492.960 1.725 10 20 JDCD COCc1c[nH]c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)c1 1839433487 JQFBXWCPNXNCAH-JOCHJYFZSA-N 479.917 1.610 10 20 JDCD O=C(CC[C@H]1CCOC1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435557 ORIUJAFMCMLZEX-NYHFZMIOSA-N 468.934 1.638 10 20 JDCD Cc1ncc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)s1 1840399714 ZCQJWPJAKRBJQQ-DEOSSOPVSA-N 497.577 1.243 10 20 JDCD CC(C)/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840625442 LDJIKPGADIWALN-KDLSMAQYSA-N 454.527 1.448 10 20 JDCD CS(=O)(=O)c1cncc(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c1 1842189074 OZAZJJVCWCGYDH-UHFFFAOYSA-N 481.534 1.095 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2ccc(-n3cnnc3)cc2)C1 1842853687 SYUYCSVISXWOEA-UHFFFAOYSA-N 469.505 1.877 10 20 JDCD O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)CN1Cc1cccs1 1843248923 IIMJFCGGFFTCIK-OAHLLOKOSA-N 456.524 1.420 10 20 JDCD 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1.791 10 20 JDCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1sccc1S(=O)(=O)N1CCOCC1 790453132 NYWGKQFMYRUAFQ-UHFFFAOYSA-N 465.597 1.878 10 20 JDCD CCCCNC(=O)Cn1c(=CC(=O)C(C)(C)C)sc(=Cc2ccc(N3CCOCC3)cc2)c1=O 916219964 RNAXETCTKJEOAO-UHFFFAOYSA-N 485.650 1.887 10 20 JDCD CCOC(=O)c1c(C)oc2ncn(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c(=O)c12 917195377 KLQFVLJAOINWND-UHFFFAOYSA-N 472.473 1.767 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3cccc(-n4cnnn4)c3)cc2F)C[C@H](C)O1 918286642 JKYFZOGCAMBGNN-GJZGRUSLSA-N 453.478 1.670 10 20 JDCD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918339828 HQJJOTXPXDXONJ-UHFFFAOYSA-N 471.988 1.413 10 20 JDCD O=C(COC(=O)c1ccc(N2NC(=O)CCC2=O)cc1)NCc1ccc(N2CCOCC2)c(F)c1 920696356 JKHJJPHBNFGSEM-UHFFFAOYSA-N 484.484 1.294 10 20 JDCD COCCN1C(=O)/C(=C/Nc2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)C(=O)NC1=S 920974553 PMMFWRUQSJNKHC-WYMLVPIESA-N 487.003 1.700 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1778224772 HMKSAPQJEXRNPO-QZTJIDSGSA-N 479.546 1.594 10 20 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CNCCCC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362414 OFPOOLXTTDBAMZ-CQSZACIVSA-N 454.556 1.848 10 20 JDCD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)N1CCN(C)CC1 1817847533 JRKWAVSYRYOLHQ-WMLDXEAASA-N 457.535 1.158 10 20 JDCD COc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)nn1 1821073365 MKBJDBKDMRUPRQ-SECBINFHSA-N 478.581 1.028 10 20 JDCD CC(=O)C[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1825941094 GRBHMNWJXORPDE-ONGXEEELSA-N 454.599 1.531 10 20 JDCD CC(C)(C)OC(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828239669 AYSVTVJRBPDMBC-SNVBAGLBSA-N 484.625 1.647 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(Cl)nn1)CC2 1828244516 JRDXLYNBUJKSAE-MRVPVSSYSA-N 483.000 1.673 10 20 JDCD O=C1NC(=O)[C@H](CC(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)N1 1832876641 LBEKPAMIMFZJQV-DGDBIBOCSA-N 486.525 1.034 10 20 JDCD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896835 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CC(C)n1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)n1 1840881291 NPQNDFGXOLYYPE-JIBKAZCMSA-N 486.525 1.364 10 20 JDCD Cn1nccc1C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251684 QXOQAKKHZZPMRM-QGZVFWFLSA-N 499.568 1.784 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCO1)C2 1844251742 UPKOSXHWKSNSMX-FXAWDEMLSA-N 489.569 1.916 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCOC2)C1 1846691044 IYDGJRXQYOEWGN-ZWKOTPCHSA-N 489.569 1.774 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3C(=O)N3CCOCC3)cc2F)C[C@@H](C)O1 727440005 QPEGAIDSWVPJTQ-SELNLUPBSA-N 476.593 1.769 10 20 JDCD CC(=O)N1CCCN(CC(=O)NCCN2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)CC1 795797670 FZXJWRZGRPFYQO-UNOMPAQXSA-N 490.607 1.287 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CNS(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 831191600 QQLBNZWFEQNRQP-UHFFFAOYSA-N 481.958 1.519 10 20 JDCD CCS(=O)(=O)NCCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 918562704 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C[C@H](C(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1)N1CCN(C)CC1 1792314900 GBOPXIFMWUOGEM-MRXNPFEDSA-N 489.667 1.617 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796141323 WRDUYQKGQGAILA-YTFCPDLSSA-N 488.541 1.096 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)C1 1801139403 LPPAXGSAKSHPMN-RACNMONISA-N 490.557 1.343 10 20 JDCD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cn1 1802078950 MYPASJIDIJABDU-PGTXOHQNSA-N 483.521 1.443 10 20 JDCD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C(F)(F)F 1803997628 HAGIWKKYBFXERQ-MRAWALMUSA-N 490.529 1.261 10 20 JDCD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1805964583 BNAIKUIOEQYSKG-IQIBNGDESA-N 495.598 1.376 10 20 JDCD CC[C@H](NC)C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808466981 CVNPERPJMSDEDB-GREBRCKQSA-N 462.554 1.878 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cccc(O)n2)[C@H]1c1cccnc1 1814185697 DYBNDJMHFPPJIN-LIRRHRJNSA-N 471.564 1.362 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725876 RACXHOKJSHXTLJ-KGLIPLIRSA-N 454.512 1.140 10 20 JDCD N[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccccn1 1817341359 JNLWDJHEGGUYPW-RDTXWAMCSA-N 473.584 1.357 10 20 JDCD O=C(Nc1cccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846005 FXLSRHBWHGXZDJ-HNNXBMFYSA-N 451.443 1.556 10 20 JDCD Cn1ncc(Br)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1817912840 RJIDPOZXVBZOKO-VIFPVBQESA-N 493.343 1.985 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cncn2)[nH]n1 1823475369 RJJXBLZZOYATLF-ZKKXHLJNSA-N 453.459 1.524 10 20 JDCD CC(=O)C[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499639 QODAZBRPCTXXLS-RISCZKNCSA-N 451.574 1.877 10 20 JDCD Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CN2C(=O)CSC2=S)CC3)c1 1826756382 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1cn2cccnc2n1 1788310364 KXRQQFOVSPLNGK-MDKPJZGXSA-N 487.520 1.116 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CS(C)(=O)=O)C[C@@H]32)cc1 1790126350 VIYHJOIQFSSBLG-BVSLBCMMSA-N 473.595 1.732 10 20 JDCD CN1N=C(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)CCC1=O 1792313882 GHEBWYHHKFBEGT-UHFFFAOYSA-N 473.580 1.589 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2)c1cc(O)nc(O)c1 1796137852 QVOFVXFQWGSMQD-OYHTYJOISA-N 458.421 1.769 10 20 JDCD COC(=O)[C@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1796482488 AVZVAPXWJKGPJL-BANDYGIESA-N 496.564 1.348 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1occc1Br 1796544739 BRGFXKVUZLSCNP-WDAIWFPHSA-N 488.385 1.106 10 20 JDCD CNCCCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1807143608 NDIYDDJBVBFZJS-KBUQRTECSA-N 454.527 1.917 10 20 JDCD O=C(Cn1cncn1)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1807609935 ZZSLXRNGEXYQOM-NWWLCNQNSA-N 464.482 1.209 10 20 JDCD CC(C)n1nc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)cc1C(=O)O 1807990174 FXQIZEMZLGCERE-YCRPNKLZSA-N 494.508 1.997 10 20 JDCD O=C(/C=C/C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)NCc1ccco1 1807995254 NWWOTAHXWHNCMI-ZAZYYCSKSA-N 491.504 1.673 10 20 JDCD O=C(CNCP(=O)(O)O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1809660800 BBAVHBJPEZDJGC-UHFFFAOYSA-N 475.866 1.321 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cccn2cncc12 1810005370 FVDMAJJJJPXKCG-HRAATJIYSA-N 494.602 1.909 10 20 JDCD CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811808477 BJQIAMQFCDKPAY-PEELUZDISA-N 460.918 1.990 10 20 JDCD Cc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1F 1814186774 XAUHKPHHZNCXNU-ACJLOTCBSA-N 476.559 1.432 10 20 JDCD Cc1ccnc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1 1814188969 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2 1832185274 PIKGLGRXBKHWFP-HXUWFJFHSA-N 486.422 1.136 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCOC2)CC1 1832875485 NUSYVUOFGBVCGF-SJORKVTESA-N 453.630 1.893 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)[C@H]1CCCCO1 1833115445 PTBODTRWPYNFCR-GZNAHNRGSA-N 473.570 1.957 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@H](O)c1ccccc1 1834586193 FJQCUBSFCULXMU-OAQYLSRUSA-N 490.651 1.152 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3ccoc3c1)CCO2 1836454690 CWYMLQBRYMTSFB-DBTPONLISA-N 495.488 1.728 10 20 JDCD Cc1nccc(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)n1 1838156860 QJKMIXZYJZMHLH-UHFFFAOYSA-N 477.612 1.258 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(C)c1 1838904445 DWFYEAOBQMRSKB-JOCHJYFZSA-N 477.608 1.234 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)ccc1O 1840881233 KCNWDHXWFVKEMH-CIFMFNLYSA-N 484.505 1.601 10 20 JDCD CN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)cc2)CC1 1841036725 AQXOXWRSDFCZJH-UHFFFAOYSA-N 487.651 1.116 10 20 JDCD CC[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1841281159 PHVPVXRPEKLOQR-DLBZAZTESA-N 477.558 1.508 10 20 JDCD C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1)n1cnnn1 1843331691 XXEHMKLWWCGXKL-QFBILLFUSA-N 498.588 1.156 10 20 JDCD CCOC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)cc1 1847054772 OFADISYUORLAAO-UHFFFAOYSA-N 461.565 1.541 10 20 JDCD Cn1cc(C(=O)NCC2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)cn1 726706182 CJDKTMFBQHXWOH-UHFFFAOYSA-N 472.565 1.872 10 20 JDCD COC(=O)CC1=c2c(O)nc(/C(Cl)=C\c3ccc(C(=O)OC)o3)nc2=S=C1C(=O)OC 749452633 LYAFSNNEYFWIQK-UXBLZVDNSA-N 466.855 1.356 10 20 JDCD CN(C)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 916632257 UGPDZBMEFGAEFG-UHFFFAOYSA-N 479.525 1.176 10 20 JDCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 916677098 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C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)n1cccc1 1838803356 MKTYCDWRATXKJE-MRXNPFEDSA-N 478.640 1.908 10 20 JDCD O=C(CCc1ccc(F)nc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839432117 CACDMYFJBHMCGG-HSZRJFAPSA-N 493.919 1.988 10 20 JDCD CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)N(CC)CC 1839432315 KJELGBWWPAMAAV-JPYJTQIMSA-N 483.993 1.942 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1 1840880726 HHBJPSGZVRQZPZ-DBTPONLISA-N 495.488 1.728 10 20 JDCD C[C@H](Nc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880877 QSEPYHGGEPMJPA-XUOJWBCZSA-N 498.536 1.169 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1 1840881164 GJQRHPMSAKFONI-SKFGKQHZSA-N 494.504 1.235 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)Cc1cnc[nH]1)C2 1843331300 GUZYDRQOQGIPLO-HXUWFJFHSA-N 482.585 1.874 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2ccccc2[C@@H]1O 1847603299 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O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cccc2ccnn12 1812090658 VTKNKPNPVUEOGW-IIBYNOLFSA-N 494.602 1.909 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)Cc2cccnc2)[C@H]1c1cccnc1 1814189191 NAMFGFJVNYZFPS-UTKZUKDTSA-N 469.592 1.585 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1 1814189892 JYLXUKBMRKJYBL-MGPUTAFESA-N 495.590 1.533 10 20 JDCD CNC(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1824434286 DATOEEIZCSCBOT-HXUWFJFHSA-N 453.543 1.535 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2 1828247525 WUSFLHAUPRHDGD-MRVPVSSYSA-N 480.553 1.466 10 20 JDCD O=C(C[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1832340693 CIYHALKVRLQNOX-NBGIEHNGSA-N 484.553 1.195 10 20 JDCD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)N1C[C@H]2C[C@H]2C1 1835674421 NXNKWDMLKQVLCO-ZSPWKAPPSA-N 498.624 1.728 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)c3cnco3)CC2)CC1 1836980724 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O=C([C@H]1COc2ccccc2O1)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440928 IDMRBLMWBXBFQN-OAQYLSRUSA-N 460.490 1.823 10 20 JDCD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1)[C@H]1SC(=N)NC1=O 1845501209 NSPBEHKPUMXKFE-YMTOWFKASA-N 452.920 1.371 10 20 JDCD COc1ccc2c(CC(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)c[nH]c2c1 1847050852 KDQKWHCNWJPLGJ-UHFFFAOYSA-N 472.592 1.783 10 20 JDCD CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1847383474 CRPZBWQKIYKTEC-SFTDATJTSA-N 480.546 1.698 10 20 JDCD C[C@@H](CC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C 1847859464 VZSOKCOECSHZQH-LDTOTXGLSA-N 487.601 1.418 10 20 JDCD O=C1COc2ccc(Cl)cc2N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1 1848034891 WDCGYRFFKTYDEB-GJZGRUSLSA-N 472.885 1.387 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)Cc3c(C)nc4c(c(O)nn4C)c3C)CC2)cc1 729754203 QXVSDNWDSCWSGX-UHFFFAOYSA-N 467.526 1.734 10 20 JDCD O=C(COC(=O)Cn1[nH]cc2c(=O)ncnc1-2)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 730657947 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O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1825863692 QGDPHJOVNMDRHQ-HNNXBMFYSA-N 494.577 1.861 10 20 JDCD O=C(CN1C(=O)CNC1=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830735570 QRBHFUTUDUBOII-MRXNPFEDSA-N 478.933 1.536 10 20 JDCD Cc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1834065892 XZGJIEYLGUBFPM-DEOSSOPVSA-N 481.509 1.154 10 20 JDCD CN(C)c1ncc(C(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)o1 1834098250 PBXKIZRXQIPHPE-GQCTYLIASA-N 499.568 1.756 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cn2ccsc2n1 1835594751 NPKWWJYHJYVJCW-UHFFFAOYSA-N 470.555 1.701 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cn1)CCO2 1836037045 IMODQUZCWNFHKK-NCWHABTQSA-N 487.484 1.050 10 20 JDCD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cc(O)n1 1838031540 MZZUSRNMHWHZOO-UHFFFAOYSA-N 456.499 1.828 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1 1839431725 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20 JDCD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509834 AJELXCNXEGUDKA-ZSSJHJOWSA-N 467.522 1.920 10 20 JDCD Cc1scc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1C 1785537965 GDBZDYRKMQMSEE-LJQANCHMSA-N 453.611 1.669 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cc(F)ccn1 1794301251 HSLJOXAMJWLYFR-MUJYYYPQSA-N 450.561 1.652 10 20 JDCD COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)CC2)ncn1 1796600763 ATEHNBPRWRIRLB-BCDXTJNWSA-N 482.541 1.460 10 20 JDCD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1800744393 QOZYNYCNTLGBSS-WMIGDMCZSA-N 484.509 1.011 10 20 JDCD O=C1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)N1 1806817456 OXENQUHXBNEHQH-URKNILKWSA-N 458.902 1.744 10 20 JDCD CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nn1 1807995328 QEAGRDSIWNYKFN-QRWLVFNGSA-N 465.514 1.868 10 20 JDCD C[C@H](C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1)n1cccc1C=O 1809998621 SWXMJOHHMVWAHQ-MRXNPFEDSA-N 476.624 1.953 10 20 JDCD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)nn1 1811212209 MAWZSHHUMGYBNH-KOSHJBKYSA-N 499.531 1.993 10 20 JDCD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1812324597 UQQSYBLCGDZDDM-BEWGVOAYSA-N 480.521 1.958 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc(=O)oc2)[C@@H]1c1cccnc1 1814185827 GMUHIYWXAWWYIY-IFXJQAMLSA-N 472.548 1.215 10 20 JDCD Cn1ncnc1C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362895 AUYXHTYPAOGYSP-LBPRGKRZSA-N 464.511 1.290 10 20 JDCD N=C1NCCN1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146475 KHCLGCHMSFJMRK-GOSISDBHSA-N 477.529 1.035 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)C1CCOCC1)CC2 1828242165 AXYIWAMGOMREAV-LLVKDONJSA-N 454.599 1.342 10 20 JDCD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1828900662 VNXNSAMUVHSMSN-QFIPXVFZSA-N 490.607 1.319 10 20 JDCD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)C1 1830713504 CPSXZXMMELGMHH-WBPRFABPSA-N 496.944 1.411 10 20 JDCD O=C1C[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CN1 1832878341 LVUXSMKXTGHYMA-KEEVIKFDSA-N 457.527 1.572 10 20 JDCD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833358323 QLXFKELNZMOATJ-HNQUOIGGSA-N 485.497 1.893 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(O)n1)CCO2 1834193634 ULPATZWEZWIESY-OAQYLSRUSA-N 463.874 1.236 10 20 JDCD C[C@@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988505 ZYRRLLZUYZWBOF-INIZCTEOSA-N 456.547 1.211 10 20 JDCD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1835844011 BASDPNTVZHGSSK-LJQANCHMSA-N 496.992 1.088 10 20 JDCD Cc1nnc(CCC(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1837172800 JCLFPYVUZAQKCP-UHFFFAOYSA-N 475.571 1.898 10 20 JDCD Cn1cc(CC(=O)N2CCC(OC3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)cn1 1838111969 YQPPAMGEENZRAF-UHFFFAOYSA-N 492.580 1.754 10 20 JDCD COCc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)c1 1838528686 BQWSAGZRKAODCH-UHFFFAOYSA-N 494.639 1.634 10 20 JDCD O=C(CCN1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839435330 HEYZKXWNSRXWGG-JOCHJYFZSA-N 467.950 1.307 10 20 JDCD Cc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839941097 NHSXQLXZTAQTEO-XMMPIXPASA-N 455.511 1.504 10 20 JDCD CCOC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840885958 JXDXDTAZKMUENE-JOCHJYFZSA-N 484.933 1.411 10 20 JDCD O=C(CCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840897468 FLMFDRQUJFJGTC-JOCHJYFZSA-N 495.598 1.075 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840952670 QQQUUXNPWSCDRT-WOJBJXKFSA-N 489.566 1.049 10 20 JDCD O=C(c1nnc(-c2ccccc2)o1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056481 OIOKULLGHRFZLI-UHFFFAOYSA-N 457.537 1.414 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(C(N)=O)c(C)c3)CC2)cc1 729059023 WHOVLRHLRBYJER-UHFFFAOYSA-N 453.543 1.370 10 20 JDCD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2ccc(CC(=O)N3CCN(C)CC3)cc2)c1 729061483 FWHQRFRZZNGCKZ-MRXNPFEDSA-N 454.527 1.533 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccccc3OCCC(N)=O)cc2F)C[C@@H](C)O1 918286558 IYUGYQZPTFTBLL-HZPDHXFCSA-N 472.517 1.948 10 20 JDCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 918337215 GSMIMVIINBTGGT-UHFFFAOYSA-N 455.496 1.945 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCNS(=O)(=O)c3cccs3)cc2)C1 918374044 JQDGDUKKRMJCQM-INIZCTEOSA-N 450.586 1.435 10 20 JDCD CN1CCN(C(=O)c2ccc(NC(=O)C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)CC1 920192435 IOIINYXDXSJLQW-UHFFFAOYSA-N 481.622 1.882 10 20 JDCD CCCCN(C)S(=O)(=O)c1ccc(N/C=C2\C(=O)NC(=S)N(CCOC)C2=O)cc1 920980571 QMMFRPWJXQFLMI-DTQAZKPQSA-N 454.574 1.293 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc3c(c1)OCO3)C2)c1cc(O)nc(O)c1 1777847788 PVXINHOCGDJHOC-CJFMBICVSA-N 483.521 1.982 10 20 JDCD C[C@@H]1CCc2c(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)c4cc(O)nc(O)c4)C3)n[nH]c21 1777848082 IVDKSPMGBIEJFJ-DBOTXTLRSA-N 455.515 1.707 10 20 JDCD CCc1ncsc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1780447022 UDRFLGSRECIMMS-UKKYDJSUSA-N 459.524 1.979 10 20 JDCD COc1ccc(Cl)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1782979555 RMYNIWSDURGXCN-OAQYLSRUSA-N 498.026 1.581 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccccc1)C2 1783246481 WSZUYFZHSVUAMJ-OPAMFIHVSA-N 475.592 1.244 10 20 JDCD O=C(CC1Cc2ccccc2C1)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547100 WSYFTSORDNTLRY-HSZRJFAPSA-N 473.620 1.482 10 20 JDCD Cc1ccccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547337 XPIGAEKJQZUAHI-QFIPXVFZSA-N 461.609 1.618 10 20 JDCD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN2C(=O)CSC2=S)C3)cc1Cl 1792659866 QBHRBBKFRJIDPN-ZSBFGKGUSA-N 468.000 1.712 10 20 JDCD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cs1 1794909113 HFFYUHSKJYLPQT-YVWYUNDQSA-N 453.524 1.448 10 20 JDCD COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1796480456 IDNOMHFYUPRXDH-MXVJPWMRSA-N 496.564 1.348 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1796740287 QSPSVDLLIBGIRU-NFBUACBFSA-N 499.568 1.303 10 20 JDCD C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1797669545 VWKRGHIEAICTAK-MUJRHELTSA-N 467.522 1.907 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cc(Cl)c2nncn2c1 1797689582 BVOAIQONDCFMCL-FVCICTRLSA-N 492.319 1.964 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCO2)C1=NN(c2ccccc2)C(=O)C1 1798098370 QJKJVCWREDXRET-VBUUOAMHSA-N 462.510 1.710 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cc(-c2ccccc2)[nH]n1 1798666212 IFNTZDSRGWSMOT-YVWYUNDQSA-N 485.591 1.140 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(NC(=O)c2ccco2)cc1 1799844493 SITPYSMTBQZMPF-FAQVEIGNSA-N 492.488 1.855 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(F)cn2n1 1801190560 ARIXBYRYLVZLKK-FJYVKWIBSA-N 467.457 1.950 10 20 JDCD COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802078675 CCFTUQJBDHCCPQ-ITLXPADYSA-N 483.521 1.443 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)cc1)C2 1802106988 DPDUZZBSOYHOKS-FVCICTRLSA-N 453.973 1.404 10 20 JDCD Cc1ncc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)[nH]1 1803817786 DWTIXVLTSZKZMV-KDOFPFPSSA-N 458.569 1.293 10 20 JDCD COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)cc1F 1804340015 FWJJDDAEAXZRNQ-QDMKHBRRSA-N 465.572 1.875 10 20 JDCD CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1F 1805174897 DJWOYDXVPRLBQN-RNODOKPDSA-N 454.462 1.946 10 20 JDCD CCc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1F 1805182341 BJOCRMBLJJORLQ-BFUOFWGJSA-N 490.586 1.686 10 20 JDCD COCc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c1 1811356145 PWRDVHYAJWKEJC-OXQOHEQNSA-N 487.607 1.736 10 20 JDCD CN(CC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1)C(=O)C(=O)O 1811808999 GPNYPULPCDBHFZ-FZKQIMNGSA-N 490.900 1.009 10 20 JDCD COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)CC1 1812694902 YBUXGNATFNLGPY-XZOQHERRSA-N 481.505 1.871 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@@H]1c1cccnc1 1814185895 HZGVZAQMXLICEZ-CXAGYDPISA-N 490.998 1.705 10 20 JDCD Cc1ncncc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814188874 CUCPFXLNERIDGN-HNAYVOBHSA-N 470.580 1.360 10 20 JDCD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)n1 1817845928 CEJJZRNNZLPQBA-INIZCTEOSA-N 481.513 1.822 10 20 JDCD CN1CCC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)C1 1820729298 CQJHWPPOJLTUPI-HIFRSBDPSA-N 464.617 1.604 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825497631 YVNJCDYJKVXIQC-HNNXBMFYSA-N 478.596 1.179 10 20 JDCD Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1834243457 NGERNUJJGFEWJP-UHFFFAOYSA-N 465.601 1.029 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1nnsc1C1CC1 1835211646 YRNJZKRLFLKUST-UHFFFAOYSA-N 472.571 1.721 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2 1837417634 GETWMTBBXHTVRS-UWJYYQICSA-N 452.891 1.514 10 20 JDCD O=C(COc1ccccc1)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1837693853 SBWHROXDOOWZRK-UHFFFAOYSA-N 491.635 1.924 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838864576 MPAYODAAIKVQFX-COIATFDQSA-N 490.459 1.865 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2 1839042156 HLWCDTVGFRCYCV-HSZRJFAPSA-N 489.475 1.573 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cccn4nccc34)C2)C1 1840881163 GJQRHPMSAKFONI-BFHGXFJZSA-N 494.504 1.235 10 20 JDCD 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459.930 1.937 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1782007958 QJNZQXRCKVRTJA-NRFANRHFSA-N 464.858 1.625 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2 1785508302 DOJUOCHDVHNMDZ-SWQPOGFJSA-N 465.506 1.856 10 20 JDCD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)C1 1785513072 JJCCDJWZRPOXOR-GTAYFMOCSA-N 476.530 1.240 10 20 JDCD O=C(/C=C/c1cccs1)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538836 ZKQLOGOIDDBZIP-GNAXCBTBSA-N 451.595 1.452 10 20 JDCD COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1 1785545277 MPCBGGAECGDDLP-NRFANRHFSA-N 479.580 1.008 10 20 JDCD NC(=O)[C@@H](N)CCC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1788055439 ZPTKYNJIFXQFPE-IBGZPJMESA-N 476.537 1.506 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21 1792241766 BTYKOGOBSYYOEM-CAMMJAKZSA-N 489.619 1.220 10 20 JDCD 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COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)nn1 1811212216 MAWZSHHUMGYBNH-UUOWRZLLSA-N 499.531 1.993 10 20 JDCD COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1813267049 MXSXGHDNZQMWIT-JTSKRJEESA-N 478.509 1.236 10 20 JDCD CCN(CC)C[C@H](C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189127 AQHZTJVDTINQIY-YRISNDGFSA-N 491.683 1.926 10 20 JDCD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)nn1 1814190348 XUJZGBYIORZRIZ-IFXJQAMLSA-N 486.579 1.060 10 20 JDCD C[C@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1815294129 IMWLCUCEDLBWEN-KDOFPFPSSA-N 465.514 1.706 10 20 JDCD O=C(CCNC(=O)c1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816728821 WGWODGLPHDLWDX-OAHLLOKOSA-N 481.534 1.995 10 20 JDCD COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817845808 XQRMJWOXAPMZGO-HNNXBMFYSA-N 455.475 1.679 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3cccn4cncc34)sc2C1 1819318330 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CC(C)(C)[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896895 SXLYWGUVIAMBPS-MAUKXSAKSA-N 455.646 1.873 10 20 JDCD Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1F 1833709156 BUVXZZBYWRTFBH-OAQYLSRUSA-N 482.896 1.316 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1)c1cc(O)nc(O)c1 1834987195 HYTZCGOEPYJDHG-UHFFFAOYSA-N 465.514 1.263 10 20 JDCD Cn1ncc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5cc(O)nc(O)c5)CC4)CC3)ccc21 1835415897 IFHIQTCKOWCHTP-UHFFFAOYSA-N 478.553 1.879 10 20 JDCD Cc1noc(N)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1835628427 QLQGFRDRUAVTPV-FQEVSTJZSA-N 466.878 1.014 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1 1838031733 IZLGHGJTWGUNEM-UHFFFAOYSA-N 484.488 1.601 10 20 JDCD C[C@@H]1CCc2c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cc(O)c(O)c(Cl)c5)CCO4)C3)n[nH]c21 1839434317 YTRQUNYKMRJTSI-JCQPUDPBSA-N 490.944 1.908 10 20 JDCD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)o1 1840507391 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O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O)[C@@H]1CCc2nc[nH]c2C1 1804291235 HCQIKGILCGBBQM-WKFDSDSDSA-N 452.511 1.983 10 20 JDCD NC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc(O)c(O)c2O)cc1 1804291610 PPXSQASQMBTEFS-GFPDGJBOSA-N 451.479 1.868 10 20 JDCD COc1cccc(CC(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)n1 1804397017 SOTZKMQXAYPBOA-OPAMFIHVSA-N 499.618 1.594 10 20 JDCD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c(O)n1 1811484442 KRMCRHPAWLKUFL-BEFAXECRSA-N 485.591 1.671 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ncc(F)cc2F)[C@H]1c1cccnc1 1814184712 DLOIJPAWGLQASW-YJYMSZOUSA-N 491.545 1.935 10 20 JDCD O=C(CCN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1815476533 OSRFKHHLJQFWDS-YERXGYGTSA-N 495.492 1.547 10 20 JDCD O=C1CC(C(=O)N[C@H]2CCc3nc(NC(=O)C4=NN(c5ccccc5)C(=O)C4)sc3C2)C1 1817367018 MZAGKJWICXNFAB-ZDUSSCGKSA-N 451.508 1.827 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1 1819016231 YQOFJOAIDNRATE-SNVBAGLBSA-N 487.592 1.272 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)CCc2ncc[nH]2)[nH]n1 1823499462 HIWQBUQDBHIHKS-ZDUSSCGKSA-N 461.573 1.618 10 20 JDCD Cn1nc2c(c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN3C(=O)CSC3=S)n[nH]1)CCC2 1823499629 QCWVTOIPFAMVGT-HNNXBMFYSA-N 487.611 1.798 10 20 JDCD CS(=O)(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)c(O)c(Cl)c1)CC2 1827211477 GTHPSPIFWGRFKV-JTQLQIEISA-N 473.960 1.868 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(Cl)cn1)CC2 1828242651 PTEUYPVKDGOVAH-SNVBAGLBSA-N 485.016 1.466 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cccn3nccc13)CC2 1828247015 NCOAAHZFWQSEMF-LLVKDONJSA-N 486.604 1.877 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2 1828247526 WUSFLHAUPRHDGD-QMMMGPOBSA-N 480.553 1.466 10 20 JDCD O=C([C@H]1CCCOC1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899674 DQAVWPUJSMXWIV-IRXDYDNUSA-N 453.630 1.893 10 20 JDCD O=C(/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1)NC1CC1 1832902532 PTSXEUZDHODBTE-JTGQJZMRSA-N 478.640 1.301 10 20 JDCD Cc1ccc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cc(O)nc(O)c5)C4)C3)sc2c1 1834567281 ADDAUIBZFAGUNR-HSZRJFAPSA-N 484.534 1.795 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1)c1cc(O)nc(O)c1 1834987672 UDUOMVUKNZICKR-UHFFFAOYSA-N 454.531 1.135 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1[nH]cnc1-c1cccnc1 1836097970 FWVIHENLTMCKGE-UHFFFAOYSA-N 491.552 1.777 10 20 JDCD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836419576 MWIKPJWXSCAWRY-FYSMJZIKSA-N 473.501 1.581 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccn34)C2)C1 1839434196 UEGAGAQEDHMRGA-HSZRJFAPSA-N 486.912 1.783 10 20 JDCD CC(C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880148 YQMCTAFXVKGXKL-BVBLWJPBSA-N 464.515 1.088 10 20 JDCD COc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840880359 LIPBTDAVFDUKET-WHVGEVHXSA-N 498.532 1.524 10 20 JDCD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)s1 1840880569 WEDWNQAKAPLDBB-KURNWNDPSA-N 474.535 1.957 10 20 JDCD Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897791 WVEQSFIMKZCTIG-OAQYLSRUSA-N 481.571 1.064 10 20 JDCD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843250837 UIBMTSAKRMQFGX-UHFFFAOYSA-N 455.490 1.761 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1 1846154341 YWPBHVLVXCZAPE-FBCAMTSGSA-N 475.501 1.930 10 20 JDCD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1847036856 HINRGRRCQBPFHC-OLMWUWOUSA-N 458.511 1.999 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1ccc2ccc([N+](=O)[O-])cc21 1847716037 GNNBFLLCIZSVQJ-HOTGVXAUSA-N 487.563 1.612 10 20 JDCD CNC(=O)C1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)CC1 29164925 KHYZLOFHRVTLDD-WOJGMQOQSA-N 490.607 1.191 10 20 JDCD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 726183284 DFEQJHKHUOOKKA-LJQANCHMSA-N 478.565 1.012 10 20 JDCD CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1 787956400 ZRTMHPZACPMSSV-UHFFFAOYSA-N 461.540 1.499 10 20 JDCD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 917709391 HEFUPHQOVPXBHZ-UHFFFAOYSA-N 454.506 1.670 10 20 JDCD CC(C)NS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1F 918645822 ZBAHZWYHPSEDBO-UHFFFAOYSA-N 483.587 1.677 10 20 JDCD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCc1cc(O)n2ncc(C(=O)OCC)c2n1 919472695 JCCQFQDYUPGAKT-HNNXBMFYSA-N 454.505 1.249 10 20 JDCD CS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 919622257 NPKOZWDDQDFXRX-UHFFFAOYSA-N 468.478 1.678 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccccc2S(=O)(=O)N2CCCCC2)c1 919810204 HJDWJBQLSBCXEB-UHFFFAOYSA-N 467.569 1.868 10 20 JDCD COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1[C@]1(C)NC(=O)NC1=O 920865671 KOPJPAPDKZDDDU-WNSKOXEYSA-N 488.566 1.626 10 20 JDCD C[C@@H](NC(=O)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1)c1ccc(N2CCOCC2)cc1 920925621 KLYNKEXLQYVUPT-MRXNPFEDSA-N 460.556 1.589 10 20 JDCD CCN1C(=O)C(=CNc2ccc(S(=O)(=O)N[C@@H](C)COC)cc2)C(=O)N(CC)C1=S 920979865 LASIFNNYKTXEME-ZDUSSCGKSA-N 454.574 1.291 10 20 JDCD CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777846326 BVAGOQLDFUNALQ-WZONZLPQSA-N 489.550 1.338 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nccnc3c1)C2)c1cc(O)nc(O)c1 1777848413 TUDGFYMUTLLUBJ-NTKDMRAZSA-N 463.494 1.877 10 20 JDCD Cc1cncc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)c1 1777848988 HEOHVSQVZMNEID-NTKDMRAZSA-N 454.527 1.957 10 20 JDCD Cc1nc2ncccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1778630642 MDMLAQGQHPDQMT-WAIKUNEKSA-N 466.498 1.285 10 20 JDCD CC(=O)Nc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)ccc1C 1781913626 GSFWNNKHFBWQSC-JOCHJYFZSA-N 490.607 1.257 10 20 JDCD O=C1CCc2ccc(C(=O)N3CC[C@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)cc2N1 1782515049 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CC(C)(C)OC(=O)NCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1792121161 PHOYQBYOVVUZJB-BPUTZDHNSA-N 464.519 1.001 10 20 JDCD Cc1cc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792244960 DKAHMVUSCDRDDS-JQFCIGGWSA-N 465.572 1.588 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@H]2CO[C@@H](CNC(=O)C34CC(c5ccccc5)(C3)C4)[C@H]2C1 1792334900 MDBJEZSNIRYKBD-MYGNMKRCSA-N 499.658 1.948 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cnc(OCF)cn1 1794410849 JVJFYMHXNUUKMK-DPIQGUFMSA-N 466.853 1.364 10 20 JDCD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O)c1ccc(O)cc1 1802079777 WLOYHOFCOPAZJC-OYPVDPKUSA-N 468.506 1.916 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)C1CCN(c2ccccn2)CC1 1804336175 ZSNAUTLZSUMUER-BCDXTJNWSA-N 487.651 1.797 10 20 JDCD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)n1 1804582065 TUXAMPRZLYEYFK-UTKZUKDTSA-N 486.623 1.461 10 20 JDCD O=C(CCN1C(=O)C=CC1=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1806385394 AZYHAJUPCCWVMZ-UHFFFAOYSA-N 475.929 1.911 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)NC[C@H]1CCN(C(=O)CN)[C@H]1c1cccnc1 1808211818 VIZHZEAIEJBCNZ-LSWJPFSZSA-N 496.612 1.764 10 20 JDCD Cc1cnoc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1811248322 NSDIQDGLLUTKNR-RHSMWYFYSA-N 459.553 1.558 10 20 JDCD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)N1CCN(C)CC1 1817847532 JRKWAVSYRYOLHQ-RHSMWYFYSA-N 457.535 1.158 10 20 JDCD Cc1nn(C)c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823500879 HVFSNEXXAATLRD-MRXNPFEDSA-N 489.627 1.855 10 20 JDCD CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1823879660 YTNRVIGNUOITKD-OAQYLSRUSA-N 482.585 1.670 10 20 JDCD Cn1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)n1 1832898608 RUYKJQGMHMLDGZ-QGZVFWFLSA-N 463.629 1.443 10 20 JDCD O=C(CSc1nc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899316 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1837865149 HJKNYQUHBYACCX-UHFFFAOYSA-N 469.586 1.778 10 20 JDCD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)cn1 1839432214 HFODGMTUBHDQJI-QFIPXVFZSA-N 477.901 1.539 10 20 JDCD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CN2C(=O)CSC2=S)CCO3)c1 1840895406 SIEHXDQKFMDBBK-QHCPKHFHSA-N 491.635 1.244 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840948705 OLHSJKCQJBKOEK-RTWAWAEBSA-N 453.442 1.308 10 20 JDCD CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c1Br 1843249904 OCIJJMWQJGKKHM-UHFFFAOYSA-N 464.320 1.682 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)Cc1cncnc1)C2 1843330843 PBKAQNPWKOTYDK-OAQYLSRUSA-N 494.596 1.941 10 20 JDCD CN1Cc2ccccc2C[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1848069345 OZCGCHZBKYRMDL-OKZBNKHCSA-N 458.609 1.105 10 20 JDCD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2)CC1 109461090 FWSDEELISSMARE-UHFFFAOYSA-N 470.595 1.852 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)c3cccc(CN4C(=O)CNC4=O)c3)CC2)cc1 115527791 HTHFHWANJPIKSQ-UHFFFAOYSA-N 465.554 1.689 10 20 JDCD Cc1cc(C(=O)COC(=O)[C@@H](O)C2CC2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 730883379 OJQPBSNDRUVEHJ-QFIPXVFZSA-N 476.551 1.612 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)CC2)cc1 743362746 IKUIKHJBETVKDM-OAQYLSRUSA-N 497.596 1.441 10 20 JDCD CN1CCN(C(=O)Cc2ccc(NC(=O)C(=O)NCc3ccc4c(c3)CCCN4C)cc2)CC1 747017376 AINVNSSUTDDMJG-UHFFFAOYSA-N 463.582 1.640 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccnc3S(=O)(=O)C(F)(F)F)nc12 747965067 IEHPOSQSCHQNDE-UHFFFAOYSA-N 474.373 1.657 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)CNS(=O)(=O)c3ccc(C(C)=O)cc3)CC2)cc1 787901645 UBXCGWYTDONZQP-UHFFFAOYSA-N 488.610 1.505 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CCNS(=O)(=O)/C=C/c3ccccc3)CC2)cc1 834636592 QYFDPMADSREKDM-LDADJPATSA-N 487.578 1.867 10 20 JDCD CNS(=O)(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 915421884 JMKWKIUTUYTLBN-GFCCVEGCSA-N 481.486 1.882 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)N3CCN(C(=O)N4CCCC4)CC3)CC2)cc1 916197120 UMIKNTHWQCNMEC-UHFFFAOYSA-N 458.607 1.750 10 20 JDCD COc1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1S(=O)(=O)N1CCOCC1 918374658 SXTDFWMJZBRKFO-UHFFFAOYSA-N 461.540 1.805 10 20 JDCD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 919699350 LPOQRDKFEXJBAZ-MRXNPFEDSA-N 480.466 1.969 10 20 JDCD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 919971487 OLDRGXAVEUEWJX-UHFFFAOYSA-N 479.574 1.950 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)S(=O)(=O)c3ccc(F)cc3)nc12 920532011 ALSGSGBHMFZKPO-LLVKDONJSA-N 451.432 1.656 10 20 JDCD COc1ccc(CNC(=O)[C@H](C)OC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OC 920637989 PNFFYKUCRHXTJX-LBPRGKRZSA-N 452.485 1.643 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCN(C(=O)Cc3ccccc3Cl)CC2)c1 920863601 WIRNFKGPAHGAPH-UHFFFAOYSA-N 451.932 1.944 10 20 JDCD Cc1cc2nnc(C(=O)N3CC[C@@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)c(C)n2n1 1777787230 RRUFNUCTHMPUTF-JIBKAZCMSA-N 494.508 1.015 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cccs1)C2)c1cc(O)nc(O)c1 1777849431 VOEQNIKRDOPYAF-OPAMFIHVSA-N 474.539 1.112 10 20 JDCD O=C(CN1CCSCC1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003479 RLWIDLOYBLYFRH-FQEVSTJZSA-N 455.964 1.244 10 20 JDCD Cc1nn[nH]c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783221944 BNQUYCVZHQLQGI-LDXXOOENSA-N 457.487 1.071 10 20 JDCD CN(C)c1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)CN2C(=O)CSC2=S)CCO3)cc1 1784245842 QDOIYUICXKTBQW-QHCPKHFHSA-N 490.651 1.375 10 20 JDCD C[C@@H](Cn1ccnc1)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1784498662 SIFDWXUQODJOQF-UUOWRZLLSA-N 464.526 1.142 10 20 JDCD CC[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1)c1ccccc1 1785538474 REOKAZYZAWGVAH-VGOFRKELSA-N 461.609 1.870 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1785538500 RTWFPXHNRXZNJR-FQEVSTJZSA-N 481.621 1.377 10 20 JDCD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)nc2ccccc12 1785540019 LAEODMQKLDWJTO-HSZRJFAPSA-N 484.603 1.847 10 20 JDCD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785545424 RPHZSPYBKKMGNV-HXUWFJFHSA-N 496.542 1.346 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)c1cc(O)nc(O)c1 1787290088 CRBVTKVARIFMBR-SZMVWBNQSA-N 472.567 1.206 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21)c1cc(O)nc(O)c1 1787292361 VYYZKPXMRKOWIG-JKOKRWQUSA-N 466.288 1.755 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccn3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787539018 FDVAOOPNWCRQEH-XJABCFGWSA-N 461.522 1.397 10 20 JDCD Cc1n[nH]cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787540095 CPWOMSHDMCLSBN-QSFXBCCZSA-N 450.499 1.104 10 20 JDCD COc1cc(C)c(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1790291889 GEIMQGSFPJHZIA-IEZWGBDMSA-N 491.635 1.766 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc2cccnc2nc1O 1790363837 HHKQQYBAWCUFPX-JQFCIGGWSA-N 465.466 1.049 10 20 JDCD COc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792239755 JZJJMDACAULMCZ-QRTARXTBSA-N 463.581 1.149 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)[C@@H]1CCC(F)(F)C1 1792439233 DZOJTFXGCKKXJB-OUQWMGTCSA-N 452.454 1.842 10 20 JDCD C[C@H](Nc1nccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1796414629 AVJOFMFPHDJNCW-VFFTVRQLSA-N 466.947 1.912 10 20 JDCD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccccn1 1801471298 SHKZSTIEBHFQLI-FCMNNSAISA-N 453.495 1.605 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1cnn(-c2cccnc2)c1 1804331390 VXZZTJXXXLYNKT-MUJYYYPQSA-N 470.580 1.379 10 20 JDCD COCc1c[nH]c(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)c1 1807995931 VSGPEAOKWOWYGQ-IIBYNOLFSA-N 451.483 1.996 10 20 JDCD CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)ccn1 1808923495 HGWGLHNWTSRTCX-JTSKRJEESA-N 476.493 1.875 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)c1cc[n+]([O-])cc1 1811204258 YJIAELBSRVQOMN-YCUVPZCXSA-N 476.489 1.865 10 20 JDCD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190859 BAAPFOPXLUAWAT-VKJFTORMSA-N 482.653 1.062 10 20 JDCD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)no1 1814191074 GSQNAUMHNUEGOM-FOIQADDNSA-N 473.580 1.487 10 20 JDCD Cc1nc2ncccn2c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816725232 MNSYFXSAPINODS-GFCCVEGCSA-N 465.495 1.840 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ncccc13)CC2)c1cc(O)nc(O)c1 1816726532 ZYQQSFAUIIENIJ-JTQLQIEISA-N 451.468 1.760 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc[n+]([O-])cc1)CC2)C1=NN(c2ccccc2)C(=O)C1 1817361666 BLBNDWQCANLASU-OAHLLOKOSA-N 476.518 1.795 10 20 JDCD COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n1 1818262371 ORJDENCTHBLTBP-OAHLLOKOSA-N 491.599 1.419 10 20 JDCD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)c(O)c(Cl)c2)n[nH]1 1821291731 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455.515 1.728 10 20 JDCD C[C@H](Nc1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902441 MDYSVFDEHPITQG-DOTOQJQBSA-N 490.655 1.757 10 20 JDCD COC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1833115840 KNSKGCPQEWSDDU-UHFFFAOYSA-N 469.586 1.776 10 20 JDCD CC1(C(=O)NC2CCN(C3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)CCCC1 1833128221 VTALQCZFEJZGNJ-UHFFFAOYSA-N 466.673 1.999 10 20 JDCD Cc1cccnc1C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1833577776 DOKQQNCSLOGLGN-UHFFFAOYSA-N 475.640 1.436 10 20 JDCD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)cn1 1833888157 KRZWMJJAKLAGHQ-AREMUKBSSA-N 491.548 1.507 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cncn1-c1ccncc1 1834013659 KCRJRIVILNZHTQ-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD Cc1c(C(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)cnn1C 1834281323 KAOFWNRLYDDGNX-GQCTYLIASA-N 483.569 1.744 10 20 JDCD C[C@]1(C(=O)N2CCC(N3CCC(NC(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)CCCN1 1835133964 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Cc1cc(C(=O)CN2C(=O)[C@@H]3CN(C(N)=O)CCN3C2=O)c(C)n1-c1ccc(OC(F)F)cc1 729263807 JEACOQNCEUNVLU-KRWDZBQOSA-N 475.452 1.905 10 20 JDCD COc1ccc(N2CCN(CCCNS(=O)(=O)c3cccc(-n4cnnn4)c3)CC2)cc1 742624750 RGRHTRXHEILYPZ-UHFFFAOYSA-N 457.560 1.162 10 20 JDCD COc1ccc(CNC(=O)CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 742928507 UMMVYFLZZCOMLZ-UHFFFAOYSA-N 455.559 1.441 10 20 JDCD Cc1ccccc1CC(=O)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 749908213 SZPMFCNEFDLABN-UHFFFAOYSA-N 468.573 1.974 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccccc3CN3C(=O)CNC3=O)cc2)C1 918039565 JKNRIACLMGRBRJ-SFHVURJKSA-N 464.526 1.762 10 20 JDCD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918372636 OAAKWCBZOVYJQS-WMZOPIPTSA-N 474.583 1.380 10 20 JDCD CN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1 918444813 WTJTUWCJHBRKLY-UHFFFAOYSA-N 458.490 1.789 10 20 JDCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 918644533 BXLSJGNENAPACI-RTWAWAEBSA-N 491.610 1.520 10 20 JDCD CCO[C@@H]1C[C@@H]1C(=O)OCC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 919430439 CVEUSXYVBYXXJC-IYOXFDBGSA-N 478.548 1.701 10 20 JDCD C[C@H](NC(=O)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21)c1ccc(N2CCOCC2)cc1 920923060 MOUWGISGCCAXQN-KRWDZBQOSA-N 486.594 1.540 10 20 JDCD CCN(CC)c1ccc(S(N)(=O)=O)cc1N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O 920980732 YWAQOPMEZQRGJZ-UVTDQMKNSA-N 453.590 1.375 10 20 JDCD COc1ccc(C(=O)NC2=S=C(C(=O)NCc3ccccc3CS(C)(=O)=O)C=C2)cc1 1535336114 UIIUYHXVXAVGQC-UHFFFAOYSA-N 458.561 1.891 10 20 JDCD COc1ccc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2 1782933625 PYAWEOQEWKARAC-VGOFRKELSA-N 495.598 1.822 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1 1783242063 QEFSECLIIXTWHV-YFTVHVBSSA-N 454.479 1.595 10 20 JDCD COc1cc(C)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783246764 HMEDRRDUWVILOW-WZONZLPQSA-N 491.635 1.991 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2 1785510171 QGZDAUPNMQMVAM-VWLXRYFESA-N 476.432 1.944 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)CCO2 1785541497 VLOVZDNCVLNBRI-VWNVYAMZSA-N 489.644 1.565 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1785544995 GVTTZMZWVPBRHX-IBGZPJMESA-N 482.515 1.038 10 20 JDCD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1F 1785547147 YZCCDLLDOMSBAZ-OAQYLSRUSA-N 481.571 1.067 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cn2ncccc2n1 1788017745 SADRVIAIWFWGPW-YEWDVWPNSA-N 471.901 1.701 10 20 JDCD CC(=O)N(C)[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1788660072 SVPUXZWXEDNQTK-ZDUSSCGKSA-N 462.597 1.848 10 20 JDCD Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)c1Cl 1789084290 QAUHQJNMCYGGGX-RLLPRBGTSA-N 476.917 1.497 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3CCC4)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790246188 QJVFOPVAUVZEMD-ODYMNIRHSA-N 460.918 1.801 10 20 JDCD 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480.521 1.462 10 20 JDCD CC(C)OCC(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1833135794 NVIJTMDUWIQWMY-UHFFFAOYSA-N 469.586 1.776 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1)c1cc(O)nc(O)c1 1834987247 JJYIDIXJWSPUTJ-UHFFFAOYSA-N 464.526 1.640 10 20 JDCD O=C(CSc1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1835089969 NGMFQPOYFWFVCG-JOCHJYFZSA-N 459.524 1.355 10 20 JDCD C[C@@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835107317 UKEZZWJLCNXRKK-CQSZACIVSA-N 474.587 1.635 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3ccncc3O)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835132896 YKCDMGAGSPCDQH-UHFFFAOYSA-N 490.564 1.765 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cc2ncsc2[nH]1 1835850785 ZJBCOLNXTLQIOP-UHFFFAOYSA-N 470.555 1.930 10 20 JDCD CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)s1 1837725331 KXNJNHSQWXQATG-FIYNHDKVSA-N 489.550 1.606 10 20 JDCD Cc1cccc(CCC(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)n1 1840879852 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917709479 YVVBJUFVURXITQ-UHFFFAOYSA-N 495.529 1.671 10 20 JDCD CCN(CC)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NCc1ccc(N(C)C)cc1 918246012 IVRIKQMUOLWVGM-UHFFFAOYSA-N 458.584 1.989 10 20 JDCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21 918267488 SJUZIONKZWXIAN-QHCPKHFHSA-N 478.549 1.556 10 20 JDCD C[C@]1(C2CC2)NC(=O)N(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1=O 919699546 RDEHPEWBBXGKKL-XMMPIXPASA-N 481.532 1.279 10 20 JDCD COc1ncccc1NC(=O)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919799965 MOJOLIQUJYWJNP-UHFFFAOYSA-N 465.489 1.601 10 20 JDCD C[C@H](NC(=O)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 920926879 QUTGGOTXWNWDNG-SFHVURJKSA-N 466.538 1.812 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1nc[nH]n1)C2)C1=NN(c2ccccc2)C(=O)C1 1778127736 XGMITVJCSGUDCN-WZONZLPQSA-N 497.581 1.204 10 20 JDCD O=C1NCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)ccc21 1778726979 IFVQEPWMBJFBEI-JARBLVMWSA-N 479.489 1.204 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1[nH]cnc1-c1cccnc1 1780036479 NMMZYBKNNYXDJT-MZNJEOGPSA-N 478.509 1.719 10 20 JDCD COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)c1OC 1780448605 MIPQRKQLVPJXRS-VWLOTQADSA-N 493.520 1.335 10 20 JDCD COc1ccnc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1OC 1782007747 LMIGIZDDDUUIKC-JOCHJYFZSA-N 477.901 1.921 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1 1782383414 MCPVNFXILWKTAE-VWLOTQADSA-N 472.505 1.571 10 20 JDCD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)(C1)C2 1783436051 ABIPBRQPWVTQQA-KXTRFFEISA-N 488.541 1.384 10 20 JDCD Cc1cnn([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)c1 1784450183 YCWVEGONYJGVFG-HOYKHHGWSA-N 464.526 1.375 10 20 JDCD O=C1Nc2ccccc2/C1=C/C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785506616 AYKFFFXZOZLZAM-RDKLFWBGSA-N 491.500 1.682 10 20 JDCD CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787538810 NUALEKQAFPSDRG-XJABCFGWSA-N 491.548 1.867 10 20 JDCD Cn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)c2c1CCC2 1787539824 ZQZFKBKWAGHZFA-BPXKWBHBSA-N 490.564 1.295 10 20 JDCD CC(C)c1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)no1 1794003398 WFDJVUATPWRYPR-IVWMJMPLSA-N 464.906 1.704 10 20 JDCD COc1cscc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1796681784 WQXRHFDPVQSSQV-USGNIVHTSA-N 468.535 1.753 10 20 JDCD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)cc1OC 1798892242 XAXILTDXRJUULM-MRSFGVLCSA-N 492.532 1.700 10 20 JDCD Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)c12 1800109084 WCXSJALTLBVOSL-ZLSBKTEHSA-N 478.505 1.676 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2 1802079086 SKOAGQXBYIPCIS-HIBMCEFLSA-N 499.589 1.526 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3nccc13)C2 1802079662 PCOKCBCWKIIJTF-NZFRQOASSA-N 464.478 1.368 10 20 JDCD Cc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1803831927 WYGHNNFSRJPSDM-HNAYVOBHSA-N 472.596 1.303 10 20 JDCD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804286466 YMYIYUJEIDZYRX-INONVRRSSA-N 481.509 1.063 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(N2CCOCC2)cc1 1804333787 SNEGETPNGRNXAO-GGPHIMKMSA-N 488.635 1.635 10 20 JDCD COc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1805606570 KNNVLUPRZLFYNC-HNAYVOBHSA-N 485.591 1.665 10 20 JDCD O=C(/C=C\C(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)NC1CC1 1814163840 NMRTUJUGOLBCDK-JOGWJMNFSA-N 492.532 1.752 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C2(F)CCC2)[C@H]1c1cccnc1 1814191579 LFLWNJNDZXLVKG-YOEHRIQHSA-N 450.561 1.840 10 20 JDCD 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BKTOBWXWJCQADI-QHCPKHFHSA-N 486.912 1.783 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)CCO2 1839699860 WJUSHCPNSZVWBK-SFUJROHXSA-N 466.943 1.696 10 20 JDCD C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)CC1(F)F 1840829154 VBRRDFSIUNOUKT-OALUTQOASA-N 460.861 1.867 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1 1840880539 UMKAFLVKUWXCIT-ZGVNINRLSA-N 489.912 1.635 10 20 JDCD C[C@@H](NNc1ccccc1)C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1841064726 PZEDJHGZGLUIAP-GOSISDBHSA-N 460.538 1.988 10 20 JDCD CC[C@@H](NC)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1843004633 UXFNMFWWNLBKTF-MSOLQXFVSA-N 490.601 1.735 10 20 JDCD O=C1CCc2ccc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)nc2N1 1843233625 MKAPKXIIIAMIDM-WEVVVXLNSA-N 464.478 1.614 10 20 JDCD CS(=O)(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)C2)nc1 1847034062 YTDUENBGTOSMGN-XBXARRHUSA-N 473.507 1.132 10 20 JDCD 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Cc1cnoc1C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1838518651 UVOZZAMZXAFYJN-UHFFFAOYSA-N 466.585 1.456 10 20 JDCD Cc1ncoc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839431694 HRWWEFRZRGECKY-HXUWFJFHSA-N 451.863 1.431 10 20 JDCD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433268 CBHFRDMHAXESNI-RCDICMHDSA-N 491.932 1.112 10 20 JDCD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1843441694 MGGJGLLHIHTFPW-UHFFFAOYSA-N 476.537 1.283 10 20 JDCD O=C(c1cnn(-c2cccnc2)c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033873 MMWUYRBSXHOHKC-FNORWQNLSA-N 461.478 1.915 10 20 JDCD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NCc2ccc(N(C)C)cc2)c1OC 24378342 JFAPIUNIBRXFQP-UHFFFAOYSA-N 463.556 1.721 10 20 JDCD CCNc1nc(NCC)n2c(SCC(=O)Nc3ccccc3N3CCC(C(N)=O)CC3)nnc2n1 109791813 KQENROCBQVNGMC-UHFFFAOYSA-N 498.617 1.815 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)N3CCN(C(=O)c4cccc(O)c4)CC3)CC2)cc1 725866009 RGSKYWVMSFNHDO-UHFFFAOYSA-N 467.570 1.690 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(CS(C)(=O)=O)cc3)CC2)cc1 742940809 YMXDMVQNOZORBG-UHFFFAOYSA-N 460.600 1.861 10 20 JDCD CS(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3cccc(S(N)(=O)=O)c3)n2)cc1 818021239 VJPILNIAIKTHEW-UHFFFAOYSA-N 473.579 1.662 10 20 JDCD COC(=O)c1sc2[nH]c(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)nc(=O)c2c1C 824097283 NNMSZNPUZDVUBE-UHFFFAOYSA-N 456.524 1.980 10 20 JDCD COCCNC(=O)CN1CCN(c2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])CC1 836183355 VEPRSTSNPALNDS-UHFFFAOYSA-N 476.284 1.159 10 20 JDCD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NCc1ccc(N2CCOCC2)c(F)c1 917709564 QSEKQFKQNVXJHO-XMMPIXPASA-N 452.486 1.672 10 20 JDCD Cn1ccnc1[C@@](O)(CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)C(F)(F)F 918340196 MJNIHOWOWPLQLQ-SFHVURJKSA-N 460.478 1.111 10 20 JDCD CN(C)C(=O)c1ccccc1NC(=O)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 918465664 RGXGKRIFWYNPSE-QGZVFWFLSA-N 451.527 1.345 10 20 JDCD Cn1c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc2c(=O)n3ccccc3nc21 918994406 DCCWYPDASKMPDY-UHFFFAOYSA-N 493.495 1.635 10 20 JDCD CCN(Cc1ccc(OC)c(OC)c1)C(=O)COC(=O)c1cc(NS(C)(=O)=O)ccc1O 920636659 GTNHEXFMDMTWBF-UHFFFAOYSA-N 466.512 1.986 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1[nH]nc3ccncc13)CCO2 1782002745 VJPILOIVXFRWKD-OAQYLSRUSA-N 457.874 1.780 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2 1783222671 IWCSGEOPQYBJOL-OOSRFHLNSA-N 473.570 1.816 10 20 JDCD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)ccn1 1785505789 POZVLVNRTDWPFG-ISTCRNMPSA-N 482.493 1.314 10 20 JDCD O=C(Cc1cc(F)cc(F)c1)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538684 UPITZGYKVYPPNY-HXUWFJFHSA-N 469.535 1.198 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccc3o1)CCO2 1785540009 KFILGGDLFPYHRQ-OAQYLSRUSA-N 459.549 1.737 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(F)c1 1785545227 KRJKPGYIKRINAP-FQEVSTJZSA-N 451.545 1.438 10 20 JDCD Cc1cc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cc(O)nc(O)c5)[C@H]4C3)[nH]c2cc1C 1787293233 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1.978 10 20 JDCD CN1CC(C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)C1 1808470595 XHLXOGWHRPOCQP-FDDCHVKYSA-N 460.538 1.442 10 20 JDCD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)ccn1 1810794363 VRGXARYYMHGXMJ-PXNSSMCTSA-N 469.592 1.965 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1814163489 DVWQOWGXOAVRMS-RTPFVWDUSA-N 494.464 1.863 10 20 JDCD COc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n1 1816269907 IPIQEUMCTLFZEF-CQSZACIVSA-N 474.568 1.980 10 20 JDCD CCc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n[nH]1 1817706845 NDEXMOGKNVRUQQ-AWEZNQCLSA-N 461.573 1.861 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146276 YFNMRVFAHQZOMY-GOSISDBHSA-N 489.492 1.908 10 20 JDCD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1)N1CCN(C)CC1 1823475144 CKTMGWDFLPHUHB-NWLOJRJCSA-N 498.584 1.868 10 20 JDCD COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825773309 OQZJFPVKNKVKHG-AWEZNQCLSA-N 480.543 1.245 10 20 JDCD O=C(Cn1ccncc1=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827717517 LJILGXWTTFDNFK-QFIPXVFZSA-N 490.564 1.656 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2[C@H]3COC[C@H]32)CC1 1832488820 JOZBCYNQVMEJDS-CYJAXWMASA-N 451.614 1.359 10 20 JDCD C/C(=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1)C(=O)O 1832901575 WRUKMMZJKMHDNE-VSKPTYQZSA-N 453.586 1.497 10 20 JDCD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)co1 1834210916 KGVLBKPCNJRLGP-FQEVSTJZSA-N 451.863 1.431 10 20 JDCD CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)no1 1834500899 TYBJGQCDMOCLLP-WUQPGSQJSA-N 487.509 1.698 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccc(-n2cnnc2)cc1 1834651433 LMZOTPOQQQTGHE-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD O=C(Cc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1835003872 PIQSVLHHXAEEGD-SANMLTNESA-N 494.523 1.618 10 20 JDCD CO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835133944 OCZVMFUPAIBCKF-KRWDZBQOSA-N 455.559 1.386 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cc2cccn2cn1 1835424727 WUQPWPLOCYLPQO-UHFFFAOYSA-N 464.526 1.640 10 20 JDCD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)nc1 1838177726 XPZOWAVPABHFMI-UHFFFAOYSA-N 492.623 1.563 10 20 JDCD COC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)CC1 1838758660 UPWQHRVOTNYNRC-HWKANZROSA-N 488.537 1.768 10 20 JDCD Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)c1 1838806819 QUHVFPGIKYELEV-INIZCTEOSA-N 493.655 1.611 10 20 JDCD Cn1cccc1C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433408 UOEOWPDHMZOHJS-QFIPXVFZSA-N 477.901 1.043 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCCC12CN(C(=O)c1cccnn1)C2 1844251472 BFYXJTOBIXBFTH-SFHVURJKSA-N 497.552 1.841 10 20 JDCD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 10906296 BIWHZXSXXIGLEV-UHFFFAOYSA-N 460.556 1.419 10 20 JDCD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 727491053 XBHDOHMNDKTBEL-UHFFFAOYSA-N 496.630 1.771 10 20 JDCD CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 729060204 CELVSNIVUAUMRT-UHFFFAOYSA-N 472.567 1.561 10 20 JDCD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)c1 729062387 ACQIYFGVIZJLEA-CYBMUJFWSA-N 460.512 1.687 10 20 JDCD CN(CCN1CCOCC1)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 729600737 URCNCSFXLGJFPC-UHFFFAOYSA-N 457.554 1.416 10 20 JDCD COC(=O)[C@@H](F)/C(NCc1ccc(N(C)C)cc1)=C1\C(=O)NC(=S)N(CC(C)C)C1=O 814334994 DJZGEONIMIFGRN-SCDSTIRESA-N 450.536 1.507 10 20 JDCD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NCc2ccc(N3CCSCC3)cc2)c1 917384096 SFRYGHMKVGOMGB-UHFFFAOYSA-N 476.624 1.536 10 20 JDCD CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1 918312037 ZIJPHZGXHKBUNI-UHFFFAOYSA-N 476.555 1.302 10 20 JDCD COC(=O)CNC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 918437637 LDHVIZGXGMYAIW-UHFFFAOYSA-N 484.578 1.326 10 20 JDCD O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1ccc(N2CCOCC2)c(F)c1 918808309 MOYUWYUNPCFHLZ-HDICACEKSA-N 475.517 1.387 10 20 JDCD COc1ccc(N2CCN(C(=O)CS(=O)(=O)Cc3nc(CCC(C)C)no3)CC2)cc1 920486245 VBHSFDDRWDMFBL-UHFFFAOYSA-N 450.561 1.930 10 20 JDCD CC(C)CN1C(=O)/C(=C/Nc2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)C(=O)NC1=S 920974352 INBRYKDRTDZBLU-GXDHUFHOSA-N 487.003 1.556 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2)c1cc(O)nc(O)c1 1777848292 ODHFUOLPVGUKBO-OPAMFIHVSA-N 452.471 1.205 10 20 JDCD CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)nc(O)c3)C2)nn1 1777850673 DANRUMGRVICHRF-OPAMFIHVSA-N 457.487 1.123 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1785540502 KIPYNZQYJIKKIL-FQEVSTJZSA-N 476.605 1.600 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1785540710 NJPQHXBXOZPGGU-ZWKOTPCHSA-N 479.546 1.594 10 20 JDCD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1785552329 YPOFVNQMNYOBLF-IOUFHMPJSA-N 454.439 1.558 10 20 JDCD O=C(Cc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1786540061 VRTIZRPMCGKUJP-XIRDDKMYSA-N 465.572 1.208 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@@H]3O)C[C@@H]21)c1cc(O)nc(O)c1 1787292646 ZUYQUVHODFHVTL-AKOMIPFMSA-N 467.522 1.382 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787541242 BFHORHOJYTZEDH-JEEBJRHZSA-N 491.548 1.622 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cc2ccoc2s1 1796118631 ZOEDZMBSRKJBAS-DRXBFXEBSA-N 465.578 1.558 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2)c1cc(O)nc(O)c1 1796138492 AJJYJQKIVMBBHR-XQLXGXOBSA-N 453.520 1.584 10 20 JDCD O=C(CCN1CCOC1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934741 WDURDHFPKKVMQH-VBUUOAMHSA-N 453.499 1.260 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc2c(c1)CCCC2=O 1797021866 NDLDBBGQPWLQHO-FAQVEIGNSA-N 451.479 1.529 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1cnn(Cc2ccccc2)c1 1798151125 PPXYWTHCGNSION-HATOLVCRSA-N 463.494 1.255 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cc(F)cc([N+](=O)[O-])c1 1799629043 QBJLYQHWDHWGGI-HSPBFZJBSA-N 487.440 1.767 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2)c1cc(O)c(O)c(Cl)c1 1799770776 FXMHYAMVQLXNMV-CWPLJXCYSA-N 483.912 1.849 10 20 JDCD N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O)c1cccc(Cl)c1 1802080071 HQVVAGSJWSVHLG-ROCPZPCRSA-N 487.940 1.760 10 20 JDCD CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cc(C)n1 1802080272 QKZFGFKPUFDHJI-GMNSRVPRSA-N 467.522 1.986 10 20 JDCD COC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1802601132 IXGNSMYFDYGYJM-PBHICJAKSA-N 450.586 1.373 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@@H](CNC(=O)C23CC(F)(C2)C3)[C@H]1c1cccnc1 1803663898 KTOMAQWEPHCXHX-MMZRUNHDSA-N 462.572 1.840 10 20 JDCD Cc1noc(C)c1CC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1804256067 ZARBHEKFOODAPC-HRAATJIYSA-N 487.607 1.795 10 20 JDCD O=C(CCNC(=O)c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804340499 RYNLIBFJLNCAIG-BJWYYQGGSA-N 474.608 1.305 10 20 JDCD Cn1cccc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1805362287 YQXCMFAURQLATG-DNVCBOLYSA-N 457.581 1.600 10 20 JDCD CCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806033316 RFSYURONVBKISH-LIRRHRJNSA-N 473.580 1.812 10 20 JDCD O=C(Cc1cnc[nH]1)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808248141 WGKCVWPFFXBWMS-HOYKHHGWSA-N 471.521 1.846 10 20 JDCD O=C(Cc1cnc[nH]1)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808248144 WGKCVWPFFXBWMS-KOSHJBKYSA-N 471.521 1.846 10 20 JDCD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)n1ccnn1 1812400737 PDAYHZHCCIJUDI-XPHOKUMQSA-N 478.509 1.770 10 20 JDCD Cn1ccnc1C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1814161513 ACAVYLQHXVQXLJ-DNSQJKMNSA-N 463.494 1.965 10 20 JDCD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)no1 1814191078 GSQNAUMHNUEGOM-QRWLVFNGSA-N 473.580 1.487 10 20 JDCD C[C@@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1815294133 IMWLCUCEDLBWEN-KSSFIOAISA-N 465.514 1.706 10 20 JDCD CNC(=S)NCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146844 IUVSIBJIVJUYNZ-SFHVURJKSA-N 496.597 1.679 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)Cc2cnccn2)CC1 1824307831 OZPQBXABVREWOZ-QGZVFWFLSA-N 461.613 1.499 10 20 JDCD CCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1824402643 PKMOUXSTPYSOLA-HOCLYGCPSA-N 468.645 1.381 10 20 JDCD O=C(CCN1CCOC1=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1835455219 VBMKIKFJEFPTSO-UHFFFAOYSA-N 494.976 1.779 10 20 JDCD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)CC2)nn1C 1836203828 RYOKMDKANZRPRP-UHFFFAOYSA-N 491.976 1.992 10 20 JDCD CCc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n(C)n1 1839433748 SAWLKMWZFVOMBS-QFIPXVFZSA-N 478.933 1.431 10 20 JDCD CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)o1 1839433923 XVWJATVSCKGOOZ-QFIPXVFZSA-N 493.900 1.686 10 20 JDCD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1)c1ccccn1 1840502117 SQWHOTSSUDRQCR-NIYFSFCBSA-N 491.548 1.434 10 20 JDCD Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840879747 CKSXHDVVNHVALG-QBHGEWLWSA-N 499.564 1.851 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1 1840880807 MOZGXAIUHQNXJX-TTZARTBGSA-N 499.564 1.945 10 20 JDCD O=C1NCCCn2nc(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)cc21 1843999496 RQQVQTKDSUPGCG-UHFFFAOYSA-N 459.890 1.212 10 20 JDCD CC(=O)N/C(=C\c1ccco1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038262 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490.564 1.846 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3S)C[C@@H]21 1792218795 DTNIMOQYJYSHBC-DEMFTJLTSA-N 471.535 1.794 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cccn2cncc12 1797523886 UKFDBKRXLNXUHQ-HBCWATKFSA-N 456.886 1.916 10 20 JDCD O=C(Cc1cc2cccnc2cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1799240373 BIUATEOYXNZWMC-GPVSGQMNSA-N 466.469 1.626 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccccc1)C2 1802106601 DUFXAFJKPJGYEV-QOSLBHJFSA-N 459.593 1.240 10 20 JDCD Cc1nn2cc(CC(=O)NC[C@H]3CCN(C(=O)c4cc(O)nc(O)c4)[C@@H]3c3cccnc3)nc2s1 1803964193 KXWQMZPXBKKXGL-QVKFZJNVSA-N 493.549 1.863 10 20 JDCD CC[C@@H](NC(C)=O)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)C1 1804914716 MSJJWJUELXGAFB-JHTBKMLMSA-N 459.543 1.963 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807991278 OTAPZWOAIIGUEJ-FZKQIMNGSA-N 454.874 1.965 10 20 JDCD CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808434459 PRNXKMSJPQQSBO-PWAGRJGVSA-N 490.564 1.747 10 20 JDCD O=C(CCN1CCOC1=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1809533333 UPQGVBVUWGFWMX-MEXJDSSQSA-N 496.520 1.760 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810085291 BMTZTTSSHDTNOI-VLIAUNLRSA-N 495.590 1.533 10 20 JDCD O=C(CC1(O)CCC1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813640540 SJRHXGIBNVHQAE-KXBFYZLASA-N 462.597 1.253 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1814189789 YZTWJXUROJTXIO-DYESRHJHSA-N 484.607 1.371 10 20 JDCD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191223 IXDFQUFRBQUNIM-CRAIPNDOSA-N 492.623 1.537 10 20 JDCD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362199 QRKVVBFEYJVJSZ-UONOGXRCSA-N 480.550 1.539 10 20 JDCD CN1CCN(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc(O)c(O)c3O)n[nH]2)CC1 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CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)n[nH]1 1805265060 ULBPSSIYTFTKKE-IFXJQAMLSA-N 486.579 1.187 10 20 JDCD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)C1 1805961989 AQDRYYOKTZIUMI-CQSZACIVSA-N 488.006 1.924 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnn2ccncc12 1809391540 KWMAEANOOKXMBQ-YCRPNKLZSA-N 459.466 1.564 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1ccc(O)cc1 1811938773 DJEOZAQNEVZIOX-JXFKEZNVSA-N 470.576 1.967 10 20 JDCD O=C(Cn1nnc2ccccc21)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1815550468 QPNAATWPINARTH-HNNXBMFYSA-N 498.594 1.707 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1nccc2nc[nH]c12 1817932813 AZGKPMKSGGQALC-ZDUSSCGKSA-N 484.567 1.847 10 20 JDCD C[C@H](CC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146151 UQTZGHQIAYGYDM-KDOFPFPSSA-N 465.514 1.706 10 20 JDCD CN1CCN(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)CC1 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O=C(NC1CCN(C2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)CC2)CC1)c1cc(O)nc(O)c1 1834988674 BZUUJBHYDXNCEP-UHFFFAOYSA-N 491.552 1.777 10 20 JDCD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)ncc1[N+](=O)[O-] 1835188993 UJWPBVZGGSFWHT-UHFFFAOYSA-N 484.513 1.603 10 20 JDCD Cc1cccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)[nH]c12 1836418126 BFHCBVCZEVUOCT-XMMPIXPASA-N 466.494 1.666 10 20 JDCD O=C(/C=C/C1CC1)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1836733294 YGIHISPYRRSTFB-ONEGZZNKSA-N 451.614 1.812 10 20 JDCD CC(C)NCCC(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1837910792 CUPXQKLZSMYJRV-UHFFFAOYSA-N 470.661 1.233 10 20 JDCD Cc1cnoc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433272 CGOHRSYWYXWQQU-HXUWFJFHSA-N 451.863 1.431 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840121944 JAHWLGIOQJKJGN-IXFSTUDKSA-N 489.619 1.107 10 20 JDCD Cc1cc(CCC(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)ccn1 1840879974 QUCPHVSXVKUXNB-KCROQMHPSA-N 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CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)n[nH]1 1838700054 OFOPEQOQDYIJDG-QFIPXVFZSA-N 478.933 1.982 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3)C2)C1 1839435343 HYEXWSQGZWZGGC-UZLBHIALSA-N 456.948 1.717 10 20 JDCD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839435540 NJDZRMVLQCVXPZ-HTAPYJJXSA-N 483.949 1.126 10 20 JDCD O=C(CCCn1ccnc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840385685 UJQYMWGZZASDGL-QFIPXVFZSA-N 478.933 1.498 10 20 JDCD COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c1 1840653635 JECMDUKPQFLJOO-JOCHJYFZSA-N 477.901 1.539 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749356 UJDFFGQWNIAKFE-RUZDIDTESA-N 483.521 1.665 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)nc3F)C2)C1 1840880022 SRWKXAVBBVLHOI-GTYDBAGRSA-N 491.447 1.260 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1 1840881764 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O=C1CN(c2cccc(C(=O)N3CCCC34CN(C(=O)c3cc(O)c(O)c(Cl)c3)C4)n2)CCCN1 1842305516 RTOGEUHYSRJYOH-UHFFFAOYSA-N 499.955 1.603 10 20 JDCD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249465 NGGQCFWVDZDEEL-AWEZNQCLSA-N 482.484 1.955 10 20 JDCD CC[C@@H](NC)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251492 CLYHLWHONVBEJR-MSOLQXFVSA-N 490.601 1.735 10 20 JDCD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037847 WHEWHOCVMIZYKS-LHWQUMODSA-N 456.495 1.775 10 20 JDCD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)C1 728714911 USMPXKXPHFFRFS-QFIPXVFZSA-N 484.578 1.736 10 20 JDCD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 728949681 UXFFOBXCOYZNCB-GOSISDBHSA-N 465.570 1.031 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CCNS(=O)(=O)c3ccc(F)c(F)c3)CC2)cc1 825441402 MUOAQRVPIZWRCT-UHFFFAOYSA-N 497.520 1.534 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)c3cc(C4CC4)nc4c3c(O)nc(=O)n4C)CC2)cc1 915190135 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COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)c2n1 1780046052 VZLGDNKCOMONEG-UWCCTICSSA-N 494.504 1.845 10 20 JDCD CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)C(C)(C)C 1784316088 VAOWAYLBKNLMIR-MYQWSPHJSA-N 489.569 1.347 10 20 JDCD CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1785508739 KHMJBYWSUZDXKO-SXBBHYFQSA-N 470.526 1.912 10 20 JDCD Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1N 1785509190 OXUQHFDORQJAPJ-CMEAPCDJSA-N 471.485 1.990 10 20 JDCD Cc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792242336 ZCKMHJXSWOVEKB-FHWLQOOXSA-N 475.636 1.768 10 20 JDCD Cc1nc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cc(O)nc(O)c3)c2s1 1796137585 LEXZBACILYQSOH-HBCWATKFSA-N 454.508 1.928 10 20 JDCD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(O)nc(O)c3)C[C@H]1CO2 1796604963 ZHYMITYOQRGMEC-DINDUCCOSA-N 488.541 1.523 10 20 JDCD CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccccc1 1800302399 ZQJCTOGIBHYZSO-IYRWYFENSA-N 468.554 1.779 10 20 JDCD CS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nc1 1807991643 QRBASJRCBFBCRD-YCRPNKLZSA-N 497.533 1.320 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)Cc2cnc[nH]2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468013 MRAJQFQDTSTXPI-UUOWRZLLSA-N 471.521 1.846 10 20 JDCD COc1ccc(C(=O)N2CC[C@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)nn1 1808469921 RGUVMAOBMIZAFP-HOYKHHGWSA-N 499.531 1.993 10 20 JDCD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)nn1C 1811139823 CPGPOVOXKNKMPY-VFNWGFHPSA-N 450.499 1.817 10 20 JDCD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)n1cncn1 1813399309 JSUSCMCXKMIRQP-FHJLPGHOSA-N 486.536 1.733 10 20 JDCD O=C(CCc1cnccn1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813448892 WPSJPFAGXCFDQO-KKSFZXQISA-N 484.607 1.371 10 20 JDCD 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Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1808000148 XDIHCPGQEMBOCF-UZUQRXQVSA-N 464.526 1.800 10 20 JDCD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)cn1 1811069045 GBAIHFOOTWCYMH-IIBYNOLFSA-N 498.634 1.723 10 20 JDCD NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1812637455 WZVRNCAFXFLAMF-SXXNRXISSA-N 454.483 1.183 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1 1814162246 HRUUKWWQEIULCR-SBWLRAJMSA-N 482.537 1.250 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1 1814163146 ZYHPRSSUBLVKSD-BVESAFSSSA-N 475.505 1.950 10 20 JDCD Nc1ncc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)s1 1814186024 KFIZIJRXWXMOJO-WBMJQRKESA-N 476.609 1.300 10 20 JDCD COCc1oncc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189467 PYRCHQBZZSDGSK-LIRRHRJNSA-N 489.579 1.396 10 20 JDCD CN1CCCC[C@@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1814890702 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O=C([C@H]1CCc2nc[nH]c2C1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899579 JUXOMIIGACUFKO-LPHOPBHVSA-N 489.667 1.995 10 20 JDCD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1)n1ccccc1=O 1832901152 OYHUJKONSSUICS-WMZOPIPTSA-N 490.651 1.889 10 20 JDCD CC(C)c1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)n1 1833282091 VITXFTIZIBMTFN-NRFANRHFSA-N 462.528 1.457 10 20 JDCD O=C(Cc1ccc(F)c(F)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1835138266 JYCPWSYNTNRBRI-JOCHJYFZSA-N 463.437 1.084 10 20 JDCD Cc1nc2ccccn2c1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835306319 HONMWZZDEPCIRH-UHFFFAOYSA-N 478.553 1.948 10 20 JDCD O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417331 MSIBLSNJALELLJ-RUZDIDTESA-N 480.521 1.677 10 20 JDCD Cc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cc(O)nc(O)c5)CCO4)C3)sc2c1 1836417814 NUPNDVQMTWFGRR-HSZRJFAPSA-N 484.534 1.795 10 20 JDCD Cc1occ(C(F)(F)F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836418116 APEIMAUTAWHVFH-HXUWFJFHSA-N 485.415 1.797 10 20 JDCD CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837039897 PMUOZGLSRUXEIL-UHFFFAOYSA-N 497.596 1.646 10 20 JDCD CC(C)c1nc(CC(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)no1 1837133782 YAZJDUODPQSDHR-UHFFFAOYSA-N 473.530 1.854 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1 1838031699 DYTZPICFBXCDIE-UHFFFAOYSA-N 466.498 1.690 10 20 JDCD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838032423 WKYVEPYXNNFHKN-KRWDZBQOSA-N 496.564 1.924 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1 1838508842 NYPNLAFWGFKSQS-DUXPYHPUSA-N 458.471 1.512 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nccn34)C2)C1 1840881558 WAXCBVOIUOOQNM-PIITYICYSA-N 494.504 1.235 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC2(CCCN2C(=O)C2(C)COC2)C1 1841131051 YUMZPMNOFGIXFC-LJQANCHMSA-N 472.586 1.945 10 20 JDCD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843251242 LWAIZKBLWLDKET-GOSISDBHSA-N 456.474 1.196 10 20 JDCD COc1ccc(CN2C[C@H](C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 726679157 HFUKUTLODJKLFB-HXUWFJFHSA-N 481.549 1.944 10 20 JDCD CN(C)S(=O)(=O)c1ccc(OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 727977506 LGDDOFDPDLUCCR-UHFFFAOYSA-N 451.520 1.608 10 20 JDCD COC(=O)COc1ccc(S(=O)(=O)Nc2ccc(NS(C)(=O)=O)c(C(=O)O)c2)cc1 728015816 WLIJWFCIMUALKJ-UHFFFAOYSA-N 458.470 1.109 10 20 JDCD COc1cc(CC(=O)O)cc(S(=O)(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1OC 906822489 FSJYHADAJBPSLL-UHFFFAOYSA-N 468.503 1.785 10 20 JDCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1OC 917757967 DNDFGIKBRWNWPC-UHFFFAOYSA-N 462.571 1.970 10 20 JDCD CS(=O)(=O)c1ccc(NCCNC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c([N+](=O)[O-])c1 918199323 ULFREKYEUSYDLF-UHFFFAOYSA-N 495.533 1.885 10 20 JDCD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C(=O)Nc1cccc(C(=O)N2CCOCC2)c1 918438331 MTKWQZPBHKUIDX-UHFFFAOYSA-N 484.528 1.514 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)/C(=C\c3cccc(OC)c3)n3nnnc3C)nc12 918937694 LXYAFVBEGPHPMA-GIJQJNRQSA-N 479.453 1.657 10 20 JDCD COc1ccc(S(=O)(=O)N2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1 919790685 XPJVNYXZKJZFGH-UHFFFAOYSA-N 474.583 1.748 10 20 JDCD CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 920864187 NKFLUTPTESLUFJ-UHFFFAOYSA-N 456.542 1.708 10 20 JDCD O=C(Cn1c(=CC(=O)C2CC2)sc(=Cc2ccc(N3CCCC3)cc2)c1=O)NC[C@@H]1CCCO1 1317946799 UKYXCTPLWAHXMO-NRFANRHFSA-N 481.618 1.394 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC[C@@]2(CN(C(=O)C3CC3)CCO2)C1 1779003186 YLHPVFKWWOKRDA-BVZFJXPGSA-N 489.569 1.774 10 20 JDCD COC(=O)c1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1782338253 WSDPKDCLDZLZOD-KBMIEXCESA-N 483.521 1.650 10 20 JDCD CN(C)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)nc1 1783245133 BSULVTIUSYTTEV-VGOFRKELSA-N 491.639 1.135 10 20 JDCD Cn1cc(F)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783247939 JMWIGAOWYSVCOS-FOIQADDNSA-N 468.576 1.152 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784251973 WHOJTBACLZTRLS-RCZVLFRGSA-N 496.951 1.996 10 20 JDCD CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C(C)(C)C 1784307211 DRKOEBYZRQAXQK-MLZJRGSSSA-N 481.977 1.895 10 20 JDCD C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785504877 BBMHUMCLSUJDEK-DVMGJAEMSA-N 482.537 1.652 10 20 JDCD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1785528818 GTIPXOQWFSRZRC-NRFANRHFSA-N 460.418 1.226 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)c3ccccc3)C[C@@H]21 1792237285 FHRKFHFJIDWHSM-FPXQBCRKSA-N 465.572 1.537 10 20 JDCD CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796482696 PLGYTTYNTKBIBL-MRSFGVLCSA-N 489.532 1.641 10 20 JDCD Cc1nc2ncccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797006292 PDBXJRZDAHGYSK-XOIINTDNSA-N 471.901 1.619 10 20 JDCD CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798176053 VSTCQITXJWKUGY-MFKICJERSA-N 465.510 1.542 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H]2CCC(=O)N2)C3)cc1 1799620071 LVPSVCRWUGLOMH-QRICJDHISA-N 450.539 1.576 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ncccc13)C2)c1cc(O)c(O)c(Cl)c1 1799768212 NCFFWZXXTVOLTA-DRXBFXEBSA-N 457.874 1.540 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c[nH]nc13)C2 1802080337 VATFJGVHSPRRRT-DOZWIBKZSA-N 464.478 1.596 10 20 JDCD Cc1cccc(C)c1SCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802105219 CVFYLJVYOOHEEQ-CWPLJXCYSA-N 493.676 1.845 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2 1802107020 HQFMIUJMDWUKBC-CULMDFNYSA-N 493.998 1.280 10 20 JDCD CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1802545392 GGYNAFBFKUHJNR-LQFPLNRMSA-N 482.537 1.832 10 20 JDCD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(C)c1 1803973732 ZLTCZBIWGVOXHH-MUJYYYPQSA-N 475.592 1.894 10 20 JDCD O=C(Cc1ccc(F)cn1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1807485524 WIIDPZGPKKCBDO-QVKFZJNVSA-N 487.582 1.725 10 20 JDCD CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1812663235 OZCJJFRSOPKBOR-IAADTXTGSA-N 468.510 1.444 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@H]1c1cccnc1 1814186529 RLNGVZMLBLUWMW-BTYIYWSLSA-N 487.582 1.725 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc3nccn3c2)[C@@H]1c1cccnc1 1814188792 ABXYNVWCJJEMBD-HRAATJIYSA-N 494.602 1.909 10 20 JDCD Cc1nc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)no1 1815873697 FKOKXJLSROTRNC-LBPRGKRZSA-N 463.545 1.196 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@@H](O)c1ccccc1 1817079145 VLKMVHVPGNUNII-KXBFYZLASA-N 473.580 1.996 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)Cc2ccccc2)[nH]n1 1823499759 WXWANJGQEHVTNC-IAGOWNOFSA-N 487.607 1.866 10 20 JDCD C[C@@](O)(C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1)C(F)(F)F 1828240366 SSQRIVULPPEOTR-KWKYVRJSSA-N 482.531 1.229 10 20 JDCD Cc1nnc(CCC(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)s1 1828240486 VVGIRVSTMFRZBS-JTQLQIEISA-N 496.665 1.708 10 20 JDCD CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1828762558 UGSNKYOTNNHSOR-IFMALSPDSA-N 499.568 1.464 10 20 JDCD O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833294999 KJHXWPIBQQDUQB-UHFFFAOYSA-N 478.553 1.568 10 20 JDCD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)ccc1F 1833468153 OQSHVTKFRASUGM-MLENBVEFSA-N 487.484 1.429 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)CC1)c1cc(O)nc(O)c1 1834985553 JVJMGYPWUDPKOK-SFHVURJKSA-N 499.612 1.469 10 20 JDCD Cc1nocc1C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1837517881 VCGKGVBUWKSOKQ-UHFFFAOYSA-N 466.585 1.456 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1 1838110519 TXFOMAPNBMGVMS-UHFFFAOYSA-N 495.536 1.572 10 20 JDCD O=C(CC[C@@H]1CCOC1)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1838817576 PNFOEHXFPTZZSI-MRXNPFEDSA-N 483.656 1.662 10 20 JDCD CC(C)N1CCC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839435357 IMXYGIGCZSLSBN-MBSDFSHPSA-N 481.977 1.694 10 20 JDCD O=C(CCc1cnccn1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840457962 CCLXYTKSCITDDI-JOCHJYFZSA-N 476.917 1.244 10 20 JDCD Cc1occc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880187 AXZRTTDFOHEOEX-UUCGHWEQSA-N 458.467 1.488 10 20 JDCD CCc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc1 1840896496 CEOVJATYMDNYHH-QFIPXVFZSA-N 477.608 1.179 10 20 JDCD Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nc2ccccc21 1843743976 LRQSYZXLPOGDRJ-UHFFFAOYSA-N 484.516 1.543 10 20 JDCD O=C(c1cncn1-c1ccncc1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033874 MNVKHJMKKOROCN-HWKANZROSA-N 461.478 1.915 10 20 JDCD COc1cccc2[nH]cc(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)c12 1847055090 BJORNGHLHNTSDT-UHFFFAOYSA-N 458.565 1.854 10 20 JDCD O=C(c1cccnc1OCC1CC1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055981 SBGPMRKBDHYQMJ-UHFFFAOYSA-N 460.581 1.548 10 20 JDCD O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(O)nc(O)c2)CN1Cc1cccs1 1848146461 ULICJBPKEHQSRM-PVAVHDDUSA-N 456.524 1.418 10 20 JDCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 10907962 ZTCJDVLATHGWQO-UHFFFAOYSA-N 474.583 1.279 10 20 JDCD CN(C)c1ccc(CNC(=O)CN2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 23291072 IVIMWKGTYWSQJJ-UHFFFAOYSA-N 466.630 1.369 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CNC(=O)Cc3ccc(O)cc3)cc2F)C[C@@H](C)O1 726823678 FKNNCCOWCVEXDK-CALCHBBNSA-N 487.528 1.663 10 20 JDCD CCN(Cc1ccccc1NC(=O)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)C(C)=O 743432419 LXCCXEVIWSWCSE-UHFFFAOYSA-N 481.597 1.941 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCCNC(=O)Cc3cccc(F)c3)CC2)cc1 748827647 ZGQJRXCMWFHQPJ-UHFFFAOYSA-N 457.550 1.614 10 20 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490.520 1.333 10 20 JDCD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)c4cc(O)nc(O)c4)[C@@H]3c3cccnc3)c(C)n2n1 1809185371 FBCURURQZXKDQR-OPAMFIHVSA-N 488.508 1.576 10 20 JDCD O=C1C[C@H](C(=O)N2CC[C@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)CCN1 1811809124 GSSRCAKYJWXDRQ-RCDCFZSISA-N 472.929 1.992 10 20 JDCD CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814165078 BSTPKKGKOCLXTM-RHOIPIOKSA-N 480.521 1.958 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)CCc2ccccn2)[C@H]1c1cccnc1 1814185198 NEXXGWWJPJRZPF-JTSKRJEESA-N 483.619 1.976 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1 1814189990 NKOAENAVFPXGSD-UGSOOPFHSA-N 488.551 1.498 10 20 JDCD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2O)n[nH]1 1823476610 JPMATRXEWVZYKZ-LOWQCSRCSA-N 478.527 1.667 10 20 JDCD CCN1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)CC1 1823500565 FUWOJBDJUYRNPK-MRXNPFEDSA-N 478.644 1.994 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2)c1cnc2c(c1)CCNCC2 1824640435 XOZIMAUBOBSILF-HNNXBMFYSA-N 480.550 1.572 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccn1)CC2 1828194964 FKTGJSHGOIKADI-QSLRECBCSA-N 453.480 1.989 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1F)CC2 1828242896 VCDCFICPWKTMGC-SECBINFHSA-N 465.557 1.763 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccncc2O)CC1 1829181286 VLWZGOCCURBXHK-INIZCTEOSA-N 462.597 1.881 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@H]1CNc2ccccc21 1834727930 BHKJXTGWSDXDGR-FQEVSTJZSA-N 465.554 1.887 10 20 JDCD Cn1ccc(CC(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)n1 1834846941 OIHIBEDHMWKFRE-UHFFFAOYSA-N 491.596 1.327 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2 1837846713 PFULXPRKKHRHRE-OAQYLSRUSA-N 465.865 1.669 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)[C@@H]3CCOC3)CC2)CC1 1838814802 DIQRQNRXQVDMPA-NKEDHYFDSA-N 460.527 1.852 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2 1839494408 XJLHREINEAITJR-BFHGXFJZSA-N 494.504 1.463 10 20 JDCD COC(=O)CCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840236561 QQPBTERWWKALFG-QHCPKHFHSA-N 498.960 1.945 10 20 JDCD Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840652043 AEIPYEMXWUBJPN-NRFANRHFSA-N 481.571 1.064 10 20 JDCD CNc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1 1840880584 YQERBTDSMFMARH-DSCGJTOLSA-N 483.521 1.629 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)Cc2c(F)ccc(F)c2F)C1 1841774503 PMCPXGSCUKIFSG-UHFFFAOYSA-N 457.499 1.710 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@](C)(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)C1 1843248770 LYINXZYFFREYPH-MWTRTKDXSA-N 490.557 1.318 10 20 JDCD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1843971845 WIOOPQWXHNLCHL-HOCLYGCPSA-N 460.531 1.813 10 20 JDCD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 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JDCD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808381088 QSBPAEKATXVVOE-CVCWVKEYSA-N 494.464 1.863 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1ccc(CO)o1 1810834996 WRRYJJDRGOWLED-KUHUBIRLSA-N 474.564 1.347 10 20 JDCD NC(=O)c1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1811189314 USMRBIXFKUOIGG-YJYMSZOUSA-N 496.911 1.669 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@@H]1[C@H]2C=CS[C@@H]21 1812387225 KETJFTIYHJLVEH-MFVLPEOLSA-N 474.633 1.823 10 20 JDCD O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1819274491 PLIWDXHIIYFUPS-LMVHVUTASA-N 476.584 1.097 10 20 JDCD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821689330 IPOYIVFBCMTBKQ-AAEUAGOBSA-N 483.572 1.824 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cnccn2)[nH]n1 1823501205 PUFVBPVJXHYYQE-MBVDDHJVSA-N 471.568 1.766 10 20 JDCD Cc1noc(N)c1C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 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COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(O)c1 1798834274 VTSDCUDNBIHDFM-RSQQPWMTSA-N 478.505 1.397 10 20 JDCD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)cn1 1799767296 LSAQGKYPJQLEFF-VPTLXERWSA-N 475.929 1.991 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC(=O)C(F)(F)F)C2)c1cc(O)c(O)c(Cl)c1 1799769558 YBARLHZSKMSGJI-WDAIWFPHSA-N 466.796 1.060 10 20 JDCD Cc1ncc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)s1 1801491679 CCTOWDYFEPNNQT-ZWOJXEGBSA-N 471.535 1.885 10 20 JDCD O=C1NC[C@@H](C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)O1 1803653933 UBPLVYBTJKLZQR-VTEBNCATSA-N 468.466 1.026 10 20 JDCD O=C(CN1CCCCC1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806886631 KILVVJSHHAVXKW-UTKZUKDTSA-N 475.640 1.434 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996680 ZKFCKOOAPCOOSR-LHSJRXKWSA-N 459.466 1.793 10 20 JDCD 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1.309 10 20 JDCD CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCN2C(=O)OCc1ccccc1 1829037491 NCSJXPIJACOUBN-HSZRJFAPSA-N 454.483 1.578 10 20 JDCD Cn1cccc(C(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)c1=O 1833586499 AKKGFJTZECCAAE-FNORWQNLSA-N 496.564 1.401 10 20 JDCD O=C(CS[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835757781 WFXZJENWWYOTBL-QFIPXVFZSA-N 478.615 1.938 10 20 JDCD CC(C)(C)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836417347 NKSWSGULLWIDEG-DEOSSOPVSA-N 470.526 1.569 10 20 JDCD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)C1(O)CCC1 1839432434 OLWUYCYOISKEFJ-QKKBWIMNSA-N 468.934 1.372 10 20 JDCD COCC1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1 1839432630 SURVAWYLMOXBSH-OAQYLSRUSA-N 454.907 1.248 10 20 JDCD O=C(C[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839432652 VEASRIHUWQAGNP-KSFYIVLOSA-N 468.934 1.780 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433266 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Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)n4cnnn4)C[C@@H]32)cc1 1790125904 XSXZSOYNIOERAT-VLSUOOLDSA-N 477.569 1.935 10 20 JDCD O=C(CSc1nc[nH]n1)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1791822878 UPFOTLGHOYHHJY-UHFFFAOYSA-N 476.609 1.891 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21 1792217407 BFLAVTCXGZKXTH-WCQKHNBBSA-N 489.912 1.864 10 20 JDCD CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)nn1 1792218388 ZHANUZZTTSJUJG-TVGHNQMJSA-N 485.541 1.457 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21 1792219442 VXFIWVJMJQPVLP-HAMHFSBISA-N 457.458 1.644 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccc2sccc2c1O 1800022943 KHNRXUAPWHQZDI-KSPBDQMDSA-N 491.616 1.670 10 20 JDCD O=C(CN1CCCC1)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1802554592 CZLBCHHQRQWKOF-CPJSRVTESA-N 474.565 1.976 10 20 JDCD CCc1oncc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1806033315 RFSYURONVBKISH-KUHUBIRLSA-N 473.580 1.812 10 20 JDCD Cn1cc(C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)cn1 1808467662 JGYZCJLTFWQUEB-FDDCHVKYSA-N 471.521 1.928 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cncs2)[C@H]1c1cccnc1 1814185722 FEZOKBPUJQEJIC-GUYCJALGSA-N 461.594 1.718 10 20 JDCD Cc1ncc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)cn1 1814186538 RUFAOWCASJTLRW-DNVCBOLYSA-N 470.580 1.360 10 20 JDCD O=C1Cc2cc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cc(O)nc(O)c5)sc4C3)ccc2N1 1816725183 GBKPGNANPGAZGM-ZDUSSCGKSA-N 465.491 1.984 10 20 JDCD O=C(COC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819313237 ASNUJNIRNNVCHF-NSHDSACASA-N 457.365 1.627 10 20 JDCD Cc1nc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)no1 1823496483 HVUKOAOROFDCMH-LBPRGKRZSA-N 463.545 1.196 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2 1828244456 HBSDXYFYCIFTNE-NSHDSACASA-N 487.592 1.272 10 20 JDCD CCN(C)[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831077403 HAUGDEKZQTXWPJ-DOTOQJQBSA-N 454.662 1.807 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@@H](O)c1ccccc1 1834581253 FJQCUBSFCULXMU-NRFANRHFSA-N 490.651 1.152 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3csc4c3CCCC4)C2)C1 1836418321 NMTSRZSGDSUMIC-HSZRJFAPSA-N 473.551 1.817 10 20 JDCD Cc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1836968817 FOKFLDVYDKNDME-UHFFFAOYSA-N 479.628 1.201 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2 1838572783 WPTSOXRKEMGUFN-QHCPKHFHSA-N 470.457 1.497 10 20 JDCD O=C(c1cnc2c(c1)CCNCC2)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442435 LBRKVBBQAHHJTQ-UHFFFAOYSA-N 472.549 1.380 10 20 JDCD Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)cnc2c1 1843788152 ADBXJCGEJBUHEO-GQCTYLIASA-N 476.489 1.650 10 20 JDCD O=C(c1cnc2snnc2c1)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847039012 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CC[S@@](=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902053 ILCHMOKUOKNAGZ-XHDOVSQSSA-N 473.686 1.625 10 20 JDCD CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1833421514 FSFDQWZWIMNARK-CQSZACIVSA-N 480.993 1.851 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@@H]1ON=C(c2ccccc2)O1 1835678503 OISINXCCNDYHTF-VWLOTQADSA-N 495.536 1.413 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)c1cnc(O)[nH]1 1835963192 DJAPYJUFDTWJRW-UHFFFAOYSA-N 479.541 1.093 10 20 JDCD CNCCCC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837868410 XBKCRQJWOSZNSO-FNORWQNLSA-N 461.559 1.815 10 20 JDCD CCC(=O)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1838111957 XSSXSUAHJJVPJA-UHFFFAOYSA-N 454.527 1.757 10 20 JDCD CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)no1 1838129007 ZDFPFQALDUJAEF-OAQYLSRUSA-N 465.890 1.685 10 20 JDCD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)cn1 1839432212 HFODGMTUBHDQJI-JOCHJYFZSA-N 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NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)cc2)C1 748459338 FVJVGOHSZVDLRE-QFIPXVFZSA-N 492.624 1.926 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 749404946 SELSDCAVLFYUNV-GASCZTMLSA-N 451.520 1.782 10 20 JDCD NS(=O)(=O)c1ccc(OCC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 750175323 WDZGPSUONRJUNG-UHFFFAOYSA-N 494.481 1.670 10 20 JDCD C[C@@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 917919305 ZFFVLOXHECFDEA-ZIAGYGMSSA-N 457.549 1.565 10 20 JDCD COC(=O)COc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 917929534 GXNCATMHJPAXQE-KRWDZBQOSA-N 461.540 1.419 10 20 JDCD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918340818 VXFYSBBIZULKRV-RUZDIDTESA-N 496.589 1.537 10 20 JDCD CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918443620 XKQSQOVZJQGRMD-UHFFFAOYSA-N 490.582 1.332 10 20 JDCD COC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918464960 FUKRXMFJPZDMFZ-INIZCTEOSA-N 453.499 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CC(=O)N(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1778103112 QZSDNRYAOMXBEQ-IUBQTAPSSA-N 483.569 1.160 10 20 JDCD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)n1ccnn1 1781546972 HKABDAAOVLDFGM-WPSZSDGUSA-N 479.541 1.146 10 20 JDCD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)c(F)c1 1781600188 UJKDJWPFYPRCTI-HXUWFJFHSA-N 467.544 1.138 10 20 JDCD Cc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1781726126 PLTCULKMAWQHDD-HXUWFJFHSA-N 468.000 1.952 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnco4)c3)C2)C1 1781797587 AHTLFUIREBLNPS-QFIPXVFZSA-N 486.575 1.645 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@]2(C1)CN(C(=O)c1[nH]nc3ncccc13)CCO2 1782001276 INUDGHGFMNYCDK-NRFANRHFSA-N 457.874 1.780 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2 1783222350 OYQNDIWYFZBCOT-KSCMVAJDSA-N 493.520 1.916 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(F)c1)C2 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O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146601 SHHFODVYMHXJLV-IBGZPJMESA-N 477.525 1.817 10 20 JDCD CS(=O)(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822971250 XUPRVWXYXULBHS-SFHVURJKSA-N 486.554 1.629 10 20 JDCD CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1823879659 YTNRVIGNUOITKD-NRFANRHFSA-N 482.585 1.670 10 20 JDCD CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1825236982 KABVELBJVHLEOS-CQSZACIVSA-N 468.539 1.374 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1834275386 XVEWQYPRXOMBIE-HXUWFJFHSA-N 482.415 1.290 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)c1nc[nH]c1[N+](=O)[O-] 1835101017 DXEFZVGSIXTEPO-UHFFFAOYSA-N 492.920 1.882 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(Br)cs3)C2)C1 1836417388 PDHIBWATUKUQAH-LJQANCHMSA-N 498.355 1.701 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1 1838502596 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DMNGQFPWKXGUJH-JFDVKVQISA-N 475.542 1.499 10 20 JDCD CC(C)(C)[C@@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828242145 HPNVEVCVIWBUSC-XPTSAGLGSA-N 456.615 1.322 10 20 JDCD COc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833826499 RTSQKTFHWRBLBQ-UHFFFAOYSA-N 483.569 1.714 10 20 JDCD Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)n1 1833853389 CGBDCACRCRIEEO-UHFFFAOYSA-N 491.596 1.556 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C[C@@H]3COc4ccccc4O3)CC2)CC1)c1cc(O)nc(O)c1 1834985920 QSYTXRCMPVEPPT-HXUWFJFHSA-N 496.564 1.908 10 20 JDCD CC(C)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1837601732 GKTTXIHQFGTWCO-SPLOXXLWSA-N 456.923 1.635 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC(OC2CCN(C(=O)c3cnc4ncccn34)CC2)CC1 1838031613 VRYDQQBKARMMSY-UHFFFAOYSA-N 466.498 1.462 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(F)c1 1839260843 SRJUOZFBXAKWNO-NRFANRHFSA-N 481.571 1.064 10 20 JDCD CCN(CC)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1839678727 FWJCVABZQQRVHG-MWTRTKDXSA-N 483.993 1.799 10 20 JDCD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)cc1 1839938332 GCSUGRSAFAVUKT-XMMPIXPASA-N 455.511 1.504 10 20 JDCD O=C(CCc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1840053551 UJBGYFPHWUAHJW-HSZRJFAPSA-N 459.474 1.335 10 20 JDCD C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881681 JCCHOCMRGQTSSJ-IEITXGKISA-N 497.548 1.547 10 20 JDCD CCN(CC)C(=O)Cn1c(=CC(=O)C2CC2)sc(=Cc2ccc(N3CCOCC3)c(F)c2)c1=O 727464686 NBAWBZVYPPFSEL-UHFFFAOYSA-N 487.597 1.342 10 20 JDCD CS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)cc1C(=O)O 728014787 GJHOGQQFRATZMQ-UHFFFAOYSA-N 483.524 1.030 10 20 JDCD COC(=O)Nc1ccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)cc1 743432248 KZOSSQAKVAYLLM-UHFFFAOYSA-N 455.515 1.750 10 20 JDCD CCOC(=O)c1c(NC(=O)COC(=O)Cn2ccc(=O)n(C)c2=O)sc(C)c1-c1ccccc1 915398978 XVLOVYZGMOKWMD-UHFFFAOYSA-N 485.518 1.943 10 20 JDCD Cc1c(NC(=O)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cccc1-n1cnnn1 918285980 CTHLUROVBGJHBV-GASCZTMLSA-N 467.505 1.978 10 20 JDCD Nc1c(C(=O)OCC(=O)c2ccc(S(N)(=O)=O)cc2)ccc2c1C(=O)c1ccccc1C2=O 918848334 RKIIPJWUDJRFER-UHFFFAOYSA-N 464.455 1.731 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cccc(S(=O)(=O)N(CC)CC)c3)nc12 918848651 MSMGAQGACDXVBL-UHFFFAOYSA-N 476.511 1.999 10 20 JDCD COc1ccccc1C(=O)NCC(=O)OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 918968118 UDMGFCRCJCWOFK-UHFFFAOYSA-N 459.474 1.260 10 20 JDCD CN(C)C(=O)N1CCC(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 919112896 VXSRBQAVWRYQLC-UHFFFAOYSA-N 450.511 1.215 10 20 JDCD CN1CCN(Cc2cccc(NC(=O)C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)CC1 920187883 IIVLWGDUFDSTOC-UHFFFAOYSA-N 465.598 1.868 10 20 JDCD COC[C@H](C)NS(=O)(=O)c1ccc(N/C=C2/C(=O)NC(=S)N(CC(C)C)C2=O)cc1 920979788 IYGRIDDXJBZKLD-LWLPBDFMSA-N 454.574 1.195 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2)C1=NN(c2ccccc2)C(=O)C1 1778126218 MDXFIMQDIAXBCX-PXDATVDWSA-N 478.505 1.560 10 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1785506125 VWTNUIQCKHKIHS-WYAMSBGYSA-N 475.885 1.714 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1785546932 MDPHOWVGAYKWPG-NRFANRHFSA-N 459.549 1.737 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cc(CO)on3)cc2)CCC1 1790177957 VWNGNSIELFAQPQ-UHFFFAOYSA-N 460.537 1.775 10 20 JDCD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc(C)c1C(=O)O 1790317397 SPARHVBPTHCIHB-WBAXXEDZSA-N 469.494 1.715 10 20 JDCD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1791082027 BLBZWOOPWBTSCG-OWLYRPNTSA-N 490.557 1.486 10 20 JDCD NC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1)c1ccccc1 1792218508 IOSWDWSRSFURKB-RTMHFOTOSA-N 481.549 1.539 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)c(F)c1)C2)c1cc(O)nc(O)c1 1796140534 RZNIVHQIYMMSMY-FAQVEIGNSA-N 471.485 1.938 10 20 JDCD CC(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)no1 1796481303 PAPFLVJRSMNSMO-MFKICJERSA-N 465.510 1.794 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934265 GRQJKDFSYTVAOM-NRDMVMEKSA-N 460.538 1.383 10 20 JDCD COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)ccc1[N+](=O)[O-] 1800047279 HGFJRNQEFDBJOQ-MUJYYYPQSA-N 456.455 1.904 10 20 JDCD CN(C)c1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)cc1 1801194143 QTLOTAXFGGHCGO-FEJSZKPUSA-N 454.527 1.395 10 20 JDCD O=C(CN1CCCC1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1802560287 HOQLINZNAXYBDU-OXQOHEQNSA-N 461.613 1.044 10 20 JDCD CC(=O)c1cc(C(=O)N2CCCC3(CCN(C(=O)CN4C(=O)CSC4=S)CC3)C2)n[nH]1 1807942929 ZXFDBOJKBUMEBS-UHFFFAOYSA-N 463.585 1.317 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993231 HAMDEMUJULSWHX-VBKZILBWSA-N 467.442 1.012 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12 1808130993 DSDRYQUZGDLZRP-LHSJRXKWSA-N 459.466 1.793 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808188808 UVPVLNOQHUEASC-BTYIYWSLSA-N 477.477 1.687 10 20 JDCD Cn1cnc(C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)n1 1808464388 LJCUIMSLLOJCGY-LAUBAEHRSA-N 472.509 1.323 10 20 JDCD CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808464716 OENMPVWPGRVCJW-XXBNENTESA-N 490.564 1.795 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cccc(F)n1 1810762906 NGBDDMWAPCEZLO-IFXJQAMLSA-N 473.555 1.796 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806797 SQBZJNIQXOHLHX-FDZBUTDGSA-N 460.918 1.189 10 20 JDCD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1812318256 KGYZRJUDZDSLRE-DOULXXCGSA-N 488.548 1.920 10 20 JDCD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190260 VHFDKTVJHRRGDC-IERDGZPVSA-N 486.623 1.530 10 20 JDCD Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1814913761 NLOAQMFELWQJTG-MRVPVSSYSA-N 466.570 1.108 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)n[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818146598 RXPLNCHWXYKMKP-QGZVFWFLSA-N 462.470 1.937 10 20 JDCD CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818147327 XUANAKGXAPBQCT-UTKZUKDTSA-N 497.512 1.259 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1819419317 UMHMQCSJIUAIBK-IUODEOHRSA-N 452.475 1.812 10 20 JDCD O=C(N[C@@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1)C1=NN(c2ccccc2)C(=O)C1 1820298782 RUENSWRDRQCIRL-LLVKDONJSA-N 494.493 1.793 10 20 JDCD Cn1nncc1C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195548 PROZBRWDHGUHTI-KTROKBFUSA-N 456.484 1.328 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnn1)CC2 1828197546 ARXLGAWKNZZGRW-WNPFHQFXSA-N 453.480 1.989 10 20 JDCD Cc1[nH]nc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)c1F 1828239953 MIMDDWMJHXWBFK-QMMMGPOBSA-N 468.561 1.400 10 20 JDCD CC(C)n1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)n1 1828244373 DKHCSQSNFJIEIV-SNVBAGLBSA-N 479.613 1.402 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)CCO2 1830834925 YYLCAAAUMPHIFM-SRGWNRLKSA-N 489.475 1.645 10 20 JDCD Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1834250592 SZRMLXUOTKTVOK-UHFFFAOYSA-N 465.601 1.029 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1)c1cc(O)nc(O)c1 1834988957 YDEHGNWFNYKMSK-OXJNMPFZSA-N 485.585 1.079 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CS(C)(=O)=O)CCO3)C2)cc1 1835257569 OVIBYHLBALXPAG-DEOSSOPVSA-N 489.594 1.209 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1 1838076732 INUIYQBWJBIKSC-UHFFFAOYSA-N 492.916 1.878 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1 1838824691 CIDMDYXFSZFYEX-OAHLLOKOSA-N 469.629 1.272 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)nc3)C2)C1 1840880848 OWXHPCNVUPGSBW-DLMBFZKISA-N 473.457 1.121 10 20 JDCD C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)N1C(=O)OC(C)(C)C 1841011627 AYOOZMNZZGRFGR-GJZGRUSLSA-N 496.655 1.838 10 20 JDCD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841779558 ZPAKKCFWRREXPJ-HNNXBMFYSA-N 496.655 1.840 10 20 JDCD COc1ccc(N2CCC(NC(=O)C(=O)N3CCc4cc(S(=O)(=O)N(C)C)ccc43)CC2)cc1 726726056 LULPQVXBLQWFPK-UHFFFAOYSA-N 486.594 1.620 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)[C@H](C)NC(=O)c3n[nH]c4ccccc34)CC2)cc1 728372130 UQVBSJXYMFIMTC-INIZCTEOSA-N 465.510 1.582 10 20 JDCD CCN1CCN(C(=O)CC2CCN(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2)CC1 731214328 DBKONUUUBGMBJH-UHFFFAOYSA-N 471.646 1.610 10 20 JDCD CCn1cnnc1-c1cccc(NC(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 743433189 YFNZOILWMIBZSX-UHFFFAOYSA-N 477.569 1.851 10 20 JDCD NS(=O)(=O)c1cnn(CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 749733713 XZHZUOYSSXQFGJ-UHFFFAOYSA-N 461.466 1.092 10 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CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)n1 1814189628 URAICQDAQUUJEG-YJBOKZPZSA-N 487.611 1.434 10 20 JDCD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c[nH]1 1814189664 VKLMVJUPRAGFQG-KXBFYZLASA-N 457.581 1.898 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1 1814191542 KAAKWZVDVIDVIN-VQEPCJJFSA-N 476.624 1.499 10 20 JDCD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1815340205 DXAPFISJRKHQBA-CQSZACIVSA-N 480.616 1.424 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ccncc13)CC2)c1cc(O)nc(O)c1 1816726339 WFYUQOFWGZCXGM-SNVBAGLBSA-N 451.468 1.760 10 20 JDCD CC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362710 UPIXTWLBAFFGLF-JSGCOSHPSA-N 483.554 1.295 10 20 JDCD Cc1nn[nH]c1C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362899 YGYPUWPSDHRINH-LBPRGKRZSA-N 464.511 1.588 10 20 JDCD CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)[nH]n2)CC1 1818815238 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O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)c3ccco3)CC2)CC1 1837395749 SWBQPCGIHUEMBF-UHFFFAOYSA-N 451.570 1.752 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839270922 BSIQHVPTSOURBO-OAQYLSRUSA-N 465.865 1.669 10 20 JDCD Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)n1 1839432665 VKDPJLZKVOTKPY-JOCHJYFZSA-N 478.933 1.335 10 20 JDCD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1)n1cccc1 1840350646 GFXREJKEODOWDQ-UQBPGWFLSA-N 479.537 1.298 10 20 JDCD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1C 1840645982 YSMFTWGMMGWSGN-QGVYAHRCSA-N 498.532 1.904 10 20 JDCD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1)c1ccccc1 1840897700 RDUPVMXQPXMVHA-AOMKIAJQSA-N 477.608 1.107 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1cccnc1)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1842088070 SZAIFJIKHFKZPY-GOSISDBHSA-N 497.552 1.841 10 20 JDCD CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)c[nH]c1C 1843248845 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COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)CC2)cc1 726064756 PXMAZDZFRVNVAF-UHFFFAOYSA-N 467.931 1.502 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)Cc3csc(N4CCCC4=O)n3)CC2)cc1 749985775 ZPAVGQLJXNQYQH-UHFFFAOYSA-N 458.540 1.713 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)COC(=O)C3(S(C)(=O)=O)CCCC3)cc2F)C[C@@H](C)O1 750271677 FOCRTWDUHSQPPW-HZPDHXFCSA-N 470.563 1.956 10 20 JDCD CCOC(=O)C1=C(COC(=O)c2ccc3c(c2N)C(=O)c2ccccc2C3=O)NC(=O)N[C@@H]1C 797354887 HVTFKHJEWNMUTM-LLVKDONJSA-N 463.446 1.720 10 20 JDCD O=C(COC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1cccc2c1C(=O)c1ccccc1C2=O 845936690 MSQBKHGGIWLHNG-WJWAULOUSA-N 484.464 1.751 10 20 JDCD CCCCNC(=O)CN1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 916986138 KIGPFTREJVZOHH-BGYRXZFFSA-N 477.625 1.589 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(S(=O)(=O)NC4CC4)c3)cc2)C1 917832716 FJSADTUOJKULPX-SFHVURJKSA-N 456.568 1.759 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)CN3C(=O)COc4ccc(Cl)cc43)nc12 918942445 URMLSZOBORIFOD-UHFFFAOYSA-N 460.830 1.734 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1 1778514863 KKCGPPWYRYFLIC-FBUBFAHDSA-N 464.478 1.837 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3cccc(Cl)c3)C2)C1 1780632175 UPRIUPOGYWEBAE-IBGZPJMESA-N 453.973 1.644 10 20 JDCD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)nc2nccn12 1782008251 WNMUGQVDJZTSSW-JOCHJYFZSA-N 471.901 1.860 10 20 JDCD CCO/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1782379909 YMWCRXYDDOUDOU-CKZROAONSA-N 454.527 1.843 10 20 JDCD CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)C(C)(C)C 1784316089 VAOWAYLBKNLMIR-UONOBRNXSA-N 489.569 1.347 10 20 JDCD Cc1cnc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)/C=C/c5ccc(O)c(O)c5O)C4)C3)cnn2c1 1785505087 AQWORGNCZYVOBH-ISTCRNMPSA-N 479.493 1.311 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1785506016 XUXPXAICHKOQLS-OJZQOFKYSA-N 465.466 1.003 10 20 JDCD 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1.170 10 20 JDCD CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C)C2 1795147574 NONDBMGWQNMDKQ-WYADAEROSA-N 491.585 1.923 10 20 JDCD CS(=O)(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)c(O)c(Cl)c2)C3)CC1 1797706172 KQVOOUSPFKNWBI-MUJYYYPQSA-N 485.990 1.675 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799934762 ROAFQTOKOAUIHH-BPMXNFAZSA-N 469.538 1.856 10 20 JDCD C[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801228920 YKVJUZVEHQJQGU-BCXSYDNISA-N 467.522 1.680 10 20 JDCD COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1803576094 DGHRLYCHPGHHLS-JLTOFOAXSA-N 460.512 1.114 10 20 JDCD O=C(CNC(=O)c1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1804366198 KTQNHRKVYUOPTE-OPAMFIHVSA-N 476.493 1.032 10 20 JDCD Nc1nc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)cs1 1807235371 BBUXGWGEYORBMW-WBMJQRKESA-N 476.609 1.300 10 20 JDCD COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1808826398 COSAFTHFGGLVPX-LIRRHRJNSA-N 489.579 1.396 10 20 JDCD C[C@H](CC(N)=O)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811798125 ZPZMSMSGUJCAAX-UHYGZKCKSA-N 460.918 1.977 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ccc(=O)oc2)[C@H]1c1cccnc1 1814185829 GMUHIYWXAWWYIY-KUHUBIRLSA-N 472.548 1.215 10 20 JDCD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)cn1 1814186494 QQURESFTPDQYBX-OXJNMPFZSA-N 469.592 1.965 10 20 JDCD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1Cc3ccccc3CN1)CC2)c1cc(O)nc(O)c1 1816724766 HAJGATYRXLTJFP-DOTOQJQBSA-N 465.535 1.890 10 20 JDCD CN(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362241 ISYHAZJCAGOJBS-CQSZACIVSA-N 454.556 1.800 10 20 JDCD CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)n[nH]2)CCC1=O 1818146075 RLIMYOVSOHUWPH-IBGZPJMESA-N 490.524 1.803 10 20 JDCD CNC(=S)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1819804885 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CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900129 JAZRVKWTHXNIQU-MSOLQXFVSA-N 482.672 1.771 10 20 JDCD CC(C)CNC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832901265 CQGBBDPHZSPUKF-INIZCTEOSA-N 468.645 1.239 10 20 JDCD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)n1 1834046710 JRAVJEFRTTXBHK-RUZDIDTESA-N 477.521 1.253 10 20 JDCD COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c1 1834988243 VPQPNBLEOQBURY-UHFFFAOYSA-N 468.554 1.929 10 20 JDCD CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cc3ccc(N)cc3)NC(=O)OC(C)(C)C)C2)C1 1835199682 HHNYWTROWFVZFU-YKSBVNFPSA-N 476.574 1.181 10 20 JDCD Cc1noc(N)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1835628428 QLQGFRDRUAVTPV-HXUWFJFHSA-N 466.878 1.014 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccnc2c1OCO2 1836092568 FHBQYCOXNDYSMY-UHFFFAOYSA-N 469.498 1.116 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836628136 PSVQQHCFPYQZAW-WOJBJXKFSA-N 473.448 1.480 10 20 JDCD Cn1c(C(=O)N2CCC(OC3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)cccc1=O 1837378670 HBIIBJYTPSUTHK-UHFFFAOYSA-N 456.499 1.118 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H]4CCNC(=O)C4)C3)C2)cc1 1839349254 LWUQETIHMNVREI-CUNXSJBXSA-N 494.592 1.690 10 20 JDCD CCN1CCC(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)CC1 1839435678 XNEHCYMIEDWIAA-HSZRJFAPSA-N 481.977 1.553 10 20 JDCD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c1C 1840070465 TYEHBNWOVNWBEG-XMMPIXPASA-N 471.510 1.123 10 20 JDCD Cc1cncc(CCC(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840879801 GJPBEKVGTQZHJK-QBHGEWLWSA-N 497.548 1.609 10 20 JDCD CC(C)n1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880864 QGMPEUHIRZVGEQ-JIBKAZCMSA-N 486.525 1.364 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)c2cc3cccnc3nc2O)C1 1845608698 REOWZBOBCLLTLL-FNORWQNLSA-N 462.462 1.983 10 20 JDCD Cn1nnnc1SCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 747919043 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COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1 1789659601 UQMYKKXWGJJENY-INIZCTEOSA-N 478.596 1.132 10 20 JDCD CN(C)c1c(F)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)cc1F 1796140142 CVCAGNJXJLTUPH-HBCWATKFSA-N 462.453 1.354 10 20 JDCD COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)c1OC 1796140622 QWKBYZQCZNQDBP-DBWKPXFBSA-N 461.446 1.166 10 20 JDCD CC1(C)Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cc(O)nc(O)c3)C4)c2O1 1796259319 XVPIUZAIZGOZPA-CWPLJXCYSA-N 453.495 1.723 10 20 JDCD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c(O)n1 1796480473 DZLUSMZJFSPSOY-VPTLXERWSA-N 463.494 1.092 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2)c1cc(O)c(O)c(Cl)c1 1799767932 BPFKAYJEJSEVGT-IVWMJMPLSA-N 457.874 1.540 10 20 JDCD O=C(C[C@@H]1COc2ccccc2O1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804334182 HSSNKQHKVNHQSK-QKPAOTATSA-N 475.592 1.715 10 20 JDCD COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)n1 1804397011 SOTZKMQXAYPBOA-AOMKIAJQSA-N 499.618 1.594 10 20 JDCD O=C(Cc1ccncc1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1807527558 GXEUCQDXPJYTCG-UWJYYQICSA-N 469.592 1.585 10 20 JDCD CC1(C(=O)N2CC[C@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)COC1 1808464762 PEAJLFNUXCLGHF-GCJKJVERSA-N 461.522 1.917 10 20 JDCD NC(=O)[C@H](N)CCC(=O)N1CC[C@H](CNC(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1 1811804189 RQQXALHUIDETQI-NRXGSXMXSA-N 475.933 1.059 10 20 JDCD CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1812649895 PDKICCDEGBDLSP-ICPLQIHGSA-N 476.537 1.405 10 20 JDCD O=C1CC(C(=O)N2CC[C@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)C1 1814165522 GYLIUPYOIZEFDO-KXTAVISMSA-N 451.479 1.897 10 20 JDCD Cc1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814189025 JIXJCVSKUVXMKU-OXJNMPFZSA-N 469.592 1.965 10 20 JDCD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)s1 1815584744 HUFYIBBWSAQIHR-SECBINFHSA-N 482.638 1.318 10 20 JDCD CS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146728 ZNUBMBOMLKTIHK-QGZVFWFLSA-N 472.527 1.239 10 20 JDCD CN1CCC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)C1 1830186707 VMFJMELLZBMJRN-ZWKOTPCHSA-N 466.673 1.808 10 20 JDCD Cc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1831841275 NKZDSLIXACEQJM-SXBBHYFQSA-N 469.494 1.290 10 20 JDCD Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)c1 1834892757 GIRISWXQNQBZEV-UHFFFAOYSA-N 491.596 1.556 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(-n4ccnc4)ccn3)CC2)CC1)c1cc(O)nc(O)c1 1834988702 GROZBCWVRYQUGT-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD O=C(CCOc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417975 SOYIGTZCBYZYNK-HSZRJFAPSA-N 457.483 1.032 10 20 JDCD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CCO2)C1 1839348265 KMCRHVZTFBUAEX-FNZWTVRRSA-N 482.581 1.689 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)Cn4nccn4)C3)C2)cc1 1839348551 VOIKOMHXGLDIED-VWLOTQADSA-N 478.553 1.456 10 20 JDCD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1)c1ccccn1 1840881407 AIEJSZWJRJVMPZ-KQQBJBPKSA-N 483.521 1.472 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)C1CCSCC1)CCO2 1840924416 MFLZOQWHYLXBBK-DEOSSOPVSA-N 486.594 1.379 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccc(Br)nc2F)C1 1842142117 FGPLUDBGRDWWNE-UHFFFAOYSA-N 487.376 1.661 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1846190313 QURKMNKCPGDUNI-CMJOXMDJSA-N 458.515 1.709 10 20 JDCD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCS(=O)(=O)C3)c2C)c1 10619909 NTPDKZSWZCRRKU-HNNXBMFYSA-N 491.518 1.828 10 20 JDCD COc1ccc(CNC(C)=O)cc1S(=O)(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)O)c1 728014795 GYBORESYESBEIC-UHFFFAOYSA-N 471.513 1.202 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 743432804 SLFADTJENABECX-UHFFFAOYSA-N 463.542 1.461 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CNC(=O)CCc3ccc(C)cc3)CC2)cc1 749311777 DJYJIFMTUGRRCH-UHFFFAOYSA-N 453.539 1.944 10 20 JDCD NS(=O)(=O)c1ccc(CC(=O)OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)s1 914961242 HCOVTNQEEIWNSO-UHFFFAOYSA-N 484.511 1.895 10 20 JDCD O=c1[nH]c2ccc(S(=O)(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc2[nH]c1=O 917912809 YFDYXYNXGOIIFN-UHFFFAOYSA-N 484.456 1.550 10 20 JDCD COC(=O)[C@@H]1CN(C(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2ccccc2O1 918284679 NTICAARBFKBMQE-FQEVSTJZSA-N 457.458 1.246 10 20 JDCD CON(C)S(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 918437994 CWXYCPPTKPGWFQ-UHFFFAOYSA-N 494.545 1.224 10 20 JDCD O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C(=O)Nc1ccc2nc3n(c(=O)c2c1)CCC3 918442547 OZVQKBSNRHCMPU-UHFFFAOYSA-N 475.549 1.806 10 20 JDCD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919971176 JBBQBGTUEAOGQX-HNNXBMFYSA-N 465.547 1.779 10 20 JDCD COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1 920196190 LJGJHCKGCUZWCW-UHFFFAOYSA-N 488.566 1.227 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)CN(C)C(=O)[C@H](C)n3cccn3)cc2F)C[C@@H](C)O1 920546150 AGFLTNFRUZTKAH-KSZLIROESA-N 489.548 1.515 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cnn2ccncc12 1778687497 OULSFWJNBGVGAG-KSCMVAJDSA-N 493.520 1.687 10 20 JDCD COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1OC 1780453675 RVMUYAGMPFAUOA-JIBKAZCMSA-N 485.493 1.373 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@]3(CN(C(=O)C[C@H]4NC(=O)NC4=O)CCO3)C2)cc1 1781751555 UAHCCSFEWMHINS-NLFFAJNJSA-N 479.537 1.136 10 20 JDCD C[C@@](O)(C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)C(F)(F)F 1782004091 TTXPYIMETMGCPY-IAGOWNOFSA-N 452.813 1.508 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1782008678 GSHPHHMMWKTOHZ-NTKDMRAZSA-N 484.940 1.961 10 20 JDCD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782159392 JGYBFFJWQFIWRY-MNFWLRKXSA-N 473.526 1.376 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1782708241 WIOJAZRICRQESH-ODXCJYRJSA-N 456.879 1.756 10 20 JDCD C[C@H](Cn1cccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1785442633 VBSHKBZIIQVSMO-DFHZNHDVSA-N 462.934 1.877 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cc(C(F)F)no1)CCO2 1785509541 UYHLXSOYYIHLKC-XAFBZQIESA-N 465.409 1.886 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1ccnc3ccccc13)CCO2 1785540103 MPDOTQQLXJHMMI-QFIPXVFZSA-N 470.576 1.539 10 20 JDCD COc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1F 1785545972 DJQXEHQVEAPJEM-HXUWFJFHSA-N 467.544 1.138 10 20 JDCD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)n1cccc1C=O 1786995316 FWNOSHQMKQAAKV-GTTWDHLJSA-N 483.521 1.672 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)[C@H]1C[C@H]1c1ccccc1 1791209227 JNYOWOHOMBWFCJ-VMXHOPILSA-N 473.620 1.630 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(F)c3)C[C@@H]21 1792218417 BFYXZPFVRXWZIN-KZDRFYRXSA-N 457.458 1.644 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O)c1cc(O)c(O)c(Cl)c1 1795354163 SNDXDFWJWZKYNY-CLLJXQQHSA-N 459.890 1.257 10 20 JDCD CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796136081 OBCPGSDXMJCHBS-CWPLJXCYSA-N 478.546 1.391 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cc2ccccn2n1 1796836152 ZPYSJOUAFMTDTJ-GSNLVNFQSA-N 464.478 1.368 10 20 JDCD CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)cc1C 1798233832 JBINLBJMUHICQN-DOZWIBKZSA-N 456.499 1.245 10 20 JDCD O=C(CCCn1cccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1801416584 FAJYQSYNGBRBBQ-HCSKGQDESA-N 455.511 1.688 10 20 JDCD COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cc1 1802082420 KKDUSVWDMZHGTP-LMDGECGLSA-N 496.516 1.436 10 20 JDCD C[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1804356818 MPGNZCAHDBMOBC-LLLHUVSDSA-N 474.608 1.303 10 20 JDCD O=C(Cc1ncccn1)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1804692755 WXYOKLMENIRTLE-DFBJGRDBSA-N 483.532 1.913 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ncccn1 1805783293 BNJNKGNKICEIFQ-WMLDXEAASA-N 456.553 1.052 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1cc(=O)cco1 1806131647 FOVFRCUUZRZCIX-IFXJQAMLSA-N 472.548 1.215 10 20 JDCD O=C1CC[C@@H](C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)N1 1808468071 NTJZQBYTGFTLOA-LTMIRXACSA-N 474.521 1.159 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808469553 PFPLOUJBYHFIKJ-YRXHYFPISA-N 473.533 1.773 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811611257 JDELDZVFFRVCMW-YJYMSZOUSA-N 452.427 1.758 10 20 JDCD O=C1CC[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)CC3)N1 1814047846 MKPUMXKLUJVQRR-WFASDCNBSA-N 466.523 1.127 10 20 JDCD O=C(O)CSCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814166335 QJUKVOBDCIHDRU-FTPWQXHLSA-N 487.534 1.735 10 20 JDCD CC(C)c1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)no1 1816721753 OWBOLMZJFSCOFO-LLVKDONJSA-N 458.500 1.924 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCO3)CC2)c1cc(O)nc(O)c1 1816726745 YQNVVIWURCPCBD-LLVKDONJSA-N 456.484 1.468 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)c1cc(O)nc(O)c1 1817847623 PFRZWNFGJNXPFJ-JTQLQIEISA-N 466.380 1.973 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cc(CO)on1 1820353430 UWKHVHMCJHWLRG-ZDUSSCGKSA-N 464.529 1.056 10 20 JDCD Cc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cn1 1823497269 UFNCJFWQIBVFRX-CQSZACIVSA-N 459.557 1.674 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)[nH]n1 1823500038 KYCUEQPNGQVQBQ-AWEZNQCLSA-N 484.567 1.619 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1)CC2 1828249417 HGPJJJNIANDREH-MWLCHTKSSA-N 456.640 1.811 10 20 JDCD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1)N1CCN(C)CC1 1830241526 XJGSHNKMISDHDY-IEBWSBKVSA-N 495.715 1.102 10 20 JDCD O=C(c1cc(O)n[nH]1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898560 PFAQKOPWVRUWBU-CQSZACIVSA-N 451.574 1.209 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)C3(F)CCC3)CC2)CC1 1838819288 KBBORUZJDBKJRC-UHFFFAOYSA-N 457.593 1.738 10 20 JDCD CC[C@@H](CC(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)NC(=O)OC(C)(C)C 1845236702 OXKAFFMXTTZTKR-AWEZNQCLSA-N 484.644 1.744 10 20 JDCD CC[C@@]1(C)NC(=O)N(CC(=O)OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1=O 9946048 AATCMQYTIWDWLK-XMMPIXPASA-N 463.446 1.664 10 20 JDCD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 9975511 RIQCQILXHGVMIL-UHFFFAOYSA-N 455.559 1.343 10 20 JDCD CCNc1nc(NCC)n2c(SCC(=O)N3CCC[C@@H]3CN3C[C@H](C)O[C@H](C)C3)nnc2n1 109466463 FASRGPYDBHHSKB-OWCLPIDISA-N 477.639 1.575 10 20 JDCD COc1ccc(N2CCC(NC(=O)NCCCN3CCN(c4ncccn4)CC3)CC2)cc1 110465794 LBSUDZYKVLKLBJ-UHFFFAOYSA-N 453.591 1.966 10 20 JDCD COc1ccc(NC(=O)C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1-n1nnnc1C 726721640 XSDQZUZRWYLJEF-GOSISDBHSA-N 466.498 1.831 10 20 JDCD CC(=O)N1c2ccc(S(=O)(=O)Nc3ccc(NS(C)(=O)=O)c(C(=O)O)c3)cc2C[C@@H]1C 728015466 QZXCYPXPZGGLTD-NSHDSACASA-N 467.525 1.855 10 20 JDCD CNS(=O)(=O)c1cccc(CNC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c1 742939929 MITPYAGPGZJCJZ-UHFFFAOYSA-N 461.588 1.225 10 20 JDCD O=C(CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)NC(=O)N[C@H]1CCS(=O)(=O)C1 780881576 PUWJYOVRWDNQJX-QTWIXLPOSA-N 485.562 1.991 10 20 JDCD COCCN1C(=O)c2ccc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2S1(=O)=O 916745311 KRGBNHHUPMSHCQ-UHFFFAOYSA-N 473.551 1.586 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)cc2)C1 917832479 AYQLHLJBGZIAEX-QGZVFWFLSA-N 460.556 1.696 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)C(=O)Nc3ccc(-n4ccnc4C)nc3)CC2)cc1 918250401 RFWOGUJYCKCRNC-UHFFFAOYSA-N 477.569 1.851 10 20 JDCD O=C1N[C@H](C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CS[C@H]1Cc1ccccc1F 918644534 BXLSJGNENAPACI-SFTDATJTSA-N 491.610 1.520 10 20 JDCD COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1=O 918884817 XWYPILQUTJOEFB-SFHVURJKSA-N 485.512 1.883 10 20 JDCD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)cc1S(=O)(=O)N(C)C 920195738 ASDKOEWBQBUAIS-UHFFFAOYSA-N 460.556 1.337 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)COc3ccc(C(N)=O)cc3)cc2F)C[C@@H](C)O1 920718205 ILGNCIRDGPKRHF-IYBDPMFKSA-N 473.501 1.777 10 20 JDCD Cc1cc(C(=O)COC(=O)COc2ccc(C(N)=O)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 920718307 HXIUHLLLLDSIEW-UHFFFAOYSA-N 485.518 1.645 10 20 JDCD CCN1C(=O)C(=CNc2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C(=O)N(CC)C1=S 920978707 FWTYMQLCXUJCFP-UHFFFAOYSA-N 470.548 1.138 10 20 JDCD COCCN1C(=O)/C(=C\Nc2ccccc2C(=O)NCc2ccc3c(c2)OCO3)C(=O)NC1=S 920979881 MGFBGKZWSLXFLC-VBKFSLOCSA-N 482.518 1.531 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1snnc1C1CC1)C2)c1cc(O)nc(O)c1 1777848314 PWLMEEMGEHYWNL-SPLOXXLWSA-N 459.528 1.663 10 20 JDCD C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1779328235 WEDLHDLYKWZGCI-BVZFJXPGSA-N 476.537 1.505 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2)c1cc(O)c(O)c(Cl)c1 1781122014 IGKHKJLJONOGLN-IIBYNOLFSA-N 462.890 1.688 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1Cc3ccccc3C1)C2 1783247047 NXHQYTDJQZQCFL-NTKDMRAZSA-N 487.647 1.776 10 20 JDCD COc1ccc([C@@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)cc1 1783769998 UGERSXSXLLKXHQ-VTFYBKDISA-N 498.532 1.539 10 20 JDCD COc1ccc(COCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)cc1 1784097598 QCTZWBRDSNIDNM-HSZRJFAPSA-N 457.483 1.162 10 20 JDCD O=C(CCc1cccc(O)c1)N1CC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1784127491 BDJJLVNMPLLLDF-NRFANRHFSA-N 463.581 1.015 10 20 JDCD Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)n1 1784227650 JKQWSOCINWPTCS-GRRCIFBWSA-N 467.522 1.742 10 20 JDCD C[C@@](O)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)C(F)(F)F 1784875550 BTPIUJKBRXQUEI-ANUOLGOYSA-N 466.840 1.658 10 20 JDCD Cc1cc(C)n(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C[C@@H]32)n1 1785339353 NCNZRJDAQQBZSN-VCOUNFBDSA-N 478.553 1.273 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2 1785545437 TXVZWHQHQUFSSP-IBGZPJMESA-N 455.508 1.269 10 20 JDCD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccccn1 1796482712 RXTQWWIBXAZOGF-OVCNXMPXSA-N 461.522 1.568 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cnc2ccccc2n1 1796778665 DYGFHMMTZNGVGZ-SSSRBCPNSA-N 476.489 1.663 10 20 JDCD CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1802545399 GGYNAFBFKUHJNR-UVJKBGPYSA-N 482.537 1.832 10 20 JDCD O=C(Cc1ccc(Br)nc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S 1804336109 WJORUOBPWRXBRJ-BTTYYORXSA-N 497.440 1.885 10 20 JDCD O=C(Cc1cncnc1)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1804651092 AGSJRYDGIRNOLZ-QGVXSFBYSA-N 475.505 1.950 10 20 JDCD N=C(N)SCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1807001136 JUYFKLJOTCJBMP-IIBYNOLFSA-N 479.566 1.507 10 20 JDCD O=C(Cn1cncn1)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1807595771 HJRBNHYPPILFEP-JPYJTQIMSA-N 472.509 1.172 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cnc2ncccn12 1809333307 ZGWFYHVXDURYNT-MGPUTAFESA-N 459.466 1.564 10 20 JDCD O=C(CCc1cnccn1)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813448885 WPSJPFAGXCFDQO-IERDGZPVSA-N 484.607 1.371 10 20 JDCD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@@H]1c1cccnc1)n1cnnn1 1813473661 NKUYXMANRSKKIF-UVBSCNOISA-N 471.905 1.714 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cccnc2)[C@H]1c1cccnc1 1814186393 OMEFUXCRSVWIQD-KXBFYZLASA-N 455.565 1.657 10 20 JDCD CCC1(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)COC1 1814190073 QBRDPDNNUXYBJL-QAPCUYQASA-N 462.597 1.374 10 20 JDCD C[C@H](Oc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814192426 UZBUGWUXUICJDA-WJPUGNRLSA-N 499.618 1.810 10 20 JDCD C[C@@](O)(C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1)C(F)(F)F 1828240372 SSQRIVULPPEOTR-NZFNHWASSA-N 482.531 1.229 10 20 JDCD Cc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1830924704 PTLFKTPWCKJQPT-VQEXNLMWSA-N 483.521 1.219 10 20 JDCD Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1832619576 CYGQBNYRORVVFB-KXZPLDGJSA-N 497.548 1.609 10 20 JDCD O=C(CN1CCCC1=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898425 MUFJJCKDZWTEIM-MRXNPFEDSA-N 466.629 1.089 10 20 JDCD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1837342227 WWFZMGKFAQYKCF-SCADDTHXSA-N 497.548 1.774 10 20 JDCD CC(C)(O)CC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1837773891 VMRAFWKCWPOMHB-GQCTYLIASA-N 462.543 1.976 10 20 JDCD N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)c1ccccn1 1837876878 KGNOAHBQZXVHPX-NKOINVLESA-N 496.564 1.910 10 20 JDCD O=C(c1ccc(F)nc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433760 SKVVBXJPNUOVAP-NRFANRHFSA-N 465.865 1.669 10 20 JDCD COc1cccc2c1C[C@H](C(=O)N1CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C1)CC2 1839795250 RYMVDQUTSTZYEV-DWXRJYCRSA-N 497.548 1.377 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1 1840880162 ZHSXDFQGSNPGCW-UNEJLILFSA-N 498.532 1.671 10 20 JDCD C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881687 JKYGGWVRLKXDPF-LBCFNCEGSA-N 486.521 1.745 10 20 JDCD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC2(CCCN2C(=O)c2cc(O)c(O)c(Cl)c2)C1 1845501643 LJXZFTANHRFFQD-UHFFFAOYSA-N 485.884 1.874 10 20 JDCD Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)/C=C/c3ccc(O)c(O)c3O)nc2s1 1847978479 CUBKVQPGRRIXNX-TVKHYIBRSA-N 469.523 1.674 10 20 JDCD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NCc2cccc(OC)c2O)CC1 727761288 UJOXENNTSJPYRS-UHFFFAOYSA-N 462.524 1.905 10 20 JDCD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 728949719 VPZNODVEURXQEX-LJQANCHMSA-N 463.648 1.608 10 20 JDCD O=C(COC(=O)Cn1cnc2sccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 918833826 LOHYTEKVULADHK-UHFFFAOYSA-N 460.487 1.293 10 20 JDCD NC(=O)CC1CCN(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 919783765 MCFVNWBVDLOKIG-UHFFFAOYSA-N 455.538 1.739 10 20 JDCD O=C(Cn1nnc2ccccc21)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782003899 OHEIODWAAQJDSK-JOCHJYFZSA-N 471.901 1.640 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccoc4c3)C2)C1 1782331114 UBKZEIUZDFPFEZ-NRFANRHFSA-N 459.549 1.737 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1 1782459320 APJZQYJTULQEJM-VWLOTQADSA-N 490.495 1.710 10 20 JDCD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1)n1ccnn1 1783221667 KIELSNHEFWACNV-ARDCJGCZSA-N 471.514 1.183 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccccn1)C2 1783245326 RYBBSJJIFGXIQJ-VGOFRKELSA-N 476.624 1.388 10 20 JDCD O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1785256934 BQCOKITZWFSZAQ-JQFCIGGWSA-N 484.534 1.163 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785509822 AHSUWPWYWXKEIG-SXXCVNDQSA-N 486.521 1.402 10 20 JDCD Cc1ccccc1NCC(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538423 NTXHGUYYLHUROS-OAQYLSRUSA-N 462.597 1.097 10 20 JDCD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc(Cl)n1 1785539788 CFXIWCLGEACCLX-IBGZPJMESA-N 484.987 1.047 10 20 JDCD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)s1 1785919997 QWZBILBGXIRFKZ-IHRRRGAJSA-N 453.611 1.510 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1nccc2nc[nH]c12 1787355296 PVBZDIQRQLAQBN-KNBMTAEXSA-N 487.520 1.344 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccnc(Br)c1 1788821436 YIVUPSKERUJRDU-QEJZJMRPSA-N 477.315 1.557 10 20 JDCD Cc1nccn1CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1791571806 DCLNMJGSGKVLKU-WFVRYNGTSA-N 484.553 1.782 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 1793049321 UYWJPEXJFAJOGZ-BQXPFJCYSA-N 459.449 1.778 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2)c1cc(O)nc(O)c1 1796137463 IHOPCFDKSOOPPV-GFENJXEQSA-N 450.451 1.264 10 20 JDCD Cc1occ(C(F)(F)F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796137526 KSAUAXHCJFQWSL-DPIQGUFMSA-N 455.389 1.930 10 20 JDCD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cc1OC 1796480919 VEZNSRIEJGJNLT-MRSFGVLCSA-N 492.532 1.700 10 20 JDCD O=C(COc1cc(Cl)ccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1797906057 RPRJOLPBRYJJQW-RSQQPWMTSA-N 497.939 1.496 10 20 JDCD CCOc1c(F)c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)c1F 1799771550 HFIXJFPVMFRKTD-SLAYPKMVSA-N 481.427 1.826 10 20 JDCD 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470.580 1.379 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)c(O)c1)C2)c1cc(O)nc(O)c1 1796140323 JZMPKGIABTVTHF-IVWMJMPLSA-N 478.299 1.478 10 20 JDCD O=C1CSc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cc(O)nc(O)c3)C4)ccc2N1 1796291794 MQTURACPBGUPDH-VTEUUUEMSA-N 470.507 1.054 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CCOC1)C2)C1=NN(c2ccccc2)C(=O)C1 1796482766 XTALLALEDFNXGD-OVCNXMPXSA-N 454.527 1.186 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cc(N2CCCC2)ccn1 1796584611 BFEABVOZMSAMRB-PTRFLTKISA-N 494.548 1.715 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1 1802238020 ZSAOTKNAIRHBCC-DFGXFYAUSA-N 459.593 1.879 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)C1CC(F)(F)C1 1802639117 TWRGJQZBECFARO-CXAGYDPISA-N 468.551 1.993 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995845 UWQXYZYKFCURMO-KPZWWZAWSA-N 453.415 1.153 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808464335 KOYIWKVHFDKYQT-DVECYGJZSA-N 484.516 1.828 10 20 JDCD O=C1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@@H]2c2cccnc2)N1 1808468069 NTJZQBYTGFTLOA-GWJPWWOOSA-N 474.521 1.159 10 20 JDCD O=C1CC(C(=O)N2CC[C@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)C1 1808469917 RENPBSXUFXNXIA-UZUQRXQVSA-N 459.506 1.859 10 20 JDCD CC(=O)NCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1812626089 FOFARVADEJVINU-PQGDUDRBSA-N 454.483 1.054 10 20 JDCD CC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814185663 UMDUVIANARJHKT-YJBOKZPZSA-N 462.597 1.563 10 20 JDCD CCOCCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814191573 LDNNSQUFDMIBPI-DNVCBOLYSA-N 450.586 1.374 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(O)[nH]2)[nH]n1)C1=NN(c2ccccc2)C(=O)C1 1818147361 YTNBJCHTXQIPHO-KRWDZBQOSA-N 462.470 1.937 10 20 JDCD Cc1nnc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)s1 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O=C(CCc1ccccn1)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1804714897 SPEHKVYYPTYWRV-JTSKRJEESA-N 483.619 1.976 10 20 JDCD CC(=O)NC(C)(C)C(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1806052008 HIJPEOZCGMVUPP-UHFFFAOYSA-N 467.570 1.925 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807992532 BZLSAGJSVORUHS-IVZQSRNASA-N 451.458 1.984 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994637 XGWRZJZBVGSHGN-YJYMSZOUSA-N 454.874 1.965 10 20 JDCD O=C(COc1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1813709097 MHKGMAVAYJICJI-LBPRGKRZSA-N 476.605 1.994 10 20 JDCD COc1cccc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)n1 1814186945 ZSKZFNDRUAQQSM-MGPUTAFESA-N 485.591 1.665 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1 1814189479 QIKMMLSEGXJGSZ-YWZLYKJASA-N 496.574 1.798 10 20 JDCD O=C(Cc1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817624325 VBGBCDKRFSAOPO-HNNXBMFYSA-N 458.569 1.900 10 20 JDCD Nc1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)s1 1823497964 JMETWKDMEXNZLQ-SNVBAGLBSA-N 465.586 1.615 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3c1)CC2 1828246572 BMWSAGSLMABZST-LBPRGKRZSA-N 486.604 1.877 10 20 JDCD CCN(CC)C[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828246989 MJFCNDZHGZJRBL-OLZOCXBDSA-N 483.685 1.893 10 20 JDCD CCN(CC)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987089 AVVPQXCUYOSSDA-KRWDZBQOSA-N 461.607 1.656 10 20 JDCD CNCCCC(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132700 FRZORIPDAQCQIU-UHFFFAOYSA-N 468.602 1.351 10 20 JDCD Cc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1 1835166997 WJUAKTZOPXEPAW-AWQUAADZSA-N 498.532 1.660 10 20 JDCD O=C(/C=C\C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1)NC1CC1 1835659921 ORMBPIQLXWOULY-ARJAWSKDSA-N 490.988 1.771 10 20 JDCD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)N1CSCSC1 1835783135 KMUNCCVNJIGJBH-HNNXBMFYSA-N 495.671 1.721 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3csc(Br)n3)C2)C1 1836418376 QSSYFHZLSVZART-SFHVURJKSA-N 499.343 1.096 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2 1838165146 UHBQCEPQKUXZRE-XMMPIXPASA-N 499.474 1.223 10 20 JDCD CNC(=S)NCCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)CC2)CC1 1838396267 MVTOIZJHYOLSFD-UHFFFAOYSA-N 499.033 1.847 10 20 JDCD CN1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)C1 1839066982 AVBLTMPPPBZGAT-NYHFZMIOSA-N 467.950 1.163 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840427225 YRWKBQXCMPHZQA-WNSKOXEYSA-N 491.928 1.684 10 20 JDCD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc1 1840897003 HATQYGXNJQDNBZ-HXOBKFHXSA-N 491.635 1.415 10 20 JDCD Cn1nccc1C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843330597 IHXDTYYNOIYKAB-LJQANCHMSA-N 482.585 1.955 10 20 JDCD CCN1CCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)NC(=O)[C@@H](C)O4)cc2F)CC1 730680704 FNPXUQQUTCWFCH-OAHLLOKOSA-N 469.517 1.942 10 20 JDCD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)c(O)c(Cl)c2)C3)nn1 1779954951 VEFUZGVWTDWCCB-VGOFRKELSA-N 476.917 1.991 10 20 JDCD CC(C)n1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)n1 1780385664 NZQNSZRASAUNSH-DOHLAZSCSA-N 456.499 1.738 10 20 JDCD COc1cccc(OC)c1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1780542217 ONBQORICERPZKN-PMDNVAFQSA-N 484.505 1.978 10 20 JDCD CCN(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1781458200 BLAIXLJYHVRKNE-BCTMXQJVSA-N 461.559 1.671 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)[C@@H]1C[C@H]2CC[C@@H]1O2 1782025491 IWTCNUNCZNYVNU-WGADZNHISA-N 472.538 1.898 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cc(=O)c2ccccc2o1 1783823799 KEENYUFJBFZWPK-RISOHXOYSA-N 465.462 1.506 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1785545910 AABFWMZITFSHIC-OALUTQOASA-N 459.540 1.422 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21 1792219239 LQSJEFPWDCVKPU-QOGCKDPTSA-N 482.489 1.839 10 20 JDCD NC(=O)c1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1799625082 NRNBQJNJEYRYDJ-IVWMJMPLSA-N 459.886 1.367 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ccc(F)nc1F 1802313288 IKIXTEKTIRMHNI-FZKQIMNGSA-N 491.545 1.935 10 20 JDCD COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)cc1 1802799552 XRXUYKADNBGSGX-IMRHEYAYSA-N 478.505 1.950 10 20 JDCD CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)CC1 1804125434 BKWZTPBHENLGLO-MUJYYYPQSA-N 482.628 1.353 10 20 JDCD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)o1 1807471136 BMWKDNAUJGFQCZ-CJOSSSAMSA-N 479.493 1.852 10 20 JDCD COc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)c1F 1815825104 ZSAGLYPVSKCFJY-SECBINFHSA-N 495.583 1.772 10 20 JDCD Cn1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc(O)c(O)c3O)[nH]n2)n1 1816322113 GQZAHRLDCCSCAO-IZPAUZPXSA-N 453.459 1.674 10 20 JDCD O=C(CCn1cncn1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822694060 WITHDLXTLTVLRP-BIENSFFJSA-N 467.486 1.914 10 20 JDCD Cc1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cn1 1823496621 NFADKWROLVMHPY-AWEZNQCLSA-N 459.557 1.674 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)[nH]n1 1823498125 MZFNMKIOSDJDHS-ZDUSSCGKSA-N 484.567 1.619 10 20 JDCD O=C(c1cccn2c(O)nnc12)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426185 NWQXEBSDNJKXSL-KRWDZBQOSA-N 466.498 1.788 10 20 JDCD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1)N1CCN(C)CC1 1827427822 JJQPAMSXXYWIOS-PXNSSMCTSA-N 459.591 1.362 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3[nH]ncc3c1)CC2 1828245079 YMKZDBIYZZJKMI-LLVKDONJSA-N 487.592 1.501 10 20 JDCD O=C(O)c1cnncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1829252158 ZRIAXNJNOOFRMD-KRWDZBQOSA-N 455.471 1.528 10 20 JDCD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)nn1C 1832896361 FFAMVQKVCFWKDM-SFHVURJKSA-N 477.656 1.751 10 20 JDCD CN1CCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1833624422 WICFGHUERBEIHM-CYXJOQHWSA-N 472.586 1.482 10 20 JDCD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)on1 1834209332 ABDLTQSRKVSINZ-UHFFFAOYSA-N 478.553 1.961 10 20 JDCD O=C(Cc1ccc2ccccc2c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1834892247 SBEQJMVAZULZOR-SANMLTNESA-N 477.517 1.959 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)CC1)c1cc(O)nc(O)c1 1834987148 HBQBMXZEUVCXFF-UHFFFAOYSA-N 464.526 1.868 10 20 JDCD COc1cc(Cl)ccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836419705 VHZWUTYQKUNOGW-QHCPKHFHSA-N 491.928 1.468 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1 1838110475 NANCXCIQEWRANM-UHFFFAOYSA-N 481.509 1.785 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)cc(O)n1 1839434115 OIGFDWJRRJMILJ-QFIPXVFZSA-N 477.901 1.544 10 20 JDCD C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1840455349 LJMOWHYTSMLVGN-MIXPHTAASA-N 499.520 1.136 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCOC1)CCO2 1840878198 YUBXFZHOHUDPNI-SZNDQCEHSA-N 454.907 1.248 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)c3cc(O)nc(O)c3)C2)C1 1843249544 WTWREPXFAOYUOQ-QFIPXVFZSA-N 460.531 1.957 10 20 JDCD Cn1ccc(CC(=O)N2CC3(CCCN3C(=O)[C@@H](Cc3ccc(N)cc3)NC(=O)OC(C)(C)C)C2)n1 1843331296 GRFZAQKBKOLNRJ-OAQYLSRUSA-N 496.612 1.884 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(N3CCCOC3=O)cc2)C1 1845532619 RSRNVWBWUSHBHU-UHFFFAOYSA-N 452.467 1.970 10 20 JDCD O=C(c1cc2cccnc2nc1O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054248 AEHUBMXPHPBHDZ-UHFFFAOYSA-N 457.537 1.013 10 20 JDCD CCOC(=O)CN(C)CC(=O)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 207870140 ATQJDVBCKIRBAD-CXUHLZMHSA-N 465.553 1.228 10 20 JDCD O=C1COc2ccc(S(=O)(=O)Nc3nc(-c4cccc(-n5cnnn5)c4)cs3)cc2N1 727248938 NPNXJKSAXXPPGI-UHFFFAOYSA-N 455.481 1.918 10 20 JDCD CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 728839769 MWHZSADFXPAEQE-INIZCTEOSA-N 474.505 1.809 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)n(C)c(=O)n4C)cc2F)C[C@H](C)O1 747546987 CAXWDNXCIBXGGN-GJZGRUSLSA-N 469.517 1.885 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CN3C(=O)NC4(CCCCC4)C3=O)CC2)cc1 781787192 PSHFPAXWBPYOBA-UHFFFAOYSA-N 458.515 1.142 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](NS(C)(=O)=O)C3)cc2F)C[C@@H](C)O1 917103783 PLUFJARZKPSAAP-JZXOWHBKSA-N 456.584 1.069 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)cc3)cc2)C1 917833436 NKDMZXIATIDWFN-FQEVSTJZSA-N 486.594 1.339 10 20 JDCD COc1cc(C(=O)NCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1OC(F)F 918335592 QWIYQUROFCEPRE-UHFFFAOYSA-N 497.520 1.578 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)nc12 919033947 HIPLLDCHAZENNN-UHFFFAOYSA-N 454.848 1.269 10 20 JDCD C[C@H]1CN(C(=O)c2ccc(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)C[C@@H](C)O1 920349149 ULFZJOMIPVAXNO-GASCZTMLSA-N 461.540 1.943 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)NCCc2cnn(-c3ccccc3)c2)c1 920636809 MGULFAFVZDNGTD-UHFFFAOYSA-N 458.496 1.465 10 20 JDCD NC(=O)C1CCN(C(=O)C2CCN(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CC2)CC1 1317914606 IYFXBUMXPHMAEN-UHFFFAOYSA-N 475.565 1.308 10 20 JDCD Cc1n[nH]c(C)c1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1 1779392918 MTGGCGFCNQWUQA-HSZRJFAPSA-N 450.499 1.263 10 20 JDCD C[C@@H](Oc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782570092 DFNRLBRRPMLFIJ-OMXJDXKCSA-N 456.499 1.483 10 20 JDCD COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN3C(=O)CSC3=S)C2)ccn1 1783247843 CFOGKBRPTAPHGK-QVKFZJNVSA-N 478.596 1.078 10 20 JDCD Cc1cccc(F)c1C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1784940447 QRSHCKMPNYJJRQ-HXUWFJFHSA-N 451.545 1.438 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1cc(C(F)F)no1 1787143307 RJXPQKMCDBQXQJ-KWBADKCTSA-N 474.511 1.066 10 20 JDCD CSCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1791307201 CRIZARAYNWDZSI-ONQXIZJVSA-N 458.964 1.459 10 20 JDCD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)n1cccc1C=O 1795752309 NRTRFJJIQWVVQF-ICFDLICNSA-N 469.494 1.281 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCC3=O)C2)c1cc(O)nc(O)c1 1796137459 ICJDEABKLLYYNL-FAQVEIGNSA-N 451.479 1.529 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@H]1[C@H]2c3ccccc3S[C@H]21 1797764300 FPQGHIVIBKIYSO-DHAILBGBSA-N 453.520 1.584 10 20 JDCD COCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1798418304 MYSYSGDOHCQKBY-XMTFNYHQSA-N 477.558 1.818 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cnc2snnc2c1 1798506650 ATYVQHGSLKCQIA-UNALJEAJSA-N 483.506 1.120 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770028 BHFOCIOULDQMGB-FIIQBIKZSA-N 461.902 1.817 10 20 JDCD COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C=C/c2ccc(O)c(O)c2O)cc1 1802078019 XADKXSFEMNCUFR-MSWAYKLESA-N 484.505 1.494 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2 1802079116 TZSGVRNWWGWTPI-APEVVXCZSA-N 499.564 1.197 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCC3)C2 1802104285 YRXPKDDXKHDSTC-DBWKPXFBSA-N 479.649 1.690 10 20 JDCD Cn1nncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1804748125 VVLWSLZQBUOQLN-SMQNEPHISA-N 464.482 1.360 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994219 DRRVGTZULHZNFW-VFNWGFHPSA-N 459.466 1.564 10 20 JDCD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807998550 LBWQZQZERXZVJC-QLVMHMETSA-N 450.499 1.740 10 20 JDCD Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)cn1 1814186460 PGQYBCGMFOJNGD-KXBFYZLASA-N 470.580 1.360 10 20 JDCD COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817364135 NXCYPIKQSXVEQC-CYBMUJFWSA-N 493.549 1.904 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)[C@H]1Cc2ccccc2CN1 1818049100 SIISDJBMBLKBPV-MSOLQXFVSA-N 498.634 1.977 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cc2n(n1)CCCO2 1819090975 NXKNXIJSJBCRDD-AWEZNQCLSA-N 489.583 1.555 10 20 JDCD CCOC(=O)N[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1819240719 ZWPXSJZWBOYJHE-LAUBAEHRSA-N 497.512 1.259 10 20 JDCD Cn1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)c1=O 1823497686 YEGSVEAEZPYMIM-CQSZACIVSA-N 474.568 1.275 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1ccn(C(F)F)n1)CC2 1828244394 FOXSYNXMQTVHLA-MRVPVSSYSA-N 486.551 1.821 10 20 JDCD O=C(COc1ccc(O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1830346895 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Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H]2CNC(=O)C2)CCO3)cc1 1839873526 YRWMDOKVTIZJCV-HFZDXXHNSA-N 480.565 1.300 10 20 JDCD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1840336113 ISWDGFAXFMHDSS-BOKBGDLOSA-N 497.548 1.547 10 20 JDCD O=C(CCN1C(=O)c2ccccc2C1=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847033793 DRSMTUUTWRIEHZ-VQHVLOKHSA-N 491.500 1.706 10 20 JDCD O=C(NCC(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1)c1cccs1 1847033959 RCLBCRKWGIJNOW-FNORWQNLSA-N 457.508 1.512 10 20 JDCD Cc1cc(C(=O)OCCN2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)c(C)n1-c1ccccn1 729207852 JGOBLWYLCOIALY-UHFFFAOYSA-N 464.526 1.198 10 20 JDCD CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 914860542 YFCZFCJWWQWVFQ-ICSRJNTNSA-N 459.568 1.910 10 20 JDCD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917832857 ILSNSMORHCXSGQ-IBGZPJMESA-N 487.626 1.831 10 20 JDCD COCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918120625 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N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807994904 WDNYJJHXCHNYFB-JLMWRMLUSA-N 462.510 1.172 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468842 ZUZSGBKBEVHVNI-KSFYIVLOSA-N 473.493 1.623 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C23CC(F)(C2)C3)[C@@H]1c1cccnc1 1814184932 HBICUTNHRBKREG-XPHJMQOMSA-N 462.572 1.840 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@@H]1c1cccnc1 1814186035 KFWHDACMNOSCHI-WMQCIHAUSA-N 484.603 1.681 10 20 JDCD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)cn2[nH]cnc(=O)c12 1817846116 ITZDDPNNLUJZAO-HNNXBMFYSA-N 478.469 1.480 10 20 JDCD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)n1 1817856893 JUOVTUKAPCEINL-SNVBAGLBSA-N 486.466 1.801 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1C(=O)C=CC1=O)CC2 1828195021 HTFFIEOTCVFDPD-NHEDYWLLSA-N 498.517 1.200 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cscn1)CC2 1828240174 OSEQXIZXNXFYNH-QMMMGPOBSA-N 453.596 1.686 10 20 JDCD COc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)n1 1828240411 UUBPVADUPOHXGL-GFCCVEGCSA-N 491.620 1.562 10 20 JDCD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)nc1 1828242196 CRQIQSNBBQELLE-NSHDSACASA-N 461.594 1.933 10 20 JDCD CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCN2C(=O)OCc1ccccc1 1829037327 CAKYQMPGPOMHAY-DEOSSOPVSA-N 468.510 1.969 10 20 JDCD O=C(C[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1832340690 CIYHALKVRLQNOX-CPJSRVTESA-N 484.553 1.195 10 20 JDCD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)C(=O)c1ccccc1 1833412948 MXPAESJBKKKJQJ-UHFFFAOYSA-N 495.580 1.450 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1ccsc1)CCO2 1833970862 DJLMMBPKPRSTMQ-YSNSILARSA-N 460.508 1.648 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2 1834481983 UNNLMWSIQSOJRU-VWLXRYFESA-N 473.457 1.121 10 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CJBNKIMBTLKSKS-FQEVSTJZSA-N 483.308 1.578 10 20 JDCD COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c1 1839995430 NZKWCUBIKOMRRQ-ZFTMLNQLSA-N 469.494 1.285 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840257295 SDPUGBVCWFJMHK-NTKDMRAZSA-N 453.495 1.293 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1 1840881283 MCSSXZRQSXFCEG-BKHXXJDVSA-N 495.532 1.310 10 20 JDCD C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 15643210 OXNRUNFQMUYBQF-CHWSQXEVSA-N 470.503 1.235 10 20 JDCD O=C(COC(=O)CCc1nc(-c2ncccn2)no1)NCc1ccc(N2CCOCC2)c(F)c1 727901894 CAWWFTSFRGODTJ-UHFFFAOYSA-N 470.461 1.295 10 20 JDCD CNC(=O)CCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 729785595 ILCAZJFIAKEEEA-UHFFFAOYSA-N 458.490 1.432 10 20 JDCD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)N2CCN(c3ccc(OC)cc3)CC2)n(C)c1 760831912 BEVLGTDGGWYKOW-UHFFFAOYSA-N 492.598 1.570 10 20 JDCD CN(C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)[C@@H]1CCS(=O)(=O)C1 913638279 DNOLEGGTGBAOBL-CQSZACIVSA-N 469.497 1.360 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)Cn3c(Cl)nc4c3c(=O)n(C)c(=O)n4C)cc2F)C[C@@H](C)O1 917167474 KGFLLFLKDPTKED-BETUJISGSA-N 492.939 1.156 10 20 JDCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1C 917758328 PEYOGTUXGXSIJJ-UHFFFAOYSA-N 461.587 1.808 10 20 JDCD O=C1CN(c2ccc(NC(=O)C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)CCN1 918295230 OVKMJCLIDPDTOB-HXUWFJFHSA-N 452.511 1.475 10 20 JDCD CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1C 918463163 HROPUMGRSGYVPC-SFHVURJKSA-N 451.527 1.910 10 20 JDCD COc1cc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc(OC)c1OCC(N)=O 919840650 VDJFYMZADJRNQR-UHFFFAOYSA-N 463.512 1.055 10 20 JDCD O=C(CCn1cc([N+](=O)[O-])cn1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919855827 YUYJGRIHHUEAIV-UHFFFAOYSA-N 454.466 1.754 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 920188415 GOTAVRVIBRSSEC-UHFFFAOYSA-N 490.557 1.152 10 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1786802787 YLTWRZGPHYNGGF-UDIDDNNKSA-N 481.597 1.280 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3O)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787537491 YDWKRIBGODRTIS-BPXKWBHBSA-N 462.506 1.778 10 20 JDCD Cn1cc(F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1787747278 ZNEWYVJHYHGCAL-XERREHJYSA-N 467.501 1.550 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1ccc2nonc2c1 1787879754 ITQCWEDCPPENEF-ZJBJCVSYSA-N 488.504 1.609 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243588 ZOLXKPVGXUDDON-YLVFBTJISA-N 469.325 1.895 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccc([N+](=O)[O-])o1 1792358472 ALGPHCSBPHRJNB-HLOZSSFFSA-N 459.411 1.221 10 20 JDCD Nc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)sc2nccnc12 1796162097 BXAKFOVYZXCYPC-JGPRNRPPSA-N 476.609 1.386 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncoc3c1)C2)C1=NN(c2ccccc2)C(=O)C1 1796479553 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2 1840284963 RLZGAWITSILETD-LJQANCHMSA-N 470.860 1.067 10 20 JDCD O=C(/C=C/c1cccnc1)N1CCOC[C@]2(C1)CN(C(=O)/C=C/c1ccc(O)c(O)c1O)CCO2 1840879875 KFFZQLMGRAAVRR-IEHCZUIVSA-N 481.505 1.381 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)CCC3CCC3)C2)C1 1840879894 LKCSJXGZMPZURN-CCWPHWCFSA-N 460.527 1.853 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CNC(=O)O2)C1 1841648734 LGUXYMSVBOPPFR-MSOLQXFVSA-N 487.557 1.016 10 20 JDCD COc1ccc(F)c(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)c1OC 1845424585 QOMNOEFRIUANIM-UHFFFAOYSA-N 467.544 1.520 10 20 JDCD O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037604 UHJWHCRDBSPKDU-FBCAMTSGSA-N 475.501 1.930 10 20 JDCD O=C(c1cc2ccc(Cl)cc2nn1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054213 ITNZUVWAQLAQMG-UHFFFAOYSA-N 475.983 1.961 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847957617 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O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccoc34)C2)C1 1782450772 WXANZIFEWRUSOO-NRFANRHFSA-N 459.549 1.737 10 20 JDCD CCOC(=O)/C=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783220357 YRNHTIHJTRXPAS-DCDKRMLXSA-N 474.510 1.450 10 20 JDCD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)ccc(F)c1F 1785061287 UASNFUPANQGCNF-HXUWFJFHSA-N 469.535 1.577 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(F)c1 1785545228 KRJKPGYIKRINAP-HXUWFJFHSA-N 451.545 1.438 10 20 JDCD CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)n[nH]1 1787170678 LGFNLEGDDHQEOI-KDVIVCEYSA-N 456.499 1.396 10 20 JDCD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)c(C(F)(F)F)c1 1787711397 LZHCCRVFARGJDY-RBOXIYTFSA-N 468.432 1.757 10 20 JDCD C[C@@H](Cn1cccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792217862 SJUSYISKQOIUHO-NHFZJSPJSA-N 470.526 1.329 10 20 JDCD 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O=C(NC[C@@H]1CCN(C(=O)c2ccncn2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468150 OTSFQRGZKIATPD-MBSDFSHPSA-N 469.505 1.984 10 20 JDCD NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1812627565 NSVSEKSWPSPFSV-HXOBKFHXSA-N 462.510 1.146 10 20 JDCD Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2c2cccnc2)cn1 1813456728 FNCZDJZJNMUERT-NLFFAJNJSA-N 485.548 1.857 10 20 JDCD CN1CCN(CC(=O)N2CC[C@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)CC1 1814164116 RFNCYBYPXMIVQN-WYCJRWTJSA-N 495.580 1.165 10 20 JDCD NC(=O)c1ncccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1 1816074443 OJCAPAKJUBWDLQ-AWEZNQCLSA-N 451.443 1.330 10 20 JDCD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816726363 UNMVHTCFCIFOJY-ZYHUDNBSSA-N 455.500 1.466 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1 1818992909 GTRZTWRBBXTUCA-JTQLQIEISA-N 487.592 1.272 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cc2cccnn2n1 1820086122 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Cc1nccn1[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031910 ZYHSHZKLBWVQIK-OAHLLOKOSA-N 457.531 1.871 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3cncs3)C2)C1 1839431890 UFLJZQNRQKHDSF-LJQANCHMSA-N 453.904 1.592 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCO3)C2)C1 1839432647 VCEWVFFRRATDQN-DYESRHJHSA-N 454.907 1.390 10 20 JDCD CC(C)N(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840567217 HYRAQJMAMCWCHA-NRFANRHFSA-N 455.939 1.161 10 20 JDCD Cc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)/C=C/c2ccc(O)c(O)c2O)CCO3)n1 1840880089 VYDWBLMLXUUMMB-XYKNMGLJSA-N 495.532 1.690 10 20 JDCD Cc1cc(NC(=O)CC(=O)N2CCCC23CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)no1 1843400252 RKHWBXIOTHPRAG-UHFFFAOYSA-N 464.482 1.308 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)CN4CCCC4)CC3)cc2F)C[C@@H](C)O1 728715075 GJKUZWKYEWFFJX-KDURUIRLSA-N 461.582 1.889 10 20 JDCD CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1 751405295 KWDAEMIEVGCFGD-SFHVURJKSA-N 453.543 1.463 10 20 JDCD CN(C)C(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918284357 BOIAQSSELMJFOH-UHFFFAOYSA-N 458.490 1.384 10 20 JDCD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1-n1cnnn1 918287675 RFDPNYPIIFGCSE-HZPDHXFCSA-N 467.505 1.978 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)CNS(=O)(=O)c3ccc(Cl)cc3)nc12 918967942 MWYZDGZDGZVLBT-UHFFFAOYSA-N 468.875 1.287 10 20 JDCD Cc1cc(C(=O)OCC(=O)NCCCN(C(C)C)S(C)(=O)=O)c(C)n1-c1ccccn1 919076186 GPSAFADGYZZBAT-UHFFFAOYSA-N 450.561 1.822 10 20 JDCD C[C@H](NC(=O)C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(N2CCOCC2)cc1 920924831 GIFXXNKCZHGQDF-KRWDZBQOSA-N 472.567 1.879 10 20 JDCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)Nc1cccc(N2C(=O)CNC2=O)c1 920938900 CBIPGSULAKAFHT-UHFFFAOYSA-N 457.512 1.299 10 20 JDCD COCCN1C(=O)/C(=C\Nc2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)C(=O)NC1=S 920980030 SXVRSLWNLOGOPS-JXAWBTAJSA-N 480.612 1.825 10 20 JDCD CC(C)[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126834 KLNYRGVWFSJCKK-ZILOHOTNSA-N 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O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(Br)c(O)cc3F)C2)C1 1780206250 DVRXHSZGGDPROR-HXUWFJFHSA-N 496.289 1.857 10 20 JDCD CN[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)C1)C(=O)O 1781754293 YGFQYXJHRPBSOB-OFVILXPXSA-N 468.554 1.600 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1cc3cccnn3n1)CCO2 1782007260 NVMWEJJCTYNSIZ-OAQYLSRUSA-N 457.874 1.551 10 20 JDCD Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783222840 NTHSKMFYYJFFGG-WZKXNVEMSA-N 483.521 1.552 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccccc3n1)C2 1783248164 MZYMMODICFUGKP-WZONZLPQSA-N 499.618 1.618 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cnn3ncccc13)CCO2 1785508639 JHVWVQAMHOGHIU-FIYNHDKVSA-N 465.466 1.003 10 20 JDCD CN(C)c1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)o1 1785888736 VPEVOBQODOMYEI-RBOXIYTFSA-N 464.906 1.712 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cccc2nc[nH]c12 1787299802 NEGAVUYUYFGGOC-BEAZRHNASA-N 478.505 1.986 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787537228 GRSOXHMYPKSFCW-FNHZYXHNSA-N 482.928 1.516 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1cn2ccc(Cl)cc2n1 1788081874 JLOXEKHNAMHJOQ-NUTKFTJISA-N 471.901 1.701 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1cccc2nccn12 1790413757 VQSPJUWDBPOQBU-JLMWRMLUSA-N 486.532 1.721 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(N)=O)[C@H]3C2)cc1 1790852612 KFEBUEDYGURSFL-BVSLBCMMSA-N 452.555 1.953 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)[C@@H]1CCc2nc[nH]c2C1 1791532676 NOBBEHLFHOOPNT-VBNWAMRMSA-N 482.537 1.325 10 20 JDCD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2)C(=O)c1ccccc1 1793435576 YGJYMEAXPHBXLX-BJWYYQGGSA-N 474.608 1.257 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cc2[nH]ccc2s1 1797112832 IZHUVJZSKLDOGF-YQYWCBKUSA-N 464.594 1.293 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)c1ccc(Br)cn1 1804335852 MTLUJNKXKCAVOX-CLLJXQQHSA-N 483.413 1.956 10 20 JDCD CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1808232638 GDICCCKKBBIICR-SKDZVZGDSA-N 475.933 1.913 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468027 MYLRUEUUHFVPFQ-DWXLDPMZSA-N 461.522 1.651 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)c1ccn2nccc2c1 1810050881 BBADFBMWRCHELN-DYESRHJHSA-N 494.602 1.909 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810085121 PKPIRZYBOIKGJO-SPLOXXLWSA-N 459.466 1.793 10 20 JDCD O=C(Cc1cc[nH]n1)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1812415315 XQJPDKQAGZXFPT-HOYKHHGWSA-N 471.521 1.846 10 20 JDCD CS(=O)(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1813575173 OFCLSHVVEFFOPO-WZONZLPQSA-N 497.577 1.315 10 20 JDCD Cc1ocnc1C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189964 MGHVFBKXJQRDHU-KDOFPFPSSA-N 459.553 1.558 10 20 JDCD CNC(=S)NCCC(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817361773 GCAMOVNGXASAEP-ZDUSSCGKSA-N 499.622 1.332 10 20 JDCD Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)n[nH]2)cc1O 1818146073 RJNHNNNBNREUOW-SFHVURJKSA-N 476.497 1.948 10 20 JDCD CN[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1)C(=O)O 1818146686 XJCISKDWHBNVJM-QZTJIDSGSA-N 481.513 1.257 10 20 JDCD O=C1CC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)=NN1 1827716633 RWBNMWKMLMVWGX-FQEVSTJZSA-N 464.526 1.275 10 20 JDCD O=C(c1nc2ccccn2n1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902448 MEMXFUNHJAQLPT-MRXNPFEDSA-N 486.623 1.823 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)C1CCCC1 1834362062 UVRWVYIDFBBVJD-UHFFFAOYSA-N 452.646 1.609 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cccc2c[nH]nc12 1835008039 ZCPJLDKLCCLQAN-UHFFFAOYSA-N 464.526 1.868 10 20 JDCD O=C(c1ccc(C(F)(F)F)nc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417654 CJKCYHBXKKWWFL-FQEVSTJZSA-N 482.415 1.290 10 20 JDCD COC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)c1 1836419257 YXZIACDGNCLOCP-HSZRJFAPSA-N 486.481 1.055 10 20 JDCD O=C(Cc1c(F)cccc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836419275 ZHUBVNXZRUPZJA-JOCHJYFZSA-N 463.437 1.084 10 20 JDCD CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1837597924 NTVWKUHGVCJWHD-KOSHJBKYSA-N 472.542 1.049 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H]4CNC(=O)C4)C3)C2)cc1 1839348356 PNCLZQIKVCSQLD-LVXARBLLSA-N 480.565 1.300 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1839433765 SYJLUHSRRMJBLV-JOCHJYFZSA-N 476.917 1.278 10 20 JDCD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1)n1cccc1C=O 1840880481 RBMSQIZLLRXSQW-HQICJHAESA-N 499.520 1.148 10 20 JDCD O=C(CCC1CCCC1)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840895696 HQLZGYKRMOORMZ-OAQYLSRUSA-N 469.629 1.274 10 20 JDCD O=C(CCN1CCCC1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840940317 BFXVVBPFTXNBRC-JOCHJYFZSA-N 467.950 1.307 10 20 JDCD CC[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843330572 GXNCNWLQLGGXRK-MOPGFXCFSA-N 460.575 1.679 10 20 JDCD CC(=O)N/C(C)=C/C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843331303 HMCMUUYJDHMQDB-RYEVTAHJSA-N 499.612 1.948 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)C1 1843903734 CHFHBHCKHYXWAM-CQSZACIVSA-N 482.628 1.307 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncn(-c2cccc(F)c2)n1 1848310488 WBBHNRNKBGEWCS-GJZGRUSLSA-N 474.543 1.082 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 23474378 RIENVOYPHAXIOL-UHFFFAOYSA-N 470.482 1.615 10 20 JDCD O=C1CCc2cc(Cl)c(S(=O)(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc2N1 726976338 JZMVRYHMPPODTF-UHFFFAOYSA-N 483.999 1.938 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3cccc(CS(C)(=O)=O)c3)CC2)cc1 746996749 PDABCKRBDLVPGT-UHFFFAOYSA-N 474.583 1.117 10 20 JDCD CC(=O)NC1CCN(CC(=O)NCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)CC1 747836864 RYCPGDPTNQVEML-YBFXNURJSA-N 490.607 1.333 10 20 JDCD COC(=O)[C@H](F)/C(NCc1ccc(N(C)C)cc1)=C1\C(=O)NC(=S)N(CC(C)C)C1=O 814334827 DJZGEONIMIFGRN-CFBLSMTOSA-N 450.536 1.507 10 20 JDCD CN(C)c1ccc(CN(C(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C2CC2)cc1 914439604 KXYRFQYMKTYCFC-UHFFFAOYSA-N 458.584 1.924 10 20 JDCD NC(=O)CCn1c(SCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nnc1C1CC1 917207208 PMWVWZFAWIOUSO-UHFFFAOYSA-N 462.551 1.415 10 20 JDCD CCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1C 917757983 FJQGIPKUCATVQN-UHFFFAOYSA-N 473.598 1.998 10 20 JDCD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917837544 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464.526 1.640 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1)c1cc(O)nc(O)c1 1834987714 XOKXXDAPXYHOBU-OAQYLSRUSA-N 466.538 1.682 10 20 JDCD O=C(Cc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1835003869 PIQSVLHHXAEEGD-AREMUKBSSA-N 494.523 1.618 10 20 JDCD Cc1ocnc1C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132750 KCTRJMDNTNICIZ-UHFFFAOYSA-N 478.553 1.961 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3Cl)C2)C1 1836417547 ZZCNEEPYCDXJCG-JOCHJYFZSA-N 487.900 1.358 10 20 JDCD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)c(F)c1 1836419394 GCVFGODHEYABAQ-JURIHQFCSA-N 487.484 1.424 10 20 JDCD COC(=O)[C@H]1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1843442391 MFYSLQIJFFUTFX-MSOLQXFVSA-N 466.538 1.962 10 20 JDCD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1846257534 ZQPGRJHHHZCQTR-UHFFFAOYSA-N 486.949 1.264 10 20 JDCD COC(=O)Nc1cccc(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)c1 1847054806 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486.619 1.930 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21 1788622181 RRFKXWBGXIMWKI-XTEGMBIUSA-N 467.547 1.974 10 20 JDCD COc1cccc(OC)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792239741 JDPGVLLRFKMVMT-ZQIUZPCESA-N 493.607 1.157 10 20 JDCD COc1cccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN4C(=O)CSC4=S)[C@H]3C2)c1 1792242205 UTXAMZSVTFPIOZ-VYPWOACLSA-N 489.619 1.548 10 20 JDCD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770410 VMYWQOINAYJIBJ-SPCJURDBSA-N 478.929 1.710 10 20 JDCD Cc1cnn([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)c1 1801346186 YEPLLJXBNDGWDS-AZTQCIJFSA-N 456.499 1.172 10 20 JDCD Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)c1=O 1803837258 GRORTIKUVJNFRK-AVUHJFIJSA-N 490.516 1.930 10 20 JDCD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)cn1 1806051906 VJQQFUNDSHQXGX-AUUYWEPGSA-N 486.579 1.060 10 20 JDCD CC(C)NCCC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1807330854 YXPWKTCKCUBPLR-OXQOHEQNSA-N 463.629 1.336 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808464049 HVQLUJLOFLJQKL-SBUREZEXSA-N 485.504 1.690 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@H]2CC2(F)F)[C@@H]1c1cccnc1 1814189758 XWIICWBEKRIOOH-WOSRLPQWSA-N 454.524 1.603 10 20 JDCD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)nn1C 1820973228 PUQBRJLYAAFUBG-SNVBAGLBSA-N 478.625 1.525 10 20 JDCD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823500029 KPLZTMHLOCBRIR-JSGCOSHPSA-N 480.616 1.567 10 20 JDCD Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828239883 JWVYEUDDOWQAFQ-LLVKDONJSA-N 479.609 1.763 10 20 JDCD CN1CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)CC1 1830009320 HKZIWJVPJKMMNK-YQVIQHHGSA-N 489.569 1.005 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832152711 IEBFVLHDBULJHO-AWEZNQCLSA-N 482.657 1.377 10 20 JDCD O=C(CCc1ccco1)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1833048073 KBGLRFZJCCRFBZ-RUZDIDTESA-N 480.521 1.462 10 20 JDCD CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1833289994 JRODJVFCWWPJBX-NKOINVLESA-N 475.586 1.795 10 20 JDCD CCc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988145 PPYXMTDPSITQIL-UHFFFAOYSA-N 453.543 1.949 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cnn2ncccc12 1835038229 DIVDEIMCKHWIFB-UHFFFAOYSA-N 465.514 1.035 10 20 JDCD Cc1noc(N)c1C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132736 IUYUHGWBVMLZMI-UHFFFAOYSA-N 493.568 1.543 10 20 JDCD CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1 1835609963 FGFBVMFSTAOPDQ-KPPJJKTOSA-N 483.521 1.629 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cc(-c2ccncc2)[nH]n1 1835943656 CXJPBIXSCDIKKT-UHFFFAOYSA-N 491.552 1.777 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836387724 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Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 918337648 DKSKLIVTPKFPQN-UHFFFAOYSA-N 479.624 1.523 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)NC(=O)Nc2ccc3c(c2)OCCCO3)c1 920636876 OWQGDCTYNHIGBK-UHFFFAOYSA-N 479.467 1.430 10 20 JDCD O=C(COC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCS(=O)(=O)C1 1321579516 VAUNOAFIGZEVIQ-CJAAZZPWSA-N 488.634 1.576 10 20 JDCD Cc1noc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C3=NN(c4ccccc4)C(=O)C3)C2)n1 1778127793 MPHQVLNQJAFUFU-NTKDMRAZSA-N 480.525 1.227 10 20 JDCD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)c1 1780063345 BQESKVCGLOUAGZ-NTKDMRAZSA-N 499.524 1.908 10 20 JDCD Cc1cnn([C@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN2C(=O)CSC2=S)C3)c1 1782517303 HZLBKVSNMWQPRL-WHSLLNHNSA-N 479.628 1.127 10 20 JDCD Cc1noc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1785977049 LJUVOUPTGKYELJ-QRFRQXIXSA-N 465.510 1.678 10 20 JDCD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)n1cccc1C=O 1786994184 REPGTPLFMWNMFR-CFFRYYMNSA-N 491.548 1.634 10 20 JDCD C[C@H](C(=O)Nc1ccc(C2(NC(=O)CN3C(=O)CSC3=S)CCC2)cc1)n1cncn1 1791860450 FPTAAUBESNGDGK-CYBMUJFWSA-N 458.569 1.834 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21 1792218533 KJIJZJGBXJDFGW-SBZMUANBSA-N 459.543 1.282 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21 1792219351 RYGFAWMVTODDFW-PFAFGPMFSA-N 483.521 1.977 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2)C1=NN(c2ccccc2)C(=O)C1 1796480713 GHRJADJXIVZIPO-RSQQPWMTSA-N 490.495 1.470 10 20 JDCD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c1C 1796482542 GXKSITDOCWTUFW-MRSFGVLCSA-N 476.533 2.000 10 20 JDCD CC(C)(C)OC(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767140 SNUXWYVCDJUTFT-IVWMJMPLSA-N 454.907 1.686 10 20 JDCD 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1818146345 CFVFPPUNHJYGAK-NRFANRHFSA-N 493.568 1.917 10 20 JDCD CC(=O)O[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1)C(C)C 1823499868 CCRLPURVRXCEEX-KSSFIOAISA-N 481.600 1.850 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1 1825713847 AWAIBZJNDAYBRF-HNNXBMFYSA-N 463.585 1.276 10 20 JDCD O=C1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)N1 1826664241 PQKJSFPIPLBCAR-LUUOPXGJSA-N 457.527 1.715 10 20 JDCD C[C@@]1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CN2C(=O)CSC2=S)CC3)CC1(F)F 1828057029 PEJVXXONHVTDKO-PWJLMRLQSA-N 460.553 1.961 10 20 JDCD C[C@@]1(C(=O)N[C@@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)CC1(F)F 1828248994 CJZVTAONGVCPBB-BCTVWOGZSA-N 460.553 1.961 10 20 JDCD C[C@H](NC(=O)c1ccccc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1828261907 DXAFWSJGDQKLBV-WFASDCNBSA-N 481.534 1.994 10 20 JDCD C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CCCN1 1830274599 VFHANCGPMRKCPH-IIBYNOLFSA-N 452.646 1.609 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)o1 1831792128 RZDMAPASXVJIIL-DEOSSOPVSA-N 466.494 1.451 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832364934 PKKHMLGEZYDBEK-HSZRJFAPSA-N 471.485 1.434 10 20 JDCD CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)n[nH]1 1834069398 RTEQDECXICLBIV-HWKANZROSA-N 497.552 1.628 10 20 JDCD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)C1 1834985407 CZISWFQJNZAJRT-JKSUJKDBSA-N 474.558 1.267 10 20 JDCD CCN(C)[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835133867 GTGYCGARMIVGMX-IBGZPJMESA-N 482.629 1.691 10 20 JDCD Cc1nc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1838264781 AMSICMKPZMMJJB-RUZDIDTESA-N 495.511 1.392 10 20 JDCD O=C(CCN1CCCC1)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1838825226 XCPYXQAWXIOIGR-UHFFFAOYSA-N 482.672 1.331 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3nccs3)C2)C1 1839431824 OOABDBYPVLMMAL-LJQANCHMSA-N 453.904 1.592 10 20 JDCD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1cccc1 1839433562 XUAJHAIPAPRARX-IVZQSRNASA-N 463.918 1.884 10 20 JDCD Cc1n[nH]cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433954 ZDFPIIPVQKJJNL-FQEVSTJZSA-N 450.879 1.167 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c[nH]1)CCO2 1840069249 WJLUKFQSBCBLMI-YSNSILARSA-N 461.446 1.054 10 20 JDCD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)ccc1F 1840897346 XYMKMPTZCZUVLI-NRFANRHFSA-N 481.571 1.064 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC2(CCCN2C(=O)c2c(O)cc(O)cc2O)C1 1845420840 BXFVYRKTDFFVHV-UHFFFAOYSA-N 450.451 1.413 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1 1845837647 YZYWJYWQEDAAPF-ITBZMZTRSA-N 493.560 1.655 10 20 JDCD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)N1CSCSC1 1847055299 BZVNWDGVBSEYJG-GFCCVEGCSA-N 460.672 1.093 10 20 JDCD COc1ccc(NC(=O)C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1-n1nnnc1C 726719819 KXOHHPSCMBOBMQ-UHFFFAOYSA-N 465.514 1.413 10 20 JDCD CCOC(=O)c1c(S(=O)(=O)Nc2nc(-c3cccc(-n4cnnn4)c3)cs2)n[nH]c1C 727251520 VOBQNLLWQAKJNG-UHFFFAOYSA-N 460.501 1.795 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)[C@@H]3CCN(c4ccc5c(c4)OCCO5)C3=O)CC2)cc1 730538015 NBRSILWXLKOKSO-QFIPXVFZSA-N 480.565 1.758 10 20 JDCD Cc1cc2[nH]c(=O)c(C(=O)OCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)cn2n1 750214009 WHZIHFOWWOYMRD-UHFFFAOYSA-N 456.414 1.902 10 20 JDCD CCN(CC)S(=O)(=O)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918220442 YBDQXECZYPEDLU-UHFFFAOYSA-N 471.599 1.201 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)C(=O)Nc3ccc(OCC(N)=O)cc3)cc2F)C[C@@H](C)O1 918288002 SCDCLWBOMBDJDB-GASCZTMLSA-N 458.490 1.558 10 20 JDCD Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 918373780 BKMGDIIEUPWNNO-HXUWFJFHSA-N 472.611 1.990 10 20 JDCD C[C@H]1CN(S(=O)(=O)c2ccc(NC(=O)C(=O)N(C)Cc3ccccc3O)cc2)C[C@H](C)O1 918444630 XCCSFRNLLANLRG-HOTGVXAUSA-N 461.540 1.787 10 20 JDCD Cc1c(NC(=O)c2cccc(NC=C3C(=O)NC(=S)NC3=O)c2)c(=O)n(-c2ccccc2)n1C 920976100 GJEUCHSDNOATSO-UHFFFAOYSA-N 476.518 1.563 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1 1777824983 LPIPGWAABVQTGL-SXBBHYFQSA-N 464.478 1.608 10 20 JDCD C[C@H](CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)OC(C)(C)C 1778047651 JHJAPHPEXYPYSQ-PNIPZHNDSA-N 492.573 1.924 10 20 JDCD Cn1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c1 1778126541 ZNONVJKLQURITI-HYBUGGRVSA-N 464.526 1.341 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2)C1=NN(c2ccccc2)C(=O)C1 1778127351 JRKZJITYLJIBMU-MLUDIAJTSA-N 488.548 1.797 10 20 JDCD O=C1Nc2ccccc2/C1=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1778903287 BGLVUZSAWUAHOP-DQJUTICRSA-N 499.527 1.645 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc2ncsc2[nH]1 1779569284 CMFYOLZJZXIFHC-QVKFZJNVSA-N 457.512 1.872 10 20 JDCD CN(C)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)cn1 1779762782 ATWVFMFQBFPNNS-JOCHJYFZSA-N 460.918 1.970 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1782709927 SOWOPAXGJKSEBW-QFSWUKKWSA-N 464.471 1.208 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cn3ccsc3n1)CCO2 1785505051 ABLXBHNIPVRFHU-WYAMSBGYSA-N 470.507 1.670 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3nc(CO)[nH]c3c1)CCO2 1785505837 QVOAVRDXYFMJQR-JARBLVMWSA-N 494.504 1.329 10 20 JDCD Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cn1 1785509258 XCJZYSJSDJWEGT-UPXASZCJSA-N 467.522 1.983 10 20 JDCD COc1c(Cl)cccc1C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547116 XHERALPQHSZYSL-FQEVSTJZSA-N 483.999 1.652 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)[C@@H]1CCCSC1 1792198301 WIGSMCAPJJELFX-NZGUISNBSA-N 470.595 1.902 10 20 JDCD COc1ccc([C@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)cc1 1792218758 CGGTZLUVZAPPLI-LMGJCQAISA-N 498.532 1.539 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccccn4n3)C[C@@H]21 1792219386 TYACDKROFLWSPM-DTLNNLRTSA-N 478.505 1.758 10 20 JDCD C[C@@](O)(CC(=O)O)CC(=O)NC1(c2ccc(NC(=O)CN3C(=O)CSC3=S)cc2)CCC1 1792315798 CPKNYMNYHJUEBX-FQEVSTJZSA-N 479.580 1.597 10 20 JDCD COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)c(F)c1 1794452996 GDCPALVLQDCLDL-USGNIVHTSA-N 481.484 1.225 10 20 JDCD CCNC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798383753 MNOYPPNCIUDDOB-XYVMCAHJSA-N 454.531 1.125 10 20 JDCD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)C3)nn1C 1799490908 LMMUQWXJSYPGPB-ACHSLPGTSA-N 450.499 1.473 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1Cl)C2 1802107007 HBTDJBIIFVWDDS-YQYWCBKUSA-N 471.963 1.543 10 20 JDCD CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1803519196 VJKGXDHOBOOPKT-VACSHPSYSA-N 489.550 1.352 10 20 JDCD C[C@H](CC(N)=O)C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1803674670 RUCZBSSXXDDAGE-TXSBPDEYSA-N 468.510 1.429 10 20 JDCD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2c2cccnc2)cc1O 1804897601 IYZNSMCFZJXZBD-NLLJUKRZSA-N 479.493 1.671 10 20 JDCD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)nc1 1807991641 QRBASJRCBFBCRD-VFNWGFHPSA-N 497.533 1.320 10 20 JDCD C[C@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808465120 QMJNMSSWAQADBL-JTUHZDRVSA-N 476.537 1.392 10 20 JDCD C[C@H](CC(N)=O)C(=O)N1CC[C@@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1808465123 QMJNMSSWAQADBL-WLENULPWSA-N 476.537 1.392 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465231 RTHDHDDEMITXFL-NLFFAJNJSA-N 483.532 1.913 10 20 JDCD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c2c1CCC2 1809371140 SWULAZYQEQVSTQ-BTYIYWSLSA-N 498.634 1.484 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@@H]1[C@@H]2C=CS[C@@H]12 1812387227 KETJFTIYHJLVEH-YFYRFGBOSA-N 474.633 1.823 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1 1814162587 MQXJZSKQJNVEHX-OUFAJUJOSA-N 466.494 1.196 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1814188867 CCJQEIHQAZCKQS-YWZLYKJASA-N 495.590 1.304 10 20 JDCD COCC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)CC1 1832896808 QNNJRHYCSDISMV-INIZCTEOSA-N 453.630 1.893 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@@H]1CCc2ccccc2[C@@H]1O 1833332151 MHBSBMMYPAKABU-RDGATRHJSA-N 494.592 1.974 10 20 JDCD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1833437090 YIFZZALWYJSZMF-JOCHJYFZSA-N 492.916 1.324 10 20 JDCD Cc1nccn1[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433197 PADFETDSAFRAJF-JLCFBVMHSA-N 478.933 1.587 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1839433355 SEEWAGPYJCOEFE-HYBUGGRVSA-N 490.940 1.425 10 20 JDCD O=C(c1ccn2cncc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433696 QGLVIGHTORXJSH-HSZRJFAPSA-N 486.912 1.783 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2 1839961294 SNISZLXJJNRGMO-YKSBVNFPSA-N 490.940 1.425 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCn4ccnn4)CCO3)C2)cc1 1840448250 XVUULWXDAVGJGE-AREMUKBSSA-N 492.580 1.846 10 20 JDCD CC(C)(C)OC(=O)NCCC(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442912 CHSYUBJSKYGVBJ-UHFFFAOYSA-N 469.542 1.898 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)CCc2noc(-c3ccccc3)n2)C1 1844999122 IXAWZEZVOGXVLZ-UHFFFAOYSA-N 485.591 1.733 10 20 JDCD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cc(O)nc(O)c3)O2)C1 1847287720 RUFFXPKHTVXISP-ULQDDVLXSA-N 488.541 1.477 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847957619 HQZWVGCIELPJAZ-MELADBBJSA-N 468.601 1.058 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 109213035 KXZJBRVPCXMRIG-UHFFFAOYSA-N 450.586 1.519 10 20 JDCD COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)n(C)c3=O)c2C)cc1 915394907 RTNMUPCRVSGFEI-UHFFFAOYSA-N 453.451 1.167 10 20 JDCD O=C(CN1CCN(CC(=O)Nc2ccc(F)cc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 917032443 XWEXRUHTDNLVEO-UHFFFAOYSA-N 487.551 1.674 10 20 JDCD O=C(NCc1ccc(N2CCSCC2)cc1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 917386107 OYBJVGBJGKLWSQ-QGZVFWFLSA-N 450.586 1.022 10 20 JDCD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1 917514885 KXBSBZBTXVMZBM-UHFFFAOYSA-N 462.553 1.994 10 20 JDCD CCOCCCNC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)CC1 918118352 ZJLXLWNVXRQAFC-OAQYLSRUSA-N 473.618 1.853 10 20 JDCD CC(C)NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442504 NDLJLMWARLYGBC-UHFFFAOYSA-N 488.610 1.837 10 20 JDCD COc1ccccc1CC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783333120 YFFYKXQDVROGKK-CFSVISAESA-N 468.506 1.898 10 20 JDCD COC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)CCO3)CCC1 1784865980 CQYFKENCILITKK-DEOSSOPVSA-N 454.527 1.568 10 20 JDCD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc(C)c1O 1784997485 JIEKOAJYSHNOLC-NRFANRHFSA-N 463.581 1.313 10 20 JDCD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)C(=O)c1ccccc1 1785503259 GAMHKKSACLCKSF-QTOANSKZSA-N 495.532 1.419 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1[nH]cnc1-c1cccnc1)CCO2 1785506646 CDEPEICAMDFXOB-SKFGKQHZSA-N 491.504 1.745 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4[nH]3)C[C@@H]21 1792219444 VXJJKCFILIITCI-QEEYCIGUSA-N 478.505 1.986 10 20 JDCD Cn1cccc(C(=O)NC2(c3ccc(NC(=O)CN4C(=O)CSC4=S)cc3)CCC2)c1=O 1792314796 YBNKAISZCPJJAZ-UHFFFAOYSA-N 470.576 1.993 10 20 JDCD COc1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN2C(=O)CSC2=S)C3)c(F)c1 1794782734 YXBMMDGWVAHORS-ZSBIGDGJSA-N 452.533 1.341 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc2c(c1)OCO2 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COc1ccc(CN2C[C@@H](C(=O)OCC(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 726679154 HFUKUTLODJKLFB-FQEVSTJZSA-N 481.549 1.944 10 20 JDCD O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)NCc1ccc(N2CCOCC2)c(F)c1 916986406 UPECFDYBLAVFSK-UHFFFAOYSA-N 476.574 1.285 10 20 JDCD COc1cc(CNCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)ccc1OCC(=O)N1CCOCC1 917397640 WRWPONUJKZULJS-JOCHJYFZSA-N 496.608 1.924 10 20 JDCD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)OCC(=O)NCc1ccc(N3CCOCC3)c(F)c1)C2=O 918902319 NFAJNXVXNZRLPO-MRXNPFEDSA-N 483.496 1.815 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 918958521 RMZIQFDZJXOZOG-GASCZTMLSA-N 479.530 1.560 10 20 JDCD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccc(-n2cnnn2)cc1 919761870 QMFKRCVGXGZJOK-UHFFFAOYSA-N 459.489 1.848 10 20 JDCD CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O 920980150 ZDVNNCGHELBTFT-VBKFSLOCSA-N 496.611 1.301 10 20 JDCD COc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1317920598 FDFBNRZQJWFWLI-GOSISDBHSA-N 459.568 1.877 10 20 JDCD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777849109 MCLXJXGZTLXYKA-VOIUYBSRSA-N 492.573 1.924 10 20 JDCD COC[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126711 JZADYJGOGJDUSA-WSCWJOSJSA-N 456.543 1.576 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](O)N4CCOCC4)C3)C2)cc1 1779094334 BUMXJTUKPMDYFL-AZGAKELHSA-N 482.581 1.188 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H](O)CC2)C1 1782323024 RWDSXXWWJLCBKL-FLDNMOITSA-N 482.581 1.844 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2 1783218110 AVURJIIRNPDDMR-OFAFLBDBSA-N 468.510 1.363 10 20 JDCD Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C[C@@H]32)nn1C 1784240269 LOJIZYNEUKAJPW-XJABCFGWSA-N 478.553 1.044 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccccn3)[nH]n1)CCO2 1785506655 CLXCUHLJXOVSLL-NHDFZSDJSA-N 491.504 1.745 10 20 JDCD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c(C)n1C 1785506943 GQZZXTOZCQJCQN-SXBBHYFQSA-N 455.511 1.916 10 20 JDCD CC(C)c1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)no1 1785508296 AOIOOBOAXAIUPH-FIYNHDKVSA-N 472.498 1.396 10 20 JDCD COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1785508948 OITAUNQGYZSZNH-QLUGYHCRSA-N 483.521 1.683 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1785537736 IZNCIPBCWKZRSA-GOSISDBHSA-N 488.513 1.404 10 20 JDCD Cc1ncc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)s1 1787541353 HODNDPYSPOFANZ-LRQRDZAKSA-N 481.578 1.767 10 20 JDCD Cc1cc(C)n(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)c(O)c(Cl)c4)[C@H]3C2)n1 1790242907 BQDSVBNGOFBSEY-QOKNQOGYSA-N 462.934 1.858 10 20 JDCD CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1790604062 APZXXVUFGBWHOK-VYSMABKCSA-N 475.586 1.774 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21 1792219123 KRCXKSMGUURQEZ-NHXJEQGQSA-N 479.493 1.153 10 20 JDCD CO[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1ccccc1 1795169909 VAWIHVALGJDWLB-RKGYPADOSA-N 476.533 1.757 10 20 JDCD Cc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)s1 1796479645 MWSGQHGHKZYSAA-YVWYUNDQSA-N 453.524 1.448 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2)C1=NN(c2ccccc2)C(=O)C1 1796481209 UZRVFZUATHNAEO-GPVSGQMNSA-N 472.505 1.330 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1F)C2)C1=NN(c2ccccc2)C(=O)C1 1796481327 QKFDUQPLRGHNTN-MRSFGVLCSA-N 464.497 1.751 10 20 JDCD Cc1cnn([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c1 1796482697 PRRGZPGABGQTOT-AYMMHLMVSA-N 464.526 1.135 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)c1 1800504936 GTELIAKPVKTAIQ-GGPHIMKMSA-N 488.635 1.635 10 20 JDCD O=C(CN1CCOCC1)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1 1806907210 QDBARVPVGCHPBY-CPJSRVTESA-N 490.564 1.213 10 20 JDCD CN[C@@H](CC(=O)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1)C(=O)O 1809830824 DHIJKJYIMFJRTM-IBGZPJMESA-N 469.542 1.073 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811806799 SQBZJNIQXOHLHX-YMFLFHJQSA-N 460.918 1.189 10 20 JDCD O=C(CCn1ccnn1)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1813429129 AJNTVDMHWPSNIK-YADARESESA-N 486.536 1.562 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)C[C@H]2CCCCO2)[C@@H]1c1cccnc1 1814185149 LJFBCRUDYONCBQ-CSODHUTKSA-N 476.624 1.907 10 20 JDCD O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cc(O)nc(O)c3)CC4)nc2N1 1816663911 BYQQBJLLUJIVIG-LBPRGKRZSA-N 480.506 1.769 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1)c1cc(O)nc(O)c1 1816944398 XNTQDAOCMMOXOT-NSHDSACASA-N 451.468 1.532 10 20 JDCD CCN(C)[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1821628688 AUARXXGWOSRWNN-JSGCOSHPSA-N 452.606 1.602 10 20 JDCD NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1821951637 GQDGQMNLYPXOJS-KRWDZBQOSA-N 451.487 1.460 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1 1823499356 ARFLSALHZDKHSU-HNNXBMFYSA-N 484.567 1.847 10 20 JDCD Cn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828195563 QUUOPZQEWBFDON-QDBLGGKGSA-N 455.496 1.933 10 20 JDCD Cc1n[nH]c(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828244321 BCLIOMJZLXHVPK-SNVBAGLBSA-N 464.598 1.569 10 20 JDCD O=C(c1cc2n(n1)CCCO2)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832902054 ILCNLKNVSUWKFC-KRWDZBQOSA-N 491.639 1.759 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cccc4c3OCCO4)CC2)CC1)c1cc(O)nc(O)c1 1834987060 BYYZSFDXBKWALS-UHFFFAOYSA-N 482.537 1.763 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cccc2nc[nH]c12 1834990407 LOUUBVTYRDQPSO-UHFFFAOYSA-N 464.526 1.868 10 20 JDCD 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488.428 1.338 10 20 JDCD CO[C@H](C)C(=O)OCC(=O)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 919595440 OFVIWGFRSWFXKG-SHLUWWQESA-N 452.510 1.311 10 20 JDCD Cn1ncc2c(O)nc(CCC(=O)NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)nc21 919762222 ZQPFPUSJFDWHBL-UHFFFAOYSA-N 491.531 1.574 10 20 JDCD CN1CCN(c2ccc(CNCCNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2F)CC1 1116019240 UWPJDDKECMOQHG-UHFFFAOYSA-N 451.524 1.554 10 20 JDCD O=C1CCCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)CN5C(=O)CSC5=S)CCO4)C3)ccc21 1777927512 IZHYCCRSKFBJRQ-HSZRJFAPSA-N 487.603 1.509 10 20 JDCD Cc1cnc2c(C(=O)N3CC[C@]4(CN(C(=O)/C=C/c5ccc(O)c(O)c5O)CCO4)C3)cnn2c1 1778527559 YCWWJAKHINEHRC-JURIHQFCSA-N 479.493 1.311 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc2nccn2c1 1778700897 GTUOLVCVJFELCU-UZUQRXQVSA-N 451.483 1.582 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]cc1[N+](=O)[O-])CCO2 1782007167 LGBBYGRSBDUEQM-GOSISDBHSA-N 451.823 1.140 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1ccn3ccnc3c1)CCO2 1785505531 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10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cnc[nH]2)[C@@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808465124 QREPAEXWUJGIPN-HTAPYJJXSA-N 457.494 1.917 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2cn3ccccc3n2)[C@H]1c1cccnc1 1814189602 UATIIZJMPORKFO-IERDGZPVSA-N 494.602 1.909 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1 1814190051 PVKZHVPFAWQDJB-HAJKQMQPSA-N 474.608 1.515 10 20 JDCD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190935 DYTGKCUHOKZVJP-ZWOKBUDYSA-N 491.639 1.253 10 20 JDCD CN(C)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816721824 PZEZHQKMBMVGLF-LBPRGKRZSA-N 454.512 1.950 10 20 JDCD Cc1nn[nH]c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146548 OVXQNNCHFKGVFP-QGZVFWFLSA-N 461.486 1.935 10 20 JDCD O=C(CN1C(=O)C=CC1=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)[nH]n1 1822528176 FEQLHAAEJAZIKO-SFHVURJKSA-N 489.492 1.120 10 20 JDCD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1)n1cccn1 1823500504 BSNCCRPMTPPRTM-GXTWGEPZSA-N 461.573 1.720 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)CCCn2ccnc2)[nH]n1 1823500977 LDPUDELGINZDJH-OAHLLOKOSA-N 475.600 1.939 10 20 JDCD CS(=O)(=O)c1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)c1 1827426885 MAXCKQCDZPYLGD-IBGZPJMESA-N 488.566 1.838 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428042 YBJPAQSKGYBQHD-VQTJNVASSA-N 453.543 1.691 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3cccnc3n1)CC2 1828244360 CTVDMMWKNVZUGB-JTQLQIEISA-N 487.592 1.272 10 20 JDCD COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828244480 IVQRDUZRQUSZFD-SECBINFHSA-N 481.581 1.364 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3cncn3c1)CC2 1828244492 JHCDMZMLRPSODE-LBPRGKRZSA-N 486.604 1.877 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccc4n3)CC2)CC1)c1cc(O)nc(O)c1 1834987732 YHQXJZWCQPMEQJ-UHFFFAOYSA-N 476.537 1.935 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)C1 1836526848 OMDZFQWDFFBXMJ-HSZRJFAPSA-N 497.464 1.051 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)CC1 1838729680 SNSUKDWXJUHPLW-ATZDWAIDSA-N 481.665 1.720 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840364707 NDSFVYLWLJVFMC-QKFKETGDSA-N 490.944 1.349 10 20 JDCD CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1842240857 GSNJNJRHQMJQGI-UHFFFAOYSA-N 495.561 1.236 10 20 JDCD O=C1NCc2cc(C(=O)N3CC4(CCCN4C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)ccc21 1843441634 JTDHNNNFFXBHFM-UHFFFAOYSA-N 457.490 1.540 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCO1)C2 1844251745 UPKOSXHWKSNSMX-YLJYHZDGSA-N 489.569 1.916 10 20 JDCD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1844287331 POHHXAVNGKFFRR-MRXNPFEDSA-N 454.863 1.063 10 20 JDCD COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1-n1nnnc1C 726723191 ODTMDEXGDDACOM-OAHLLOKOSA-N 465.514 1.632 10 20 JDCD CS(=O)(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3ccc(-n4cnnn4)cc3)n2)cc1 727244935 NRFMVXSVXFAUJS-UHFFFAOYSA-N 477.553 1.958 10 20 JDCD COC(=O)c1cc(-c2csc(NS(=O)(=O)c3ccc(S(=O)(=O)N(C)C)cc3)n2)c[nH]1 727247816 OPFLUSJVLOUTML-UHFFFAOYSA-N 470.554 1.976 10 20 JDCD O=C(CN1CCSCC1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S 728913131 CHORKUVRIIASSQ-YBEGLDIGSA-N 451.595 1.782 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)Cn3nnc(-c4ccc(C(N)=O)cc4)n3)cc2F)C[C@@H](C)O1 917204841 NNGGBMFLTFNYRH-HUUCEWRRSA-N 467.505 1.508 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(CC(=O)Nc4ccc(F)cc4)CC3)cc2)C1 918118903 VXQRKYBWNWCEDQ-FQEVSTJZSA-N 496.587 1.993 10 20 JDCD COC(=O)CNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 918442534 OQJCPSVJAILTNM-UHFFFAOYSA-N 482.537 1.053 10 20 JDCD O=C(COC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)NCc1ccc(N2CCOCC2)c(F)c1 918997413 JONDVUDUGJPTRF-UHFFFAOYSA-N 475.429 1.815 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cc2ccccn2n1 1778481025 IZLHDPKEPDKELV-WZONZLPQSA-N 451.483 1.582 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2)c1cccc(F)c1 1780357362 XMEKPKSXRDYPBM-IIBYNOLFSA-N 465.572 1.814 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1ccco1)C2)c1cc(O)c(O)c(Cl)c1 1781122705 CNQPPWHRHMAINV-WZONZLPQSA-N 491.928 1.902 10 20 JDCD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1781237125 CRUHQIAZJKKQIC-HSZRJFAPSA-N 454.483 1.192 10 20 JDCD C[C@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1782538099 NYAQEVDZRGNNTF-XSSDXNQZSA-N 456.499 1.483 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2 1783220210 UPJIPXVFKVINLB-OFAFLBDBSA-N 470.478 1.598 10 20 JDCD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CCO2)C1)n1cccn1 1784516293 LYNHXHMWOMDDAK-UZUQRXQVSA-N 450.499 1.067 10 20 JDCD O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 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10 20 JDCD Cc1n[nH]cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21 1789313929 HQIGNJSPVCEPHC-QSFXBCCZSA-N 450.499 1.104 10 20 JDCD CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)cc1 1789587670 AWAVOTGYUUFJBX-SZMVWBNQSA-N 476.624 1.206 10 20 JDCD COC(=O)[C@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)C1 1791242532 HEJFISXGSNDOHY-OIDVLUPKSA-N 461.515 1.066 10 20 JDCD COc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1794033096 ALIIQOGSROOSIK-SFJZTILLSA-N 483.521 1.443 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1n[nH]c(C2CC2)c1F 1794482318 GWSVZKHETZFXQB-SKBGBOCVSA-N 472.473 1.460 10 20 JDCD N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cccc(Cl)c1 1795630679 MRVTYLZZLUBOCF-JSEIYGHXSA-N 487.940 1.760 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)c1cc2cn[nH]c2cn1 1797581855 WZOMQVNDLAPJCQ-IVWMJMPLSA-N 457.874 1.540 10 20 JDCD CN(C)C(=O)NCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1802687472 RXQDDDRDGNXMDJ-SAWCTTBHSA-N 483.525 1.189 10 20 JDCD CC(=O)N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C(C)(C)C 1803384852 PAXRFRRAUWOKRS-TYCQWZJGSA-N 469.542 1.758 10 20 JDCD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN2C(=O)CSC2=S)nc2nccn12 1804336418 WRLIQQBHUZBCRV-BTTYYORXSA-N 458.569 1.150 10 20 JDCD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1807194882 FVZPTBQXBSOWJR-CRFBAAHOSA-N 475.933 1.059 10 20 JDCD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c2c1CCC2 1809363633 SAECCLJJKIBGJS-IVZQSRNASA-N 462.510 1.743 10 20 JDCD COCc1c[nH]c(C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)[C@@H]2c2cccnc2)c1 1811349473 OPCAMYHQXRZYNZ-HRAATJIYSA-N 451.483 1.996 10 20 JDCD CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814162944 ZLXLGWMEOVVTPZ-FCRGVEGXSA-N 482.537 1.832 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1 1814380229 RWRVTUSNVTURJX-SJCJKPOMSA-N 476.605 1.649 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccc(O)nn1 1816298451 IMTZFODQGRAMOZ-GFCCVEGCSA-N 461.529 1.072 10 20 JDCD COC(OC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146120 SQKRSFZKXFDDRQ-KRWDZBQOSA-N 454.487 1.814 10 20 JDCD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1)n1cncn1 1828200838 TXINAWVWLFOOQP-FZKQWKSJSA-N 470.511 1.738 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1ccn3nccc3c1)CC2 1828245127 ZKEDKPQOMKMIFM-GFCCVEGCSA-N 486.604 1.877 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831187004 GHYWTEODHQQULX-KRWDZBQOSA-N 485.497 1.496 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCC(N3CCC(NC(=O)CNC(=N)N)CC3)CC2)cc1 1834678109 MYYFEGXKRZRPBU-UHFFFAOYSA-N 479.629 1.762 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3ccccc3-n3nccn3)CC2)CC1)c1cc(O)nc(O)c1 1834987456 USKGMFJBANAIDD-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD Cc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)c1 1835155259 QQJHSHAHBVGDFG-UHFFFAOYSA-N 475.640 1.436 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)c1cc(Cl)ccn1 1835891240 LKZQQNLJGLLZJM-UHFFFAOYSA-N 496.058 1.781 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1836418912 FZJJJWAADPIGJX-XMMPIXPASA-N 464.478 1.425 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)c3csnn3)CC2)CC1 1836945672 DRSOTIABJCMZLM-DUXPYHPUSA-N 474.539 1.981 10 20 JDCD CC(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)n1 1838791575 GFQFGFKCOMSUSR-JIBKAZCMSA-N 486.525 1.364 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1O)CCO2 1839910150 YCXFOWHMLHCZRU-UVXPNCNTSA-N 484.505 1.221 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)/C=C/c1cccc(O)c1)CCO2 1839928007 HMEXHXBAXWSGEY-SRFFLEDSSA-N 496.516 1.692 10 20 JDCD Cc1ccc(CCC(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cn1 1840880135 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1836526396 RDDGDIYTNIGOAR-DEOSSOPVSA-N 497.939 1.598 10 20 JDCD CCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1837570963 QLZBPSKLFIRQIP-UHFFFAOYSA-N 480.612 1.710 10 20 JDCD O=C(c1ccc2nonc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433992 IDFCXEIPQQGQDQ-JOCHJYFZSA-N 488.884 1.671 10 20 JDCD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)ccc1F 1840682068 QXAVSCXAKGTKEM-JOCHJYFZSA-N 461.446 1.024 10 20 JDCD CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccc(F)cc1 1845007314 UCTJRZLMMLYVCR-SFHVURJKSA-N 478.571 1.067 10 20 JDCD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1845230209 SJJHAICQIZBQSK-GOSISDBHSA-N 499.568 1.258 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc(-n4cncn4)c(Cl)c3)cc2)C1 750357843 FGSKBANZRXEVKY-MRXNPFEDSA-N 481.944 1.877 10 20 JDCD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 916676333 HMGHEJMPLUYWJZ-UHFFFAOYSA-N 458.540 1.768 10 20 JDCD CN(C)C(=O)CN1CCN(C(=O)COC(=O)c2ccc3c(c2Cl)C(=O)c2ccccc2C3=O)CC1 917219818 PYNYLDIHWSRUSL-UHFFFAOYSA-N 497.935 1.505 10 20 JDCD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917837234 VZWFZOSKQXQVNY-HNNXBMFYSA-N 469.933 1.956 10 20 JDCD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 918373468 ZXABNFPSAAACKI-IBGZPJMESA-N 488.610 1.551 10 20 JDCD COCCOc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(C)c1 918465830 TUIPBMRTBDEKHE-LJQANCHMSA-N 468.554 1.977 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777850975 OUMRZZOTMUQZAY-FGDDKPPBSA-N 473.526 1.376 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnc(-c3ccccc3)o1)C2)c1cc(O)nc(O)c1 1777851075 OIBFRJZXUGLHCT-MZNJEOGPSA-N 479.493 1.984 10 20 JDCD O=C(COc1cc(Cl)ccn1)N1CC[C@@]2(C1)CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)CCO2 1779228856 DEHFVMWTSVCSKH-XMMPIXPASA-N 497.939 1.737 10 20 JDCD CC(C)(C)n1cc(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)nn1 1780355349 MCKADRABUPXIHB-XMMPIXPASA-N 479.541 1.270 10 20 JDCD O=C(CN1CCSCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1783499094 LECXALXRQXFVKN-YEWWUXTCSA-N 469.991 1.393 10 20 JDCD C[C@H](Cn1ccnc1)C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1784507997 PFJXZOSRMHIVGB-GEBOWEBUSA-N 456.499 1.179 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccn3n1)CCO2 1785505409 HHLHOCQMLCLTRP-SXBBHYFQSA-N 464.478 1.608 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1scnc1C(F)(F)F 1786264740 FSEWTFJEVVGYSF-DLOVCJGASA-N 472.445 1.875 10 20 JDCD COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21 1787724017 JODKUULRTDVRSS-YLVFBTJISA-N 465.890 1.793 10 20 JDCD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C=C/c4ccc(O)c(O)c4O)[C@H]3C2)cc1 1792218761 CGGTZLUVZAPPLI-VTFYBKDISA-N 498.532 1.539 10 20 JDCD C[C@@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792241958 MFKUGYFEPZNEAG-DKIMLUQUSA-N 476.624 1.100 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccoc3C1)C2)C1=NN(c2ccccc2)C(=O)C1 1796479676 VXUMNCLDUSCLNC-FLFXDLLNSA-N 476.533 1.767 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1cc(-c2cccs2)on1 1798128394 DZMHLGRMAMMVMW-KSPBDQMDSA-N 492.604 1.467 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799147798 DMRBWFPMFAXKNN-SFUGEZHDSA-N 477.945 1.355 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996157 MHJKSZIVUGWCTF-BTYIYWSLSA-N 459.466 1.564 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1)C1=NN(c2ccccc2)C(=O)C1 1808468883 GEDQLMHLKFPXFL-SBUREZEXSA-N 485.504 1.277 10 20 JDCD Cc1nnc(CC(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)o1 1810054490 SXQYECPSFGOAED-UHFFFAOYSA-N 464.526 1.945 10 20 JDCD CCN(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812315980 LVIYOPWWMSIWTK-ALKREAHSSA-N 463.629 1.288 10 20 JDCD Cc1nccn1[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814191940 PIIFOSVZQWWSGR-LIVBEALHSA-N 486.623 1.714 10 20 JDCD N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccccn1 1817341355 JNLWDJHEGGUYPW-KSSFIOAISA-N 473.584 1.357 10 20 JDCD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1 1817846419 WRJLUMZVTKNMSW-JKSUJKDBSA-N 475.458 1.017 10 20 JDCD Cn1ncnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818146319 YTNVGPMACROMDJ-KRWDZBQOSA-N 461.486 1.637 10 20 JDCD CN1CCCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1822600016 DSFJZRGLAMJCIZ-WCQYABFASA-N 467.642 1.400 10 20 JDCD O=C(C[C@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1831246700 WXPUXSHTVLWOTJ-NLFFAJNJSA-N 483.521 1.267 10 20 JDCD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)N1CCCC1 1832425035 ZSAHJGDDFHEMHV-HSZRJFAPSA-N 495.960 1.224 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)[C@@H]1CC(=O)N(C2CCCC2)C1 1833683748 JDWHYFVZOCYMLE-GOSISDBHSA-N 499.612 1.469 10 20 JDCD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c1 1838929764 ALAKKKVNEJHCPT-VQEXNLMWSA-N 484.505 1.595 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839433567 XVRNRQFVIDNARN-LRTDBIEQSA-N 486.905 1.383 10 20 JDCD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)CC1 1840897096 LEXPYEUDJNQSMI-DRSNIGMVSA-N 483.656 1.520 10 20 JDCD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1841224974 MLCDSAJQODVTGH-PSOXFSNLSA-N 495.532 1.199 10 20 JDCD Cn1c(=O)n(CC(=O)N2CC3(CCCN3C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)c2ccccc21 1843441519 DEXQHMMYORBAMI-UHFFFAOYSA-N 486.532 1.336 10 20 JDCD COc1cccc(CNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1O 727762995 VJSJSPFADSEEPH-UHFFFAOYSA-N 461.540 1.330 10 20 JDCD COC(=O)C[C@@H]1C(=O)NCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 915195007 QYCXZBWFTRIHBU-JFBXQDQPSA-N 467.594 1.620 10 20 JDCD CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 918284377 CSKBZODHTBBCSH-UHFFFAOYSA-N 490.557 1.118 10 20 JDCD O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 918333838 BNNQGANWFOQWNB-UHFFFAOYSA-N 470.551 1.303 10 20 JDCD Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OCC(=O)N(C)C)c1 920189323 OBASKLCYJPOAHL-UHFFFAOYSA-N 472.517 1.693 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1778637087 VVWRJHUUKXWZEZ-SXBBHYFQSA-N 482.468 1.976 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781774725 KNCUQPHMJGVDLX-DEOSSOPVSA-N 495.467 1.970 10 20 JDCD COc1ccnc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1OC 1782007750 LMIGIZDDDUUIKC-QFIPXVFZSA-N 477.901 1.921 10 20 JDCD CCOC(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)OCC 1782339642 NYFOIAFJIAZHQR-OPAMFIHVSA-N 451.520 1.410 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1nc(Cl)ccc1F 1785474930 SONTWAMOQQXOLE-GVXVVHGQSA-N 486.978 1.328 10 20 JDCD O=C(CCCc1ccccc1F)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785539110 IGCGTCVFEVCVOC-JOCHJYFZSA-N 479.599 1.839 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1cnn2ccncc12 1788031664 KLXSDGKAFWYKJE-BPXKWBHBSA-N 487.520 1.116 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2)C1=NN(c2ccccc2)C(=O)C1 1796479594 KJYXWGUWKPVSBA-XHNJZIHCSA-N 484.516 1.626 10 20 JDCD CNC(=S)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)C2 1797759038 WXAQDVRVOVMFEA-JHDGKUDLSA-N 483.638 1.781 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799768425 YARIYIUZQGLQKR-YGSHXTJESA-N 456.879 1.516 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2)c1cc(O)c(O)c(Cl)c1 1799769471 PEMACGIEGFFMNB-CWPLJXCYSA-N 483.912 1.849 10 20 JDCD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1800959490 QMRHKYNYSUGLMT-SPCJURDBSA-N 478.929 1.710 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)c1cc(O)ncn1 1803740265 AVXHAAJEXKJZNW-SBUREZEXSA-N 485.504 1.690 10 20 JDCD Cc1cncc(C(=O)NC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@H]2c2cccnc2)c1 1805772263 OEEDHZYSKAILST-JXFKEZNVSA-N 469.592 1.965 10 20 JDCD Cn1ncnc1C(=O)N1CC[C@H](CNC(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808465763 YPDXGOOUFLHJJJ-UTKZUKDTSA-N 472.509 1.323 10 20 JDCD O=C(CCN1CCOC1=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1809533336 UPQGVBVUWGFWMX-OPKTXDQFSA-N 496.520 1.760 10 20 JDCD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cc(O)nc(O)c4)sc3C2)C1 1816720487 VBFWEBBRNAMRQV-LOWVWBTDSA-N 460.512 1.764 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)nc(O)c1)CC2 1825965071 GJFHJLKWJKEHCT-BFHYXJOUSA-N 472.523 1.931 10 20 JDCD Cc1noc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)n1 1827147464 RLOXINJWIQMKAA-HNNXBMFYSA-N 465.601 1.401 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn3nccc13)CC2 1828247016 NCOAAHZFWQSEMF-NSHDSACASA-N 486.604 1.877 10 20 JDCD Cc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1832783612 ZZMOGVJYUBMXEW-ZWDKTXKMSA-N 497.548 1.609 10 20 JDCD CN1CCC(CC(=O)NC2CCN(C3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)CC1 1833134761 QYOIRJOBOJPFBT-UHFFFAOYSA-N 495.715 1.150 10 20 JDCD Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1834240293 DLQJICJGTZYPRP-UHFFFAOYSA-N 478.553 1.961 10 20 JDCD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)nn1C(F)F 1836160694 HTLBPJPPHPQRAT-UHFFFAOYSA-N 478.500 1.892 10 20 JDCD O=C(Cc1ccc(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836419669 SPMZLHXGFGUHJU-QFIPXVFZSA-N 463.437 1.084 10 20 JDCD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839217997 GQAKXJZJIGSLFT-WAIKUNEKSA-N 457.483 1.030 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CC(N)=O)C3)C2)cc1 1839348514 DKEGEGDPWCTWGA-WXTAPIANSA-N 482.581 1.676 10 20 JDCD CC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)CCO2 1839348603 YYMZRGKIFQBNGF-RUZDIDTESA-N 468.554 1.300 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3)C2)C1 1840880372 LQZLQLBEQDDQRG-KAIXTLCJSA-N 484.505 1.007 10 20 JDCD COc1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1C 1840880376 MAJKSSBVHCHQLW-BFHGXFJZSA-N 499.520 1.299 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2cncc(C(F)(F)F)c2)C1 1844546583 UXEXSYFYSDDSLC-UHFFFAOYSA-N 458.487 1.778 10 20 JDCD COC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S)c1ccccc1 1847451281 HBMCUJRMRFVVGA-RLFYNMQTSA-N 476.580 1.146 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 23703611 HQAIWVLRPJCUBI-UHFFFAOYSA-N 475.571 1.626 10 20 JDCD CCNc1nc(NCC)n2c(SCC(=O)N3CCN(Cc4cccnc4)CC3)nnc2n1 108203390 ODVVLAKSADFZKJ-UHFFFAOYSA-N 456.580 1.214 10 20 JDCD Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1C 726975101 VNZGNYOQHCIIBT-UHFFFAOYSA-N 453.542 1.925 10 20 JDCD O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](N2CCNC2=O)C1 744355732 VSCZOLVOQUPLMT-INIZCTEOSA-N 489.510 1.731 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3ccccc3OCC(=O)N(C)C)CC2)cc1 746199117 PEZMFBOMEPSSGJ-UHFFFAOYSA-N 455.511 1.668 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CCc3nc(-c4ccccn4)no3)CC2)cc1 915050079 RBFIOSQZORUZBH-UHFFFAOYSA-N 451.483 1.965 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCS(=O)(=O)Cc3ccccc3)cc2)C1 918122942 OAKCIGOECZBHQT-HXUWFJFHSA-N 458.584 1.803 10 20 JDCD NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1Cl 918464398 UXXIZQSXGMOBAC-AWEZNQCLSA-N 457.918 1.396 10 20 JDCD CCCNC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 918464662 YQZHSMGSFGIXII-LJQANCHMSA-N 465.554 1.783 10 20 JDCD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cn1 919799896 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C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1)n1ccccc1=O 1799769535 VYEFJLWAPLLMSI-NFWAQSGPSA-N 461.902 1.377 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1OC(F)F 1801816913 QNXIXEVBBGZYIJ-DPIQGUFMSA-N 485.534 1.352 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2 1802078689 CHTDMLQJTKJGDU-FWAVJVHASA-N 493.516 1.599 10 20 JDCD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1(O)CCC1 1802467456 ASYPAENCMQGKFJ-ALKREAHSSA-N 476.624 1.499 10 20 JDCD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)c(O)c(Cl)c1)C2 1802844793 CYFOIPAIJOJSMS-NOVWEMISSA-N 475.933 1.474 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CSC1=S)[C@H](O)c1ccccc1Cl 1804340183 KLVNPGJNGVDGDP-SJBDTSRBSA-N 468.000 1.872 10 20 JDCD N[C@H](CC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cccnc1 1807268948 HEVPHEJYFRGUEA-HMFYCAOWSA-N 498.634 1.433 10 20 JDCD 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COC1(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CN2C(=O)CSC2=S)CC3)CCC1 1827414222 UXFYUUOTAZPVDS-NSHDSACASA-N 468.626 1.875 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828964969 AWMNQXWFHYCABR-WIOPSUGQSA-N 497.596 1.050 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2 1829489987 NOFLDLVXSZXPNN-VQLVADFHSA-N 489.437 1.088 10 20 JDCD Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)c2c1CCC2 1834987302 KVDMRFHFXMYIQQ-UHFFFAOYSA-N 468.558 1.214 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1)c1cc(O)nc(O)c1 1834987738 YJOWTRAGCFVFTQ-UHFFFAOYSA-N 465.514 1.035 10 20 JDCD O=C(c1ccc2ncoc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836418263 KNGJDQBDTIBRFW-JOCHJYFZSA-N 454.439 1.018 10 20 JDCD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836418974 JXNXHKVHEVXOOB-XMMPIXPASA-N 471.510 1.502 10 20 JDCD O=C1CC(C(=O)N2CCC(OC3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)CC3)CC2)C1 1838824025 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COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846341444 WTGVGERXOABYTN-OALUTQOASA-N 464.522 1.738 10 20 JDCD O=C(c1cn2c(Cl)cccc2n1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847054315 NFDGGQCPDXLZHC-UHFFFAOYSA-N 463.972 1.665 10 20 JDCD CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1)NC(=O)OC(C)(C)C 1847054822 SYPULUIVGLMWFG-AWEZNQCLSA-N 484.644 1.744 10 20 JDCD O=C(CCn1c(=O)oc2ccccc21)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847056298 AZZZGJSQBVRNJM-UHFFFAOYSA-N 474.564 1.048 10 20 JDCD COc1ccc(N2CCN(C(=O)CN3C(=O)C(=O)N(CCc4cccs4)C3=O)CC2)cc1 26210313 ZZYVVYPEPNAXJS-UHFFFAOYSA-N 456.524 1.439 10 20 JDCD Cc1ccc(C(=O)NCCC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(O)c1 726203147 ILBGUNRNDUPIEI-UHFFFAOYSA-N 473.501 1.656 10 20 JDCD C[C@@H]1CN(c2ccc(CNC(=O)NCCC(=O)N3CCN(c4ncccn4)CC3)cc2F)C[C@@H](C)O1 726706331 HSMVAMVAAWBTPZ-RTBURBONSA-N 499.591 1.767 10 20 JDCD C[C@H](OC(=O)Cn1cnc2c(cnn2C)c1=O)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 826023430 UFZDUSFLWKIWRR-ZDUSSCGKSA-N 485.456 1.476 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JDCD O=C(Cc1ccccc1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836417647 CENYGBWJSGUQLN-QFIPXVFZSA-N 495.454 1.824 10 20 JDCD CC(=O)C[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1836557684 OOPVVWCWPYFBPR-AWEZNQCLSA-N 468.645 1.034 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1 1838111771 PDOYSPDJUSKKSL-RMNGQBEXSA-N 480.565 1.670 10 20 JDCD Cc1cc(F)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c1 1839457207 TZAMNFQNKFQIMZ-JOCHJYFZSA-N 463.437 1.463 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(F)c3)C2)C1 1840879888 KXNNQGYSHVTAIO-KFVKGYIZSA-N 473.457 1.121 10 20 JDCD C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840880691 FRZKIPMVRKRCEQ-ZLGDRYJUSA-N 497.548 1.774 10 20 JDCD C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881367 QUEJPADALPRJBC-XPHTUUDFSA-N 498.532 1.741 10 20 JDCD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2 1841515484 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JDCD CC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN4C(=O)CSC4=S)C[C@@H]32)CCCCC1 1791215684 JLBKNSDOMYYYNS-JYJNAYRXSA-N 453.630 1.797 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21)c1ccc(-c2ncc[nH]2)cc1 1792032726 XGVZAXJUWVXCSN-WDSOQIARSA-N 463.494 1.790 10 20 JDCD CCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792218483 HRKRJPXOHXCZOH-XLKQXPMPSA-N 456.499 1.327 10 20 JDCD O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1792422476 YHGYSAIAKLDDRE-MBQWOLKWSA-N 483.477 1.557 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCN2CCN(C)CC2)cc1 1795447402 SPISLEYGWJDJGG-SUOOXSEHSA-N 493.652 1.935 10 20 JDCD C[C@@H](Oc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796482562 ISNDWWGFJITFFL-PRHHBONVSA-N 477.521 1.231 10 20 JDCD C[C@@H](NC=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](Cc1ccc(N)cc1)NC(=O)OC(C)(C)C)C2 1800092528 XEGKEFCELPYSSV-CMWLGVBASA-N 487.601 1.477 10 20 JDCD 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O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)C(=O)Nc1cccnc1 1810461392 CBHYEAHYWDTNSJ-QRWLVFNGSA-N 462.466 1.241 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@H]1CCc2nc(NC(=O)c3ccncc3F)sc2C1 1817871049 CAQDDPCWPAITCO-VIFPVBQESA-N 465.557 1.763 10 20 JDCD NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818148098 ZOUSCXBIPWLROK-KRWDZBQOSA-N 451.487 1.460 10 20 JDCD Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)c1F 1823495940 GAYXMLWSWRHXSG-LBPRGKRZSA-N 479.563 1.757 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1 1823497385 CTNORPGNXPLLDH-SNVBAGLBSA-N 478.516 1.207 10 20 JDCD O=C(CN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827715189 PNICVGUEEJOSOT-NRFANRHFSA-N 481.553 1.851 10 20 JDCD Cn1ccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3ccc(O)c(O)c3O)sc2C1 1828194943 FCAZYQANKRKIDR-QDBLGGKGSA-N 455.496 1.933 10 20 JDCD CC(=O)C[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828249644 KSTDRTJZKPPFQP-KOLCDFICSA-N 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CN1C(=O)c2ccc(S(=O)(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2C1=O 917929520 GQGQBIHPIWGDOA-HNNXBMFYSA-N 456.524 1.093 10 20 JDCD NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1 918200079 WIRQUMABLYHNTN-HSZRJFAPSA-N 469.561 1.841 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc(S(N)(=O)=O)ccc3Cl)cc2)C1 918370775 BMYPTWIDMDAKLY-AWEZNQCLSA-N 450.948 1.619 10 20 JDCD CCS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 919701354 YMTFWYHCDFEJEH-IBGZPJMESA-N 490.605 1.620 10 20 JDCD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CCN(C[C@H]2CCCO2)CC1 919782481 KPVVSVVHFQJYIO-OAQYLSRUSA-N 483.592 1.949 10 20 JDCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCN(CC(=O)N4CCCCCC4)CC3)CC2)cc1 920252054 GTHPOEJXWOMQRT-ZHACJKMWSA-N 497.640 1.447 10 20 JDCD COCCN1C(=O)/C(=C/Nc2cccc(S(=O)(=O)NC3=NCCCCC3)c2)C(=O)NC1=S 920978757 PDIKUAIPDIQDPQ-DTQAZKPQSA-N 479.584 1.123 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1n[nH]c2ccc(F)cc12 1779087627 SQRXOZXRCAAULI-UZUQRXQVSA-N 469.473 1.950 10 20 JDCD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c(-n2nccn2)c1 1780241369 ORNNBHOBAQYVEG-QHCPKHFHSA-N 464.482 1.139 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)[C@H]1CC[C@H]2CCC(=O)N2C1 1780612071 UWARUGZQBPDRFA-GCMIKPLOSA-N 472.542 1.021 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)c3cccc(Br)c3)C2)C1 1780972138 HFGFWUKLQXBNCY-GHTZIAJQSA-N 492.326 1.432 10 20 JDCD CSc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c1O 1785545578 ZVVBOZADKIRTGV-HXUWFJFHSA-N 481.621 1.418 10 20 JDCD CCc1noc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787539491 KNCZTCAYKXNXAR-MDKPJZGXSA-N 479.537 1.932 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1ccc(F)nc1 1788841005 VJFJRMYXOGPLOG-QRFRQXIXSA-N 465.485 1.607 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1ccoc1Cl 1789421015 SWONEKCXFQBUSA-DRZSPHRISA-N 457.961 1.387 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc4ncccc34)C[C@@H]21 1792237274 DTRDHBPPUGIYTM-QRFRQXIXSA-N 498.630 1.617 10 20 JDCD O=C(COC1CCCCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1792787617 LICZWIJEHYFPEL-MRSFGVLCSA-N 468.554 1.718 10 20 JDCD COc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)cc1C 1796481007 GVOAXVIOMNROKN-OPMZPASUSA-N 477.521 1.395 10 20 JDCD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)sc1C 1798410737 UCEOVDHZIURUSC-DOMITNGFSA-N 459.524 1.793 10 20 JDCD CCOC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)ccn1 1798688436 NVONVUDSFZTJEJ-GCXCYBGASA-N 497.504 1.292 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1)c1ccc[n+]([O-])c1 1804780919 HXWLYPJPKIDOJG-XZSBDORCSA-N 476.489 1.865 10 20 JDCD O=C1CC[C@@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)N1 1806641557 OXENQUHXBNEHQH-IYJAJMOOSA-N 458.902 1.744 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994217 DRRVGTZULHZNFW-QVKFZJNVSA-N 459.466 1.564 10 20 JDCD CN1C(=O)CC[C@H]1C(=O)NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1808759489 KUUIJIKDDLIOLS-UTSGNWPNSA-N 488.548 1.501 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1)c1cc(O)c(O)c(Cl)c1 1811797532 UNOAGYBEXILZGT-AUUYWEPGSA-N 474.901 1.918 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1 1814162925 ZDSJGVRJTHUSFS-OHEQXUGLSA-N 468.466 1.026 10 20 JDCD CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362650 SOZZKDYACJAYOY-VNDWYCCKSA-N 481.534 1.967 10 20 JDCD C[C@]1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)CCCN1 1820823351 IOUHWXJBAWNJAJ-ORAYPTAESA-N 450.590 1.404 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1821096896 HZEBSOUCMNDMDM-LBPRGKRZSA-N 477.506 1.657 10 20 JDCD COC(=O)CSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1824519030 NPAWQEIWSAGXLF-HNNXBMFYSA-N 487.669 1.373 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)C1=CCCS1)CC2 1828240232 SBFQJQLJIBMIAQ-VIFPVBQESA-N 454.624 1.936 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc3nccn13)CC2 1828247481 SSAPIFLMLGOILS-LLVKDONJSA-N 486.604 1.877 10 20 JDCD O=C(Cc1cccc(Cl)n1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1833879314 CTNLVUYIEQGVRQ-UHFFFAOYSA-N 473.961 1.969 10 20 JDCD Cn1cc2cc(C(=O)N3CCC(N4CCC(NC(=O)c5cc(O)nc(O)c5)CC4)CC3)ccc2n1 1834987139 DYRFFRCFWNBONE-UHFFFAOYSA-N 478.553 1.879 10 20 JDCD C[C@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988477 WSBLKVFREKVWEQ-QGZVFWFLSA-N 467.570 1.952 10 20 JDCD O=C(/C=C1\C(=O)Nc2ccccc21)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835689172 CCWKMTHCJKASNU-HKWRFOASSA-N 491.548 1.714 10 20 JDCD O=C(Cc1ccc(F)cn1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1836034213 CXRCLVBIARWLBI-QFIPXVFZSA-N 479.892 1.598 10 20 JDCD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)n1cccc1C=O 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O=C(CCc1ccc(O)nn1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1812325871 IDFFDJWNYVRZFV-IVZQSRNASA-N 464.482 1.336 10 20 JDCD CCC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1815108432 IIVVUKSEIZFSLP-AAEUAGOBSA-N 466.589 1.177 10 20 JDCD COc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n1 1815806002 CODHBJVETMZXTP-OAHLLOKOSA-N 488.595 1.908 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cc(=O)nc2cccnn12 1820144821 PJHPQKZLQAGEHT-CQSZACIVSA-N 476.453 1.239 10 20 JDCD CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(O)c(O)c(Cl)c3)sc2C1 1823708429 ZCKFLACMHDGFOM-JTQLQIEISA-N 473.960 1.868 10 20 JDCD N[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1)c1cccnc1 1826993331 ZKPOCSCVCXAAHO-RBUKOAKNSA-N 489.667 1.952 10 20 JDCD CC(C)(C)n1cc(C(=O)N[C@H]2CCc3nc(NC(=O)CN4C(=O)CSC4=S)sc3C2)nn1 1828247163 NDPUQWUOVSGZSN-JTQLQIEISA-N 493.640 1.576 10 20 JDCD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1829114085 HAQLMMQFIFLKPO-DHIUTWEWSA-N 497.596 1.550 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1 1831982934 XJCTXFZMEDCCJQ-NRFANRHFSA-N 491.548 1.324 10 20 JDCD O=C(C[C@H]1CNc2ccccc2O1)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835696998 HFPGVLHBAPQKBS-FQEVSTJZSA-N 495.580 1.941 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ccc(OCCCO)cc1 1836113806 IURZSSWNVZUYPF-UHFFFAOYSA-N 498.580 1.753 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1 1836527001 XNYUXLYPWBEADK-XMMPIXPASA-N 497.939 1.598 10 20 JDCD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c(F)c1 1836693540 GSMZDSASRRQPCG-DEOSSOPVSA-N 489.500 1.343 10 20 JDCD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)c(C)n1C 1838390238 SXFKEOUEQDTLBH-PIITYICYSA-N 485.537 1.542 10 20 JDCD CCc1[nH]nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)c1F 1839431871 RYOHJIRWHZHHKB-NRFANRHFSA-N 482.896 1.560 10 20 JDCD CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1839432289 JYWOTLFJROUNCH-GTXQTCRKSA-N 456.923 1.228 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)c2ccn(-c3ccccc3)n2)C1 1844799899 ZDKRVWAFRLRDBC-UHFFFAOYSA-N 455.565 1.550 10 20 JDCD O=C1CCCc2cc(C(=O)N3CC4(CCCN4C(=O)CN4C(=O)CSC4=S)C3)ccc21 1847054221 JFGPTBIKFNGKNB-UHFFFAOYSA-N 457.577 1.883 10 20 JDCD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)c(O)c1O 727005248 LRRIABPKPASYCR-CQSZACIVSA-N 464.496 1.611 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)CS[C@@H](C)C(=O)Nc3cc(C)on3)CC2)cc1 742927112 ITEDLVBBVXCLRU-KRWDZBQOSA-N 461.588 1.990 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)NCc3ccc(S(=O)(=O)N(C)C)cc3)CC2)cc1 742940706 WLXHTPDEBDGJOE-UHFFFAOYSA-N 475.615 1.567 10 20 JDCD COC(=O)c1c(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n[nH]c1C 912531113 PQGMKLJQOWIBJL-UHFFFAOYSA-N 462.450 1.839 10 20 JDCD CCCCNC(=O)Cn1c(=CC(=O)C2CC2)sc(=Cc2ccc(N3CCOCC3)cc2)c1=O 914579879 KUTNYWYMHJIBSO-UHFFFAOYSA-N 469.607 1.251 10 20 JDCD Cc1cc(CCNC(=O)C(=O)Nc2cccc(C(=O)NCC(N)=O)c2)c(C)n1-c1ccccc1 915749187 SAZIADGRQCOACW-UHFFFAOYSA-N 461.522 1.607 10 20 JDCD COc1ccccc1C(=O)N1CCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 916996869 YGCNQCATUHSTGJ-UHFFFAOYSA-N 470.545 1.745 10 20 JDCD COCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 918373396 YEERUAHDUIKMHV-IBGZPJMESA-N 474.583 1.243 10 20 JDCD CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 918846143 GMQZHAOPDQMYHM-UHFFFAOYSA-N 479.530 1.386 10 20 JDCD O=C(COC(=O)[C@@H]1CCCCN1c1ncccn1)NCc1ccc(N2CCOCC2)c(F)c1 919075574 OXTSRFXUIBBUQL-FQEVSTJZSA-N 457.506 1.671 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)c(F)c1)C2)c1cc(O)nc(O)c1 1777851143 CJYZKIZFOZPCNA-WZONZLPQSA-N 459.474 1.566 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)n3)C2)C1 1779485875 COCJRDPROMTGLC-QHCPKHFHSA-N 451.458 1.457 10 20 JDCD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1781986416 DASJZXMLTVLLTQ-OAQYLSRUSA-N 460.418 1.606 10 20 JDCD CCCNC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783218282 JKZJSEDNVGCHOQ-BSZIWHIGSA-N 489.569 1.637 10 20 JDCD CC(C)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1)C(C)C 1783246511 XNCVKUBDOJZBGD-GTCCEBARSA-N 484.688 1.383 10 20 JDCD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783854212 DORODOSKAPZBRZ-DRRFGNLZSA-N 486.521 1.402 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1 1784133640 XORSVPSFMIHDCT-ROMRWMGNSA-N 454.527 1.160 10 20 JDCD O=C(/C=C/c1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1784868454 DCWHIKRIKSIKHM-NVKRQELUSA-N 495.573 1.818 10 20 JDCD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)ccc1O 1785509732 AZDLVFGJJJDWDV-BSBODGDASA-N 454.479 1.974 10 20 JDCD O=C(CC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1)Nc1ccc(F)cc1 1785510405 YWBNZLMHZINBCA-AMGVHNACSA-N 499.495 1.814 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21)c1cc(O)nc(O)c1 1787291209 MBSGRCWWBOZYFE-NUTKFTJISA-N 459.524 1.786 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787539817 YJLNQRTWMJIEDG-KNBMTAEXSA-N 465.485 1.607 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1ccn2cncc2c1 1788407201 XNMPTHLJIPCSSC-HARLFGEKSA-N 486.532 1.721 10 20 JDCD N[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1)c1cccnc1 1790243593 ZWXJAHITCXEIGQ-LLYILUEJSA-N 474.945 1.830 10 20 JDCD O=C(COc1cccc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1793818514 ADXWUGFGVXILDK-GPVSGQMNSA-N 499.614 1.669 10 20 JDCD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c(C)c1 1796480707 GEPNWDDTEKFWSQ-MRSFGVLCSA-N 476.533 2.000 10 20 JDCD CC(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)n[nH]1 1798667982 MPFCUWQLSKFADK-MFKICJERSA-N 464.526 1.529 10 20 JDCD CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc(O)nc(O)c2)C3)cc1OC 1800859638 PESPDZREMMZGBM-GPVSGQMNSA-N 471.510 1.346 10 20 JDCD O=C(CCc1c[nH]c2ncccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1802070628 YQIRMDBQBOBIAU-WWBGSUSQSA-N 492.532 1.915 10 20 JDCD CNC(=O)CC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@H]1c1cccnc1 1803487454 WIFASVNQLDCKMH-NLLJUKRZSA-N 454.483 1.054 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cncc(F)c1 1805852503 VOOBPSVDZFQPPJ-KUHUBIRLSA-N 473.555 1.796 10 20 JDCD CN1CCCn2nc(C(=O)N3CC[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3c3cccnc3)cc2C1 1807999214 IUZGLHAAPSKYCO-GAJHUEQPSA-N 491.552 1.553 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810549678 XGYSZEQEZNFQOO-KRWDZBQOSA-N 492.573 1.613 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@H]1c1cccnc1)c1cccnn1 1810723445 RPUMNRRWHPEOCA-JPYJTQIMSA-N 469.505 1.984 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)Cc2ncccn2)[C@H]1c1cccnc1 1814163122 ZLHMMDFTJYYSMQ-OYOQQZMJSA-N 475.505 1.950 10 20 JDCD COc1ncccc1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814186879 YYUGNIAMENCDAK-KXBFYZLASA-N 485.591 1.665 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cc3ccccn3n2)[C@H]1c1cccnc1 1814189079 LACBVUFCUFGJRW-KKSFZXQISA-N 494.602 1.909 10 20 JDCD O=C(/C=C\C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1)NC1CC1 1817362272 UAYHURDKXYLAGB-WOLCWHLNSA-N 492.561 1.683 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2C(=O)OCCO)[nH]n1)c1cc(O)nc(O)c1 1817847654 RBAMWNVOEJGDDO-SFHVURJKSA-N 495.492 1.985 10 20 JDCD O=C(O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)ncn1 1825502657 OLNUHRWRZWUQNJ-QGZVFWFLSA-N 455.471 1.528 10 20 JDCD Nc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)s1 1826997395 LHWVGYCMMCJWCK-ZDUSSCGKSA-N 467.642 1.819 10 20 JDCD CN1CCN(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)CC1 1827426087 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Cc1cccc([C@@H](CC(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)NC(N)=O)c1 919067865 IIJNADKQVYTBGS-HXUWFJFHSA-N 472.517 1.930 10 20 JDCD CCN1C(=O)c2ccc(C(=O)OCC(=O)N(C)Cc3ccc(N(C)C)cc3)cc2S1(=O)=O 919580824 CIKLAOBSUDRQRI-UHFFFAOYSA-N 459.524 1.732 10 20 JDCD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC3CCN(C(=O)c4ccco4)CC3)CC2)cc1 920255842 XFXUUILQUIQIAK-CMDGGOBGSA-N 466.538 1.914 10 20 JDCD CS(=O)(=O)Nc1ccc(O)c(C(=O)OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c1 920636498 VVKRRHNEZJWBPB-UHFFFAOYSA-N 463.512 1.391 10 20 JDCD CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1N/C=C1/C(=O)NC(=S)N(CCOC)C1=O 920976754 SQDFGFKFKNEPLG-LUAWRHEFSA-N 480.490 1.597 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1778473454 MPBFVYOZLZTAIZ-OAQYLSRUSA-N 479.649 1.931 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1781812902 QGHKSABHIKYRSG-DEOSSOPVSA-N 480.477 1.040 10 20 JDCD Nc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C=C/c3ccc(O)c(O)c3O)C2)cs1 1783222586 ZHHZDVNQNNHLEE-MAOUNKGHSA-N 474.539 1.683 10 20 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COc1ccc(C(=O)N2CC[C@H](CNC(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)nn1 1814190349 XUJZGBYIORZRIZ-KUHUBIRLSA-N 486.579 1.060 10 20 JDCD O=C(Cn1ccccc1=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817519145 HTSMVTNHPOGPKV-CQSZACIVSA-N 474.568 1.124 10 20 JDCD Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c(=O)[nH]c1C 1817843877 FNLIEVLWTBLCIG-AWEZNQCLSA-N 453.459 1.536 10 20 JDCD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)nc(O)c2)n[nH]1)[C@H]1SC(=N)NC1=O 1817845166 DDCWQXRZTBRKHD-PXTQAZKISA-N 473.515 1.324 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)c1cc(O)nc(O)c1 1817847309 UOFYBHKQXDEVBW-IBGZPJMESA-N 477.525 1.919 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccnc2)[nH]n1 1823498098 MPKCYSQKNGMKAH-HNNXBMFYSA-N 458.569 1.900 10 20 JDCD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)c2)CC1 1824459966 JRQZFUIKQJWWKO-YOEHRIQHSA-N 468.576 1.054 10 20 JDCD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)nc(O)c3)CC2)cn2[nH]cnc(=O)c12 1827428533 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CC(=O)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840133163 PHEVPCMVISTJGD-ASSNKEHSSA-N 454.907 1.436 10 20 JDCD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1 1840881472 VCXAZUBUUUYVFI-DSCGJTOLSA-N 484.505 1.595 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1 1840897174 PKDUYIGBEWXQFB-HSZRJFAPSA-N 489.619 1.494 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1 1841855702 VLYNQPQDTRRBMA-UHFFFAOYSA-N 472.885 1.389 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccccn1)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1 1843249163 DMAJHJYGDSSURC-SFHVURJKSA-N 497.552 1.841 10 20 JDCD O=C(c1c(O)cc(O)cc1O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843442470 MNERJCDQWVQCRO-UHFFFAOYSA-N 450.451 1.413 10 20 JDCD O=C1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)Cc2cnc3ccccn23)=NN1c1ccccc1 1847535505 PBZSEXOLKZSHGG-SFTDATJTSA-N 456.506 1.872 10 20 JDCD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)C1 1847690020 RVWJESCFZHEYFR-FZKCQIBNSA-N 496.655 1.742 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)CNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 748572624 SQMRUZDFNMKHHK-UHFFFAOYSA-N 498.945 1.794 10 20 JDCD CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)=NN1c1ccccc1 751345414 LRFCUNUBVVPXIT-QFIPXVFZSA-N 454.552 1.762 10 20 JDCD O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 918294069 CLXAKJDATWBQBG-JOCHJYFZSA-N 481.549 1.940 10 20 JDCD CC(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1 918340244 OBALACOJGADJMU-UHFFFAOYSA-N 465.597 1.538 10 20 JDCD COc1ccc(N2CCN(CCCNS(=O)(=O)c3ccc(F)c(S(C)(=O)=O)c3)CC2)cc1 919939549 BACDIBHPUDXYAN-UHFFFAOYSA-N 485.603 1.728 10 20 JDCD C[C@H](NC(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1)c1ccc(N2CCOCC2)cc1 920871574 LXLCIWUWNXNVDS-SFHVURJKSA-N 473.599 1.763 10 20 JDCD C[C@@H](NC(=O)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1)c1ccc(N2CCOCC2)cc1 920927572 YRSWGVRXIXSWCV-HXUWFJFHSA-N 493.608 1.656 10 20 JDCD Cc1nc(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)sc1C 1779950192 XPUYLFVLIMAMAT-GOSISDBHSA-N 454.599 1.064 10 20 JDCD COC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)CC1 1781818306 XUSVLWDQZKKZTC-RYNBQMKOSA-N 474.510 1.284 10 20 JDCD CCOc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)nn1 1782007294 BOBNJVJVLNLRTB-OAQYLSRUSA-N 462.890 1.697 10 20 JDCD CN1CCCC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccc(O)c(O)c2O)C1 1783218246 GBCKMWNJNIMDTK-DYFLVBFBSA-N 473.570 1.815 10 20 JDCD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)ccc1F 1785011527 WXMOTXMEMHGFSK-FQEVSTJZSA-N 467.544 1.138 10 20 JDCD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)C1 1785480987 SSGLNRDDNQBEEU-QHCPKHFHSA-N 476.530 1.193 10 20 JDCD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)c(F)c1 1785544791 APCRXPKSEQDYMZ-HXUWFJFHSA-N 467.544 1.138 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21)c1cc(O)nc(O)c1 1787292131 YQOJCDPIBGMNGQ-PJODQICGSA-N 466.416 1.814 10 20 JDCD COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)c(F)c1 1796480541 MSKRPBLPBKBKNL-USGNIVHTSA-N 481.484 1.225 10 20 JDCD Cc1cccnc1C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1803810690 QJVSKVOTXRRRID-OXQOHEQNSA-N 469.592 1.965 10 20 JDCD C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(O)c(O)c1O 1804283334 RUVLSIFDTZBEEV-YDFGSDHNSA-N 452.529 1.136 10 20 JDCD C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1807160455 SWCSHLSHVLUDJO-HZUJVAHNSA-N 498.634 1.843 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808238538 IMBDHUDPPFXRPX-PTLVVNQVSA-N 473.533 1.922 10 20 JDCD CN1CCN(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)CC1 1809604009 TYMOBJPUUGOAOL-HTAPYJJXSA-N 487.988 1.713 10 20 JDCD CCN(CC)C[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1812362708 CCEOASQPTPXAOZ-MDKPJZGXSA-N 491.683 1.926 10 20 JDCD Cc1n[nH]c(C)c1C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814189360 OVRZLRIDUZZILJ-KXBFYZLASA-N 472.596 1.601 10 20 JDCD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1816725913 RZABOJYGTICMRG-CYBMUJFWSA-N 492.517 1.968 10 20 JDCD Cn1c(=O)n(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)nc(O)c3)n[nH]2)c2ccccc21 1817845738 VQKNASDNCSRDAS-MRXNPFEDSA-N 491.508 1.875 10 20 JDCD Cn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)/C=C/c4ccc(O)c(O)c4O)sc3C2)n1 1828194891 AKDZJJYNRUAYHU-QDBLGGKGSA-N 455.496 1.933 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ccc[nH]1)CC2 1828242160 ATVWMWHDKQWPMJ-LBPRGKRZSA-N 463.610 1.876 10 20 JDCD CC[C@H](C)[C@@H](N)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828242676 RNDOTNUANBMLCA-FEUHOPSXSA-N 455.631 1.289 10 20 JDCD O=C(CSc1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1831290251 QAVOMHHXBHBBMW-QFIPXVFZSA-N 495.504 1.633 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(C(F)(F)F)CC1)CCO2 1832144896 HTBREZUMFPFXDX-UTKRZORCSA-N 487.475 1.932 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833572804 ORNJVAZWSLPWNI-NRFANRHFSA-N 496.879 1.231 10 20 JDCD CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)c1F 1833738688 JRSFEPAIIMPENM-NRFANRHFSA-N 482.896 1.560 10 20 JDCD C[C@@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1837232252 QIDBZBRKCOHGPF-SZNDQCEHSA-N 479.580 1.805 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839606812 SMGDUMQWVPPHBD-XMMPIXPASA-N 480.477 1.130 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)c(Cl)c1)CCO2 1840753848 OYGODFFUBGECCC-OAQYLSRUSA-N 483.855 1.808 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)CCN2Cc3ccccc3C2=O)C1 1843872537 QTCBLSHDIYOXAZ-UHFFFAOYSA-N 472.592 1.096 10 20 JDCD Cn1nccc1C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C1 1844251683 QXOQAKKHZZPMRM-KRWDZBQOSA-N 499.568 1.784 10 20 JDCD O=C1CSc2ncc(C(=O)N3CCCC34CN(C(=O)/C=C/c3ccc(O)c(O)c3O)C4)cc2N1 1845670661 KCKQARUUCMCXSC-HWKANZROSA-N 482.518 1.773 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCO2)C1 1846147190 DQCQUVKYDYGGQS-PXNSSMCTSA-N 489.569 1.916 10 20 JDCD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847037245 HTPBFGOOPWQEHI-JCOOBLOPSA-N 497.523 1.907 10 20 JDCD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN2C(=O)CSC2=S)cc1 1847777240 WFGBZECCWWWHNV-XSLAGTTESA-N 459.593 1.861 10 20 JDCD COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 1847948305 NRHIBFVYADBXNG-NHIVFGFISA-N 458.511 1.998 10 20 JDCD Cc1nnnn1-c1cc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1F 727946502 HCZAGBBVBDBVDQ-UHFFFAOYSA-N 457.441 1.340 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc4c(c3)OCCCO4)CC2)cc1 743432401 LNJWUNCYQIEOKH-UHFFFAOYSA-N 454.527 1.733 10 20 JDCD NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC1 749024962 RWCOEWWIFSKVKK-UHFFFAOYSA-N 483.544 1.619 10 20 JDCD CNC(=O)c1ccc(NC(=O)C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1 915743390 FMICDBHKDHJIHI-UHFFFAOYSA-N 453.543 1.322 10 20 JDCD O=S(=O)(NCc1ccc(N2CCSCC2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 917913439 BEWJVPVRQWZSBG-UHFFFAOYSA-N 497.664 1.739 10 20 JDCD Cn1nc(O)c2c(C(=O)NCc3ccc(N4CCS(=O)(=O)CC4)cc3)cc(C3CC3)nc21 918645053 POKPCLSODSLUSZ-UHFFFAOYSA-N 455.540 1.716 10 20 JDCD CS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1[N+](=O)[O-] 920014926 JHURBEBOEJNZOD-UHFFFAOYSA-N 453.498 1.485 10 20 JDCD C[C@@H](OC(=O)c1cn(CC(=O)N(C)C)nn1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 920641964 DTAGHWPZEOJCTQ-CYBMUJFWSA-N 475.461 1.326 10 20 JDCD COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920925076 HGYWQKNISDZENT-MRXNPFEDSA-N 490.582 1.598 10 20 JDCD COc1ccc(-n2c(C)cc(C(=O)OCC(=O)NC(=O)N[C@@H]3CCS(=O)(=O)C3)c2C)cc1 921176151 SNPSCPNHOZLPSP-OAHLLOKOSA-N 463.512 1.272 10 20 JDCD NC(=O)c1ccccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)c2)C1 1777852176 GYOOOELEGLLNFS-UZUQRXQVSA-N 454.483 1.033 10 20 JDCD COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cc(O)nc(O)c2)C3)C1 1782169336 OPTLOBKCRPZOAZ-PXYFHJBISA-N 475.542 1.600 10 20 JDCD CS(=O)(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1782716986 HNMORQHBWRRQRG-OXQOHEQNSA-N 474.963 1.313 10 20 JDCD O=C(CCc1ccccc1Cl)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538150 JTXKMFLRYHSCTJ-NRFANRHFSA-N 482.027 1.963 10 20 JDCD CC(C)COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)ccn1 1785541442 ZYNLQTOUANLIPN-JOCHJYFZSA-N 492.623 1.420 10 20 JDCD COc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)ccc(F)c1F 1785544866 BTFLGSLRKRFQSW-HXUWFJFHSA-N 485.534 1.277 10 20 JDCD CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cc3ccc(O)c(O)c3)NC(=O)OC(C)(C)C)C[C@@H]21 1786394828 MHUAFJSNCRMBFR-UGNRZPKXSA-N 491.585 1.923 10 20 JDCD CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)nc(O)c4)C[C@@H]32)cc1 1792004406 YZEGLPMVWJGODX-SNRMKQJTSA-N 454.483 1.358 10 20 JDCD COc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1792023821 HNXOEOYJDVRDPE-XEZPLFJOSA-N 498.026 1.802 10 20 JDCD Cc1cccc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792239787 MMROILNXZHSZKY-ULQDDVLXSA-N 461.609 1.757 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2)c1cc(O)c(O)c(Cl)c1 1799769610 ZUCCIMPBUOKDGQ-DRXBFXEBSA-N 483.855 1.825 10 20 JDCD CCS(=O)(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(O)nc(O)c2)C3)cc1 1801563455 ZADDYPGHZGWOPE-BCDXTJNWSA-N 473.551 1.781 10 20 JDCD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802079185 WOQHMFYXPPTRGZ-YHRQIVFBSA-N 491.541 1.319 10 20 JDCD C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S)c1ccccc1 1802106644 IFMIXPSSSRQHRJ-RACNMONISA-N 461.609 1.630 10 20 JDCD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2c2cccnc2)n(C)n1 1807990614 IRXGLQVQXKNCKV-VBKZILBWSA-N 452.471 1.263 10 20 JDCD 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O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1 1814188849 BVRRTMGIXXKYEV-VBKZILBWSA-N 495.590 1.533 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1Cc3ccccc3CN1)CC2)c1cc(O)nc(O)c1 1816724769 HAJGATYRXLTJFP-WBVHZDCISA-N 465.535 1.890 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(=O)oc2)[nH]n1 1823495838 CUFCFAGMIQIASV-CYBMUJFWSA-N 461.525 1.529 10 20 JDCD CN[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1)C(=O)O 1826940455 HJEVZDTYFLDFLG-LEWJYISDSA-N 483.569 1.462 10 20 JDCD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)CC2)n[nH]1 1832902759 UFOMMLVFPPVOHR-QGZVFWFLSA-N 463.629 1.741 10 20 JDCD Cc1ncc(CC(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1834988399 NNEHRPUSUKQACB-UHFFFAOYSA-N 459.572 1.686 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1 1836941755 SBRRVYMXVODGKV-DUXPYHPUSA-N 484.509 1.625 10 20 JDCD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)o1 1837453648 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COc1cc(C(=O)N2CCCC23CN(C(=O)CN2C(=O)CSC2=S)C3)cc([N+](=O)[O-])c1OC 1845552612 HLPOVGNOJUMMKO-UHFFFAOYSA-N 494.551 1.289 10 20 JDCD CCSc1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)CSC1=S 1847195757 GRUIUQPRGKWPIO-KBPBESRZSA-N 450.611 1.869 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(c2ccccc2)C(=O)C1 1847955075 MFKGPBMKQDUACU-SLFFLAALSA-N 481.553 1.991 10 20 JDCD COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C)c3=O)c2C)c1 17180370 PDPUNFXYVMREJJ-UHFFFAOYSA-N 477.477 1.994 10 20 JDCD CS(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3cccc(-n4cnnn4)c3)n2)cc1 727245285 ZMHRZAWEBVNLAS-UHFFFAOYSA-N 462.538 1.990 10 20 JDCD O=C(COC(=O)CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(N2CCOCC2)c(F)c1 917990875 MYKJTAWJEBJIDK-UHFFFAOYSA-N 465.428 1.530 10 20 JDCD O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 918080713 GFSNMYNRTJVJDU-UHFFFAOYSA-N 487.557 1.639 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(S(=O)(=O)NC4CC4)cc3)nc12 918899218 FWPDVYZHQZALLE-UHFFFAOYSA-N 460.468 1.409 10 20 JDCD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 919698237 YFHDGVFCTFZGNP-PTRHGPIFSA-N 490.539 1.366 10 20 JDCD C[C@@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N(C)C[C@H]1COc2ccccc2O1 920636008 NXRRQDZESBLVAH-HIFRSBDPSA-N 464.496 1.607 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2)c1cc(O)nc(O)c1 1777849395 VGRDFVKITDOFGU-UMEGOILYSA-N 480.521 1.814 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cncnc1)C2)C1=NN(c2ccccc2)C(=O)C1 1778126460 XATWWXJNKAQOSV-PXDATVDWSA-N 476.537 1.326 10 20 JDCD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)c(O)c(Cl)c4)CCO3)C2)n1 1779237148 QUSVLLDGNZZEEQ-QHCPKHFHSA-N 490.944 1.495 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)OCO3)CCO2 1785505412 HIQKBNRRACKHLK-FBUBFAHDSA-N 468.462 1.689 10 20 JDCD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1O 1785510062 LPNPUYUBBRPVNM-OGPASDKVSA-N 497.504 1.624 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2 1785541705 YTWKBZKYRVNGHI-GOSISDBHSA-N 454.961 1.039 10 20 JDCD O=C(CC1CCOCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1786740383 XYPOQYRTWXMHFD-MJBGSXMXSA-N 460.527 1.613 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)c1cccc(F)c1 1789517968 NYQKZQARABXJBY-BPUTZDHNSA-N 451.545 1.279 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790242895 ALJCRFJCSDCDDJ-YLVFBTJISA-N 479.877 1.149 10 20 JDCD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1)n1cccc1C=O 1792218405 ALFHETFLVAQNOO-GTTWDHLJSA-N 483.521 1.672 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21 1792221372 SRHGREFIZOIBBX-GMHLOAMTSA-N 486.496 1.742 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)c1cc(O)nc(O)c1 1796137005 RUIAGSMJICTFKT-MFKICJERSA-N 481.465 1.259 10 20 JDCD N[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1cccnc1 1796931724 GBVAVAFSXNVMMR-NRDMVMEKSA-N 460.538 1.903 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1ccn(C(F)F)n1 1798165178 LHYMHLRFIPVRRE-ZAHULMEISA-N 464.425 1.312 10 20 JDCD CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN2C(=O)CSC2=S)C3)ccc1C 1799716491 WJOSXIHYXWGDBG-CWPLJXCYSA-N 490.607 1.017 10 20 JDCD CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)c(O)c(Cl)c2)nn1 1799769379 ZKIUDQPTZBMRHJ-FVCICTRLSA-N 463.922 1.615 10 20 JDCD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC2(CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)C1 1806931778 CINGCFLOBGFVSD-UHFFFAOYSA-N 493.524 1.815 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809114815 YYQRKEYPNAPAFG-QMHKHESXSA-N 488.504 1.890 10 20 JDCD CC(C)(C)OC(=O)CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814186249 YSJDBHBVAGWSJF-MGPUTAFESA-N 492.623 1.680 10 20 JDCD O=C(CCn1cncn1)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817366709 BGQOLSMEFHSXNZ-CQSZACIVSA-N 478.538 1.530 10 20 JDCD CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN2C(=O)CSC2=S)CC3)nn1 1821760210 BOVMXKYRXZDPDW-SNVBAGLBSA-N 492.608 1.418 10 20 JDCD Cn1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cccc1=O 1823495871 DJKBNDNMDVKHTG-ZDUSSCGKSA-N 474.568 1.275 10 20 JDCD CC(C)(C)[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823496560 KFUPGJGJQXKBKA-MLGOLLRUSA-N 453.590 1.669 10 20 JDCD Cc1nnsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823497622 GDURFFJXTBCGNG-NSHDSACASA-N 465.586 1.736 10 20 JDCD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)nc2nccn12 1824114955 BGWLHOACHBFRLZ-LBPRGKRZSA-N 465.495 1.840 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1CCN(c3ccccc3)CC1)CCO2 1830614281 YOEONHKSPJREBM-SANMLTNESA-N 496.564 1.479 10 20 JDCD CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1832396205 DDWWXJNIWXCUIZ-OAQYLSRUSA-N 488.610 1.834 10 20 JDCD O=C(c1cncc(O)c1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900691 XNGQKUSGPOOQLO-QGZVFWFLSA-N 462.597 1.881 10 20 JDCD Cc1cc[nH]c1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1833551024 LUABGSXYVCUTHY-OJZQOFKYSA-N 457.483 1.223 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)CCc3ccccn3)CC2)CC1)c1cc(O)nc(O)c1 1834985939 RLSHSFULDVCEMB-UHFFFAOYSA-N 453.543 1.706 10 20 JDCD O=C(CCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1835321818 MJJMWHRTTNGZTC-NRFANRHFSA-N 482.459 1.578 10 20 JDCD Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031703 FVRVWXCBFCZNKZ-UHFFFAOYSA-N 471.558 1.698 10 20 JDCD C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840469772 WKOKKRGSVVDEKP-NIYFSFCBSA-N 494.548 1.708 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840544311 AVUBVOYHQSTUHG-PZPSAWLHSA-N 481.640 1.274 10 20 JDCD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1)c1ccccc1 1840895322 PAWXFQFHUCEFLZ-KSFYIVLOSA-N 477.608 1.107 10 20 JDCD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1846341443 WTGVGERXOABYTN-MOPGFXCFSA-N 464.522 1.738 10 20 JDCD O=C1CSC(=S)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1 1848247376 WOOWSLRJYZRQBE-OALUTQOASA-N 487.651 1.356 10 20 JDCD CCN(CC)S(=O)(=O)c1c(C)nn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)c1C 105032446 CQTMLPRQZVIKLI-UHFFFAOYSA-N 463.604 1.888 10 20 JDCD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc(F)cc1 725948340 BXSDEVKLTZJTMB-SFTDATJTSA-N 457.502 1.669 10 20 JDCD CCN1CCN(C(=O)c2ccc(NC(=O)C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)CC1 744907641 HVIBXKCVQAXQOE-UHFFFAOYSA-N 479.581 1.556 10 20 JDCD COc1ccc(Cc2nnc(SCC(=O)NCc3ccc(N4CCOCC4)c(F)c3)n2N)cc1 917163059 ALYXVYWNVBYVGM-UHFFFAOYSA-N 486.573 1.976 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C1 917831994 FPBGIXDYKBNWCV-SFHVURJKSA-N 453.499 1.733 10 20 JDCD O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 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O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C3CC3)on1)CCO2 1830196961 QKUHYLJNIQAEKV-VWLOTQADSA-N 493.520 1.415 10 20 JDCD O=C(Cc1ncccn1)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1833875113 HYGBHISAPSIYDU-UHFFFAOYSA-N 489.580 1.384 10 20 JDCD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)c(O)c(Cl)c4)C3)C2)cn1 1833997850 BELQADLZFYXRNC-QFIPXVFZSA-N 461.902 1.838 10 20 JDCD Cc1nocc1C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1 1834250327 JFSDYFUOLIPGIT-HWKANZROSA-N 470.526 1.998 10 20 JDCD O=C1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)CC2)N1 1834590027 AVUBKXNTAHWLDL-QGZVFWFLSA-N 464.950 1.215 10 20 JDCD Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)c4cc(O)nc(O)c4)CC3)CC2)s1 1834852897 QNSQIZTVSJMPGN-UHFFFAOYSA-N 460.560 1.081 10 20 JDCD Cc1ccn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cc(O)c(O)c(Cl)c2)CCO3)n1 1839432609 RUNQONZQQDMGJA-NRFANRHFSA-N 464.906 1.026 10 20 JDCD COc1ccc(Cl)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839790357 OYPFBPYREXAWSV-QHCPKHFHSA-N 491.928 1.468 10 20 JDCD C[C@@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)C3)C2)CC=CCC1 1840555343 BJIMHJWLJIYTKK-CLJLJLNGSA-N 480.565 1.982 10 20 JDCD COCc1c[nH]c(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1840881092 BXEYSVMMAPBZSO-ISTCRNMPSA-N 487.509 1.061 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1 1843457203 QJYRPBZUGXXMHD-UHFFFAOYSA-N 451.527 1.657 10 20 JDCD O=C(OCCO)c1ccccc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844719061 YAOKPCOHDPUAIR-UHFFFAOYSA-N 490.516 1.446 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC2(CCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1 1845076285 DVGZMOFBBSCILW-ACISRZNPSA-N 455.511 1.421 10 20 JDCD CC(C)(C)OC(=O)NC12CC(C(=O)N3CCCC34CN(C(=O)CN3C(=O)CSC3=S)C4)(C1)C2 1846110349 SEXBKJQRDXBVOB-UHFFFAOYSA-N 494.639 1.498 10 20 JDCD O=C(c1cc(-c2ccncc2)[nH]n1)N1CC2(CCCN2C(=O)CN2C(=O)CSC2=S)C1 1847055577 HUMRLUPUSLWQHO-UHFFFAOYSA-N 456.553 1.149 10 20 JDCD CCNc1nc(NCC)n2c(SCC(=O)N3CCN(CCc4cccs4)CC3)nnc2n1 108889006 NHHBGBGNQCGITQ-UHFFFAOYSA-N 475.648 1.923 10 20 JDCD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 727599704 ATMDSKJFLPNHSJ-APWZRJJASA-N 473.599 1.857 10 20 JDCD COc1ccc(N2CCN(C(=O)C[S@@](=O)Cc3nnnn3Cc3ccccc3)CC2)cc1 914523934 SRYGIGIQTKWISJ-YTTGMZPUSA-N 454.556 1.328 10 20 JDCD COCCN1C[C@@H](C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1=O 914659586 DALQEFNDUHMJCS-GJZGRUSLSA-N 464.474 1.827 10 20 JDCD COc1ccc(N2CCCN(C(=O)C(=O)Nc3ccc(NC(=O)CN4CCOCC4)cc3)CC2)cc1 918461479 DZKYAANOWGVQIA-UHFFFAOYSA-N 495.580 1.643 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2)c1cc(O)nc(O)c1 1777848181 MLAGDNCIGOYTST-VGOFRKELSA-N 452.471 1.205 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1cc2cn[nH]c2cn1 1779197538 KCZLVCQCNDDJSZ-KSCMVAJDSA-N 493.520 1.916 10 20 JDCD CCn1nc(C(=O)N2CC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)cc1C 1779715964 XNWVSOBXZSCATQ-XMMPIXPASA-N 464.526 1.448 10 20 JDCD 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488.513 1.164 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2 1802079621 MXDHAQRULIXCBR-QUKZKKHZSA-N 454.479 1.355 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)C1CC(F)(F)C1 1802639128 TWRGJQZBECFARO-GUYCJALGSA-N 468.551 1.993 10 20 JDCD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)[C@H]1c1cccnc1 1804095165 ZTZSCWKJINMJBB-DJJJIMSYSA-N 487.900 1.018 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCC2(CCCN(C(=O)C(O)O)C2)CC1 1805278147 RFSZTRFKKQORHG-LJQANCHMSA-N 490.601 1.247 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)Cn2cccn2)[C@H]1c1cccnc1 1814163702 IMEKPRVDGPGPST-DPLQINJDSA-N 463.494 1.814 10 20 JDCD N[C@H](CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1)c1cccnc1 1814185254 AMVOYAARPXBMCB-NJNPRVFISA-N 498.634 1.433 10 20 JDCD CN(C)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1814546726 KTYGQQCNBVSBJH-CQSZACIVSA-N 454.556 1.800 10 20 JDCD 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CC(C)(C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1833284360 DWKFYEXBOCEORN-HSZRJFAPSA-N 483.613 1.758 10 20 JDCD COc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1836237289 HDFNKUQODWMNEV-UHFFFAOYSA-N 490.651 1.741 10 20 JDCD O=C1CCc2ccc(C(=O)N3CCC(OC4CCN(C(=O)c5cc(O)nc(O)c5)CC4)CC3)nc2N1 1838021819 QKKAKWVCXAJCJD-UHFFFAOYSA-N 495.536 1.699 10 20 JDCD Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1838110555 WYQMRNJKKOMZFR-UHFFFAOYSA-N 492.580 1.983 10 20 JDCD Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840650375 BBBLNPIICCJHPM-SANMLTNESA-N 494.523 1.997 10 20 JDCD CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)no1 1840880551 VOSYKQOMKOWPEC-WUQPGSQJSA-N 487.509 1.698 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843440798 BDGMJAWMMHWXJA-SFHVURJKSA-N 499.568 1.258 10 20 JDCD NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2cccc3c2C(=O)c2ccccc2C3=O)c1 10876315 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COc1ccc(N2CCN(CCCNC(=O)N3CCN(CC(=O)N4CCCC4)CC3)CC2)cc1 916198979 TVJOYPMQDOMJBO-UHFFFAOYSA-N 472.634 1.157 10 20 JDCD Cn1cc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc2)cn1 917726669 JMJSSUMULPYHQS-UHFFFAOYSA-N 450.498 1.793 10 20 JDCD CC(C)N1C(=O)c2ccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2S1(=O)=O 917832160 LPKAXHBRAORDKN-GOSISDBHSA-N 484.578 1.871 10 20 JDCD CNS(=O)(=O)c1cccc(C(=O)OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 918843611 NOUPBIIQBXWLLK-HOTGVXAUSA-N 493.557 1.821 10 20 JDCD Cc1cc(=O)c(C(=O)OCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1-c1ccccc1 918912825 JRJKIONBDHANRU-UHFFFAOYSA-N 480.496 1.990 10 20 JDCD CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)c1 919878592 SEODXQKDSQMNCI-UHFFFAOYSA-N 457.961 1.735 10 20 JDCD COCCN1C(=O)/C(=C/Nc2ccccc2S(=O)(=O)N(C)C2CCCCC2)C(=O)NC1=S 920978440 BAXQXHZZOSNERR-JQIJEIRASA-N 480.612 1.825 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)Cn3nc4n(c3=O)CCCCC4)cc2F)C[C@@H](C)O1 1317948746 GDCGDWOWZFOEGG-CALCHBBNSA-N 489.548 1.384 10 20 JDCD Cc1ccn2c(=O)c(C(=O)N3CC[C@]4(CN(C(=O)c5cc(O)c(O)c(Cl)c5)CCO4)C3)cnc2c1 1777994998 FASFJQQCWFYZPC-XMMPIXPASA-N 498.923 1.825 10 20 JDCD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1778126625 FZMHDHBRQLFCHV-DZRGJMJISA-N 483.569 1.208 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1779357317 BMDXUWNNDSVFLW-DEOSSOPVSA-N 499.474 1.480 10 20 JDCD C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783246399 SDCMJGSAVHUNBU-ZDPZECHZSA-N 491.639 1.256 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nonc3c1)C2 1783247976 LMPURTFTGFAMED-IIBYNOLFSA-N 489.579 1.211 10 20 JDCD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1783398840 AHTLYWJEGYRFGK-OAQYLSRUSA-N 469.922 1.719 10 20 JDCD Cc1c(F)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1783738211 OEOZHESDDPGTAB-QRTARXTBSA-N 465.572 1.588 10 20 JDCD 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478.933 1.106 10 20 JDCD C[C@@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834986982 OYEDRBGIDOSVEG-CQSZACIVSA-N 474.587 1.635 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1ncn(-c2ccccc2)n1 1835155635 BURNUMXYCFZRRG-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1)c1ccc(O)cc1 1836418910 FZDBFTRWDZLJAG-WNSKOXEYSA-N 457.483 1.072 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2 1839923693 SVPRPYMZBUIRIO-ROVVAWJSSA-N 495.743 1.643 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC2(CCCN2C(=O)CCOc2ccc(F)cc2)C1 1841195968 NFJOCWBNLLADAJ-UHFFFAOYSA-N 451.545 1.658 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CCCC12CN(C(=O)c1cc[n+]([O-])cc1)C2 1843331366 QJIJJIMCWZCONI-OAQYLSRUSA-N 495.580 1.855 10 20 JDCD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1 743869232 LIIRRSDVDQLTNR-UHFFFAOYSA-N 480.546 1.175 10 20 JDCD O=C1CN(S(=O)(=O)c2cccc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2)CCN1 917386748 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CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1829076822 RIKNRWDEPFMDAA-NVXWUHKLSA-N 482.672 1.771 10 20 JDCD O=C(CCN1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832900158 JBVQWHJZDFYWQT-SFHVURJKSA-N 466.673 1.952 10 20 JDCD Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)CC3)CC2)cn1 1834194458 BHOACUDXPPTGNI-UHFFFAOYSA-N 461.950 1.984 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1)c1cc[nH]c2nccc1-2 1835010745 KYTSWURBPHXSHC-UHFFFAOYSA-N 464.526 1.820 10 20 JDCD O=C(c1ccc2cnccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2 1836418230 IIYKRWPNPJXHLK-XMMPIXPASA-N 464.478 1.425 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1 1836418943 ISKRTFPREPAHSG-JOCHJYFZSA-N 454.439 1.018 10 20 JDCD N=C(N)SCC(=O)N1CCC(OC2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1837826765 AXVUUWMOBHSVRP-UHFFFAOYSA-N 486.598 1.405 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)c(Cl)c1)CCO2 1837915440 GYXYCQIZVPCTGT-FQEVSTJZSA-N 483.308 1.578 10 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O=C(COC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 845936686 MSQBKHGGIWLHNG-HCIHMXRSSA-N 484.464 1.751 10 20 JDCD COc1ccc(N2CCN(C(=O)CNS(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)cc1 872084144 PNLIQEMACWUMFX-UHFFFAOYSA-N 461.540 1.484 10 20 JDCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 915779082 WPQKAIPGCRJDPC-UHFFFAOYSA-N 472.567 1.563 10 20 JDCD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2=O)cc1 919971139 QJGPVLQGCXMXBW-VWLOTQADSA-N 484.528 1.879 10 20 JDCD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2 920637930 ONGXVVBLTRQSHF-OLZOCXBDSA-N 464.496 1.958 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc2c(c1)COC2 1778640155 RCSCSFUIHOOSKL-NTKDMRAZSA-N 453.495 1.964 10 20 JDCD CCn1nc(C(=O)N2CC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)cc1C 1779723617 VDOCCJMJNHBMHG-NKOINVLESA-N 456.499 1.485 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1780364372 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O=C(CNC(=O)c1cccnc1)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804366200 KTQNHRKVYUOPTE-ZHRRBRCNSA-N 476.493 1.032 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1)[C@H]1CCOC1 1813552969 BPBOURUWXZRYGU-SFYKDHMMSA-N 461.522 1.917 10 20 JDCD CS(=O)(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1814165427 FZGHWEWEOJHUBI-PQGDUDRBSA-N 489.550 1.352 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)c2ncccc2F)[C@@H]1c1cccnc1 1814189834 IERSBHPLFSKBGF-IFXJQAMLSA-N 473.555 1.796 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814648000 UCZNMRSURCFHFO-OYLQIYHASA-N 488.566 1.608 10 20 JDCD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)C2=NN(c4ccccc4)C(=O)C2)CC3)o1 1815487777 PRTVARGWMUKPIK-CYBMUJFWSA-N 479.522 1.782 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cc(=O)cco1 1816652159 PZGBQHCXBHTEFE-CYBMUJFWSA-N 461.525 1.529 10 20 JDCD N[C@@H](Cc1cccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1818074131 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453.480 1.989 10 20 JDCD CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cc(O)nc(O)c2)CC3)nn1 1821631733 MPSGUHPAWXATTB-NSHDSACASA-N 457.516 1.835 10 20 JDCD O=C(CCn1ccnn1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)[nH]n1 1822811538 VMQVQOUNXWGGGU-YERXGYGTSA-N 467.486 1.914 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2)[nH]n1 1823496061 CIJZUCFFOWWXOI-AWEZNQCLSA-N 450.590 1.358 10 20 JDCD CCOc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)cn1 1823496794 QAGWJOSGPZWYKB-AWEZNQCLSA-N 489.583 1.765 10 20 JDCD O=C(O)c1cnncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827428516 SSYOTNVJWBYNMK-QGZVFWFLSA-N 455.471 1.528 10 20 JDCD CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1827708730 IEADHCBOYVPTQV-MRXNPFEDSA-N 468.645 1.239 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cn1)CC2 1828242202 DIUHDPXUMDKPKQ-VIFPVBQESA-N 463.566 1.330 10 20 JDCD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)CC2)nn1C 1834171692 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C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1)n1cccc1 1828250023 NERYSXMSWZCQDP-VXGBXAGGSA-N 463.610 1.978 10 20 JDCD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1828887810 IVBDHUOJPVDMLI-QHCPKHFHSA-N 454.483 1.578 10 20 JDCD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)cn2[nH]cnc(=O)c12 1829596495 MHCCNDLIWBYIOO-SFHVURJKSA-N 480.525 1.684 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1F)CCO2 1831917317 CCNWEEAPGRMKBW-HSZRJFAPSA-N 486.525 1.750 10 20 JDCD COC(=O)CSCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896999 YQGHJVGMVNXORE-OAHLLOKOSA-N 487.669 1.373 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)c3ncn(-c4ccccc4)n3)CC2)CC1)c1cc(O)nc(O)c1 1834986971 NZKOQKPPNZTVHL-UHFFFAOYSA-N 491.552 1.573 10 20 JDCD O=C(CC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1835335821 PDYBYKVVZKQARC-KRWDZBQOSA-N 452.813 1.774 10 20 JDCD CCC1(C(=O)N2CCOC[C@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)CCC1 1836526409 ROEYYBMNDDQTCC-VWLOTQADSA-N 468.554 1.816 10 20 JDCD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1)n1ccccc1=O 1837691108 HCAGEXYOZFOWBY-CMJOXMDJSA-N 491.928 1.244 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCOC3)C2)C1 1839435497 LFWSGLFTMIOPRU-SZNDQCEHSA-N 454.907 1.248 10 20 JDCD COc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)/C=C/c2ccc(O)c(O)c2O)C3)n1 1843587121 YXYSMSZRKYGRPC-XBXARRHUSA-N 470.438 1.646 10 20 JDCD CC(C)(C)OC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)CN3C(=O)CSC3=S)C2)CC1 1847057085 GSJXJLQXEJGPRW-UHFFFAOYSA-N 496.655 1.697 10 20 JDCD CN(C)c1ccc(CNC(=O)COc2ccc(S(=O)(=O)N3CCCC3)cc2C(N)=O)cc1 19042220 GXQLHXVYVHZUMW-UHFFFAOYSA-N 460.556 1.331 10 20 JDCD O=C(O)[C@@H]1CCCN(S(=O)(=O)c2ccc(NS(=O)(=O)c3cccc4nsnc34)cc2)C1 520077384 QKMVNVGHUORJJC-GFCCVEGCSA-N 482.565 1.977 10 20 JDCD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(=O)Nc1ccc(N2CCC(C(N)=O)CC2)cc1 749027292 JJXHSEXJWVYJPF-UHFFFAOYSA-N 479.581 1.822 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)CC2)cc1 775505725 YCLGTSWOYOQONP-FQEVSTJZSA-N 451.523 1.936 10 20 JDCD Cn1cc(S(=O)(=O)Nc2sc3c(c2C(=O)NC[C@H]2CCCO2)CCCC3)cc1C(N)=O 914564608 UPQMVESGNKBPTN-GFCCVEGCSA-N 466.585 1.774 10 20 JDCD C[C@H]1CN(c2ccc(CNS(=O)(=O)c3ccc(S(N)(=O)=O)cc3)cc2F)C[C@@H](C)O1 917919304 ZFFVLOXHECFDEA-OKILXGFUSA-N 457.549 1.565 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(C(=O)COc4ccc(F)cc4)CC3)cc2)C1 918117476 LLDRINPQORVDNP-FQEVSTJZSA-N 497.571 1.960 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)N3CCCC[C@H]3CCNS(C)(=O)=O)CC2)cc1 918198575 VBJOUIJCDLOEIG-NRFANRHFSA-N 481.663 1.711 10 20 JDCD O=C(COC(=O)CCn1cnc2ccccc2c1=O)NCc1ccc(N2CCOCC2)c(F)c1 918921458 PPONPOQZKMHSKC-UHFFFAOYSA-N 468.485 1.622 10 20 JDCD C[C@H](OC(=O)c1cc(NS(C)(=O)=O)ccc1O)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 920637937 ONGXVVBLTRQSHF-STQMWFEESA-N 464.496 1.958 10 20 JDCD CN(C)S(=O)(=O)c1cccc(NC(=S)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1 920995171 UXRMZMSAHBVSPP-UHFFFAOYSA-N 482.653 1.658 10 20 JDCD C[C@@H]1CN(C(=O)Cn2c(=CC(=O)C3CC3)sc(=Cc3ccc(N4CCCC4)cc3)c2=O)C[C@@H](C)O1 1321783736 PFWSLIKRPKLUCU-RTBURBONSA-N 495.645 1.734 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccc3[nH]1)C2)c1cc(O)nc(O)c1 1777847917 DEFXHSPQBXQLBK-UZUQRXQVSA-N 451.483 1.810 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1 1778175764 SAUVSKPXNIXJRC-VGOFRKELSA-N 488.591 1.194 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1778411245 CMMWINZXZWPIIY-DEOSSOPVSA-N 473.493 1.194 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@]2(CCN(C(=O)c3cn4c(C(F)(F)F)cccc4n3)C2)C1 1782213002 YHVWQCADTKJWMQ-NRFANRHFSA-N 491.426 1.917 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cc(O)nc(O)c2)CCO3)C1 1784150833 ZMQXYIRQCJJQFR-VOIUYBSRSA-N 490.557 1.583 10 20 JDCD CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)cc1C 1785508119 YDBRTRXWEBFUJK-BVBLWJPBSA-N 456.499 1.485 10 20 JDCD O=C(Cc1ccccc1F)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538843 ZXMHWYDVXAKCOF-HXUWFJFHSA-N 451.545 1.058 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1785539827 CZHCGFYODQHZND-MRXNPFEDSA-N 494.542 1.466 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCO2 1785545281 MUYVNGPAAAORIZ-LJQANCHMSA-N 482.515 1.038 10 20 JDCD Cc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CN4C(=O)CSC4=S)C3)C2)cc1 1785547217 UGZLEEGIVPOMFQ-OPAMFIHVSA-N 461.609 1.789 10 20 JDCD Cc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cc(O)c(O)c(Cl)c4)C[C@@H]32)c1F 1785777787 VVIGNDLRKNKUOM-RBOXIYTFSA-N 466.897 1.839 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1cccc2nccn12 1790417166 VRCQYMMWSBJMDG-SBTJSFKZSA-N 478.505 1.758 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21 1792218329 YLHMVDIQDMOYAR-RFYUIMKKSA-N 494.544 1.974 10 20 JDCD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN4C(=O)CSC4=S)[C@H]3C2)cc1F 1792240225 ZJDUCQFWDWUJJQ-ZOBUZTSGSA-N 465.572 1.588 10 20 JDCD CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2)C(C)(C)C 1793377895 AEWQCTCXXSTGGL-ITBLURSFSA-N 467.570 1.968 10 20 JDCD CC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)c1ccccc1 1795078988 JJWWDVAASISFCR-CLWJZODNSA-N 461.609 1.630 10 20 JDCD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc(O)nc(O)c2)c(OC)c1 1796140866 BNQHXWBZDIDALA-GPVSGQMNSA-N 471.510 1.346 10 20 JDCD COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(c2ccccc2)C(=O)C1 1796479123 GXOUXRMAXMJEDU-USGNIVHTSA-N 497.939 1.740 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccc3[nH]1)C2)C1=NN(c2ccccc2)C(=O)C1 1796481230 VYUVYMQMEVKWQZ-RSQQPWMTSA-N 472.505 1.559 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)c1ccc(OCC2CC2)cc1F 1799420363 KYWIGNYMTZDHIW-MFKICJERSA-N 471.485 1.938 10 20 JDCD C[C@@H](NNc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799767018 MTEVLHCGTXJVLR-BCEDRHLLSA-N 474.945 1.960 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2 1802080229 OAOYOLGHSYPISU-ZBTCFNCUSA-N 454.479 1.140 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)cc1F)C2 1802107098 JSISSDRUKLLFGT-PCCFMPIBSA-N 473.498 1.167 10 20 JDCD O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1804417500 BETXNYBKHITHEB-XOBRGWDASA-N 467.442 1.012 10 20 JDCD CC[C@H](NC)C(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)[C@@H]1c1cccnc1 1807348826 BLGMPQZWXCAXCL-OEFUUFEASA-N 454.527 1.916 10 20 JDCD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807996642 XXHJACJKXZYDFT-QMHKHESXSA-N 488.504 1.890 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)Cn2ccnc2)[C@H]1c1cccnc1 1814162026 FHSVJDXRJJUUHX-AKVVTYHKSA-N 463.494 1.814 10 20 JDCD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1 1816729964 XIPFXWGMPSRKOU-GXSJLCMTSA-N 450.473 1.737 10 20 JDCD CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817367074 QYLFEGYEFIWSSO-DYVFJYSZSA-N 487.607 1.962 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1[nH]nc2ncccc12 1817917698 ZWSVBVOEBXATTB-CYBMUJFWSA-N 484.567 1.847 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1nc2ncccn2n1 1818621267 BZORMARMTKKREO-GFCCVEGCSA-N 485.555 1.014 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1c(O)cc(O)cc1O 1821195871 PXFZJDBVWZXVIF-GFCCVEGCSA-N 491.551 1.693 10 20 JDCD CCOc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CN3C(=O)CSC3=S)n[nH]2)nn1 1823499903 DYTPTJRALPLPQY-CQSZACIVSA-N 489.583 1.765 10 20 JDCD Cc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1824715748 URDLRFXYGDZYNA-KRWDZBQOSA-N 463.629 1.822 10 20 JDCD CC[C@@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)CC1 1827716383 JNAFCDFSJTZSDL-CTNGQTDRSA-N 482.585 1.846 10 20 JDCD O=C(CN1C(=O)CSC1=S)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ccccc3n1)CC2 1828244413 GDAOLTMBHADEJN-LLVKDONJSA-N 486.604 1.877 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2 1835026981 GEFNCDJBGKETMK-NHDFZSDJSA-N 486.496 1.655 10 20 JDCD Cc1nccnc1C(=O)N1CCC(N2CCC(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1 1835132690 DNCTWQJGRWPPEA-UHFFFAOYSA-N 489.580 1.763 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CSC(=N)N)CCO3)C2)cc1 1835513879 MJOIBRVUYVTLAL-DEOSSOPVSA-N 485.610 1.791 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)c1cccnn1 1835893643 KZIVSFDFKMAMMU-UHFFFAOYSA-N 475.553 1.455 10 20 JDCD CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1)c1ccccc1 1836418017 UYKQAPFTIQDRQT-CYFREDJKSA-N 455.511 1.757 10 20 JDCD Cc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cc(O)nc(O)c3)CCO4)ccc2n1 1836418419 SWNIIUNVFRXHJE-RUZDIDTESA-N 478.505 1.733 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccncc1O)CCO2 1837820387 URFWHRMLUAZKRK-OAQYLSRUSA-N 463.874 1.236 10 20 JDCD 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Cn1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)CN3C(=O)CSC3=S)[nH]n2)n1 1817563063 ORRHYTAWENHWIO-CQSZACIVSA-N 461.573 1.238 10 20 JDCD C[C@@H](Cn1cncn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1819545012 HKFBZFPRMJMOAD-JSGCOSHPSA-N 476.588 1.190 10 20 JDCD O=C(N[C@@H]1CCc2nc(NC(=O)c3ncon3)sc2C1)C1=NN(c2ccccc2)C(=O)C1 1821023209 XHKDLNMWMWRIKD-LLVKDONJSA-N 451.468 1.545 10 20 JDCD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cc(O)nc(O)c2)CC3)nc2nccn12 1824114952 BGWLHOACHBFRLZ-GFCCVEGCSA-N 465.495 1.840 10 20 JDCD O=C(CCc1cnccn1)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1826913383 ANTXJRULTZZZEC-NSHDSACASA-N 476.609 1.338 10 20 JDCD N[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1)c1cccnc1 1826993332 ZKPOCSCVCXAAHO-RTBURBONSA-N 489.667 1.952 10 20 JDCD NC(=O)[C@@H](N)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)c(O)c(Cl)c2)CC1 1830736796 JQRSPUVCEYIZQB-IRXDYDNUSA-N 466.966 1.577 10 20 JDCD O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1832602715 GCBJLJUCUXHQRP-FQEVSTJZSA-N 467.931 1.520 10 20 JDCD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4cc(O)nc(O)c4)CC3)CC2)C1 1834988181 IQULAHKATKKBGS-DLBZAZTESA-N 488.585 1.657 10 20 JDCD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)c1ccnnc1O 1836063657 CCNFMXQDSCHKFB-UHFFFAOYSA-N 491.552 1.160 10 20 JDCD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1 1836525912 DBCHXPXYYMPWEM-QHCPKHFHSA-N 486.912 1.796 10 20 JDCD Cn1ccc(C(=O)N2CCCC23CN(C(=O)[C@@H](Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)C3)n1 1842467376 NZPFYBBBMSQNKV-GOSISDBHSA-N 499.568 1.784 10 20 JDCD Cc1nn[nH]c1C(=O)N1CC2(CCCN2C(=O)[C@@H](Cc2ccc(N)cc2)NC(=O)OC(C)(C)C)C1 1843331254 BNKOSAPCCZETOJ-GOSISDBHSA-N 483.573 1.648 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CCCC12CN(C(=O)Cn1cccn1)C2 1844251762 VIWHGKZZTSRCHY-GOSISDBHSA-N 499.568 1.634 10 20 JDCD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2)[S@](=O)c1ccccc1 1845780652 NYIAZMLIAKXWJG-KJEZJMDVSA-N 465.622 1.246 10 20 JDCD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1847552708 CJMQEEKTYIYFGT-JSJNYSNDSA-N 452.511 1.570 10 20 JDCD COc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1-n1nnnc1C 726719883 LSZLHPBOPHGIEQ-UHFFFAOYSA-N 483.504 1.334 10 20 JDCD COc1ccc(N2CCN(C(=O)CN3CCN(CC(=O)N4C[C@H](C)C[C@@H](C)C4)CC3)CC2)cc1 741788484 UWHUPTXBGOGROP-FGZHOGPDSA-N 471.646 1.466 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)CN3C(=O)CCOc4ccccc43)CC2)cc1 749681842 MQJGONREPJEFOH-UHFFFAOYSA-N 453.495 1.703 10 20 JDCD Cc1cc(C(=O)COC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c(C)n1-c1ccccc1 914656916 VFLYZWHJEFGZCO-HKUYNNGSSA-N 458.536 1.856 10 20 JDCD Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)C2=O)cc1 917833804 TYBJHXNCTCYIFO-AFMDSPMNSA-N 477.565 1.780 10 20 JDCD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3nc(CN4CCOCC4)cs3)cc2)C1 918028060 HQRZNGPYLABLDW-KRWDZBQOSA-N 458.588 1.999 10 20 JDCD CCCS(=O)(=O)NC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)CC1 918123482 XPFRDEVJEPTVGS-SFHVURJKSA-N 465.620 1.392 10 20 JDCD O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1ccc(N2CCC(CO)CC2)cc1 918215464 IAAGDHLEVKJXEO-UHFFFAOYSA-N 460.600 1.814 10 20 JDCD COC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 920787150 ULSLGMFKHHDZRO-SFHVURJKSA-N 452.511 1.359 10 20 JDCD COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)c1 1779538013 HKWXANSFFPCAQW-OJZQOFKYSA-N 455.467 1.364 10 20 JDCD O=C1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cc(O)c(O)c(Cl)c3)C2)CN1 1781119357 HHVXXUHPLBCCFT-OIAISFKWSA-N 465.934 1.405 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2)c1cc(O)c(O)c(Cl)c1 1781122097 KOCUHTSZOSTBAM-IIBYNOLFSA-N 462.890 1.276 10 20 JDCD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1781293046 XBWRWTTXAJTCHS-SSOJOUAXSA-N 498.536 1.499 10 20 JDCD C[C@@H](Cc1ccncc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2 1781481413 PFXUYDSYJVBVQY-LSRZYVKLSA-N 454.527 1.894 10 20 JDCD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)C1 1783450657 QIHAPWSIAWJJSV-FYSMJZIKSA-N 488.541 1.193 10 20 JDCD COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C[C@@H]32)n1 1785200391 FICQVOOAEAYLGO-GFWDFKOESA-N 483.521 1.443 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2 1785503229 DBEVUEGEQNKKNF-OKAASLONSA-N 482.489 1.487 10 20 JDCD CC(C)Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cc(O)nc(O)c4)[C@H]3C2)n(C)n1 1787291321 ZPPKIDARKXKLGS-FNHZYXHNSA-N 457.531 1.332 10 20 JDCD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)c3)[C@H]2C1 1787294633 ZNVIZKTZVIHCIU-IXDGSTSKSA-N 485.497 1.374 10 20 JDCD N=C1NCCN1CC(=O)Nc1ccc(C2(NC(=O)C3=NN(c4ccccc4)C(=O)C3)CCC2)cc1 1788013601 CYGWQJJRFRORNC-UHFFFAOYSA-N 473.537 1.753 10 20 JDCD NC(=O)CC[C@H](N)C(=O)NC1(c2ccc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)cc2)CCC1 1788672450 DTLIFIVGVWJREW-IBGZPJMESA-N 476.537 1.506 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21 1792239199 VGRITHCHYUFQLO-MPGHIAIKSA-N 485.591 1.083 10 20 JDCD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C2=NN(c4ccccc4)C(=O)C2)C3)ccc1F 1794353838 PLIBPJHGYNFWHW-MFKICJERSA-N 465.485 1.525 10 20 JDCD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cc(O)nc(O)c1 1797854829 ATUBYJUCFKCPEC-PLACYPQZSA-N 466.538 1.646 10 20 JDCD CC(C)n1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1798157009 MRVZMVARMOLKQP-UUYBIMOCSA-N 456.499 1.497 10 20 JDCD Cc1nccn1CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770486 XXLYQHYYAWAYFO-CWPLJXCYSA-N 462.934 1.940 10 20 JDCD COc1c(Cl)cccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802107823 UNUSPXXQLHVVKV-DPIQGUFMSA-N 483.999 1.412 10 20 JDCD Cc1ncoc1C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1805861007 JYIPPDJXMWWFAU-WMLDXEAASA-N 459.553 1.558 10 20 JDCD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807993654 KXBBPONFIDCAHW-ABAIWWIYSA-N 486.378 1.563 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2cccn3ccnc23)[C@H]1c1cccnc1 1814188899 DLVDHQZPESOZES-UZLBHIALSA-N 494.602 1.909 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)c2ncccc2F)[C@H]1c1cccnc1 1814189835 IERSBHPLFSKBGF-KUHUBIRLSA-N 473.555 1.796 10 20 JDCD COC(=O)CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1815225269 PSPYPLLWIQOJHQ-GFCCVEGCSA-N 485.613 1.168 10 20 JDCD N[C@@H](CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1cccnc1 1816722777 XEJMARXCGAVWHV-KGLIPLIRSA-N 454.512 1.660 10 20 JDCD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1ON=C(c3ccccc3)O1)CC2)c1cc(O)nc(O)c1 1816725302 GUQMTHHHOCTDTE-LRTDBIEQSA-N 481.490 1.910 10 20 JDCD O=C(CN1C(=O)CSC1=S)N[C@@H]1CCc2nc(NC(=O)c3cn4ccccc4n3)sc2C1 1818070731 ZJBVHHOJGFUADK-LLVKDONJSA-N 486.604 1.877 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1)c1cc(O)c(O)c(Cl)c1 1821292253 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463.874 1.236 10 20 JDCD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)cc1[N+](=O)[O-] 1839188974 JSERLOWGRBAZRV-HSZRJFAPSA-N 486.481 1.022 10 20 JDCD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839537638 UMKGSJYJHLVPCO-QFIPXVFZSA-N 489.575 1.363 10 20 JDCD CCC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)CC1 1840897028 IDMYDEKQTWWTEP-BSRJHKFKSA-N 497.683 1.910 10 20 JDCD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC12CN(C(=O)CN1C(=O)CSC1=S)C2 1841767193 OTGZAILSHDAZAT-CYBMUJFWSA-N 468.601 1.060 10 20 JDCD CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)c1)c1cccnc1 1847679676 VOXWOHOELRPPHS-ABSDTBQOSA-N 483.525 1.969 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(N)(=O)=O)c(Cl)c3)cc2)C1 725907682 RFDUSOFNFJZZRE-OAHLLOKOSA-N 450.948 1.619 10 20 JDCD COc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)CC2)c1 729600095 WHVGEVHNWLYSFM-IBGZPJMESA-N 452.559 1.824 10 20 JDCD COc1ccc(N2CCN(CCNC(=O)C(=O)Nc3ccc(CN4CCCC4=O)cc3)CC2)cc1 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O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1 1814163359 AHWVWBKVPOEMIZ-FTPWQXHLSA-N 477.477 1.315 10 20 JDCD Cc1noc(C)c1CC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814184777 FVANCPPMFRMBIH-HRAATJIYSA-N 487.607 1.795 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@H]1CCN(C(=O)C(=O)c2ccco2)[C@@H]1c1cccnc1 1814185577 SULDRRADBMYLQB-RDTXWAMCSA-N 472.548 1.424 10 20 JDCD O=C(Cn1nnc2ccccc21)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1815550469 QPNAATWPINARTH-OAHLLOKOSA-N 498.594 1.707 10 20 JDCD COC(OC)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817363555 IPRRVXQSPKLVDY-LBPRGKRZSA-N 457.512 1.467 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccnc2c1OCO2 1820127259 PKQYGLCXTMFDDU-ZDUSSCGKSA-N 488.551 1.700 10 20 JDCD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)[C@@H]1CC[C@@H]2CCC(=O)N2C1 1820757962 DGYOCRYSULWCKI-UNEWFSDZSA-N 468.514 1.923 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828972968 PIKNOCCTYWRYSN-YGBPNOIISA-N 489.569 1.087 10 20 JDCD C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831870317 WMIVLCLGXDFHBR-VFNWGFHPSA-N 485.628 1.082 10 20 JDCD C[C@@H](Cn1cccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832896688 MYGVTAAYOQPEIJ-WMZOPIPTSA-N 477.656 1.999 10 20 JDCD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cc(O)nc(O)c4)C3)C2)c[nH]1 1833380195 MUJWHYATTRVBQS-QHCPKHFHSA-N 458.515 1.502 10 20 JDCD O=C(c1cc(O)nc(O)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1836419050 OLVWLPVFSQCFHX-QFIPXVFZSA-N 487.900 1.406 10 20 JDCD CCC1(C(=O)N2CCOC[C@@]3(CN(C(=O)/C=C/c4ccc(O)c(O)c4O)CCO3)C2)CCC1 1840880907 SAHBMWRODGPSHH-SXBBHYFQSA-N 460.527 1.853 10 20 JDCD CC(C)(C)OC(=O)N[C@H](Cc1ccc(N)cc1)C(=O)N1CC2(CCCN2C(=O)c2cc[nH]n2)C1 1841698676 BCCHIZCSOBEOIP-LJQANCHMSA-N 468.558 1.945 10 20 JDCD COc1ccc(N2CCN(C(=O)COC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)cc1 21277958 KWDQFKINVOHYNE-UHFFFAOYSA-N 487.578 1.985 10 20 JDCD COc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)cc1[C@]1(C)NC(=O)NC1=O 117595083 CDYOJWLQWXLIDB-QFIPXVFZSA-N 458.540 1.829 10 20 JDCD CNS(=O)(=O)c1ccccc1N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 609041977 NQQNDWGTSIXLJZ-UHFFFAOYSA-N 453.571 1.110 10 20 JDCD O=C1CN(c2ccc(NC(=O)C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2)CCN1 726727374 WYUYVOQZELASHE-UHFFFAOYSA-N 487.507 1.948 10 20 JDCD COc1ccc(N2CCN(CCCNC(=O)NCc3nnnn3-c3ccccc3)CC2)cc1 730582055 BIDNGTBSKBMAEP-UHFFFAOYSA-N 450.547 1.682 10 20 JDCD CCN1CCN(c2ccc(CNC(=O)NCCS(=O)(=O)N3CCSCC3)cc2F)CC1 730582483 BQYMOUCDDQRJGF-UHFFFAOYSA-N 473.640 1.145 10 20 JDCD O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 742346068 FYTYMNMSKBTBLY-UHFFFAOYSA-N 455.496 1.945 10 20 JDCD O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1 750345962 RKLFJJDSGAAKST-UHFFFAOYSA-N 476.581 1.995 10 20 JDCD O=S(=O)(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 917918341 ODVGACFFPCUPMO-UHFFFAOYSA-N 499.586 1.162 10 20 JDCD NC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 918274364 DFOVFFCGFDLNDG-UHFFFAOYSA-N 480.443 1.661 10 20 JDCD C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)S(=O)(=O)c1ccc(F)cc1 918337603 NGLNJLSQUWUSRT-HNNXBMFYSA-N 454.545 1.539 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3ccc(CN4C(=O)CNC4=O)cc3)nc12 919001037 AQNNMWMHZVAUMP-UHFFFAOYSA-N 453.411 1.020 10 20 JDCD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1)c1ccc(O)cc1 1781264472 HRMOUEZSJBVLLR-SPLOXXLWSA-N 463.581 1.186 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)cc3F)C2)C1 1781666750 PROAAUXIKWZAGM-GTYDBAGRSA-N 458.442 1.805 10 20 JDCD O=C1CCc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cc(O)c(O)c(Cl)c5)C4)C3)nc2N1 1782000754 ATNSCXNZTIUOAW-HSZRJFAPSA-N 486.912 1.788 10 20 JDCD O=C(c1cc(O)c(O)c(Cl)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1782007342 QFAVOMICSIFUJE-XZOQPEGZSA-N 487.896 1.929 10 20 JDCD CCCC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007854 XXPQCBQTNPDYLE-YEJXKQKISA-N 453.923 1.500 10 20 JDCD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)cc(C)c1C(=O)O 1782174593 ZXJUBZNQYUAEHR-QFIPXVFZSA-N 491.591 1.305 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2 1783220367 ZGBPDQLUZYEKRZ-YGBPNOIISA-N 469.494 1.278 10 20 JDCD CN1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)c3)C[C@@H]21 1785023737 RRLTZABRIMHFPX-WJMWBRGCSA-N 466.538 1.143 10 20 JDCD COC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CN4C(=O)CSC4=S)CCO3)C2)c(C)c1 1785278345 PTKDMLYNMOSWQW-JOCHJYFZSA-N 491.591 1.085 10 20 JDCD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)/C=C/c4ccc(O)c(O)c4O)C3)C2)C1 1785504103 XDISDLCUFUUXSK-XGFUSAMKSA-N 474.510 1.236 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)N1CC[C@@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2 1785508992 PHPUYXMNQKCKRK-BFHGXFJZSA-N 491.504 1.541 10 20 JDCD NC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21)c1ccccc1 1786925563 IDGPGWWLVSKNBF-RTMHFOTOSA-N 481.549 1.539 10 20 JDCD C[C@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cc(O)nc(O)c5)[C@H]4C3)cc2NC1=O 1787295284 BXQBFHYPMYXIJE-AGLNLLDASA-N 482.493 1.119 10 20 JDCD Cc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C4=NN(c5ccccc5)C(=O)C4)[C@H]3C2)s1 1787537290 MFUOXEKKOIVXIJ-IEZWGBDMSA-N 467.551 1.838 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC=CO3)C[C@@H]21)C1=NN(c2ccccc2)C(=O)C1 1787539719 RBLRYTXILDPIKV-YRLHULLVSA-N 452.511 1.452 10 20 JDCD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C[C@@H]21)c1cc(Cl)ncn1 1789057568 OBNMJALNCNJASZ-QOKNQOGYSA-N 482.928 1.516 10 20 JDCD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792217707 GICRACLKQLHOKD-RAALZJPISA-N 478.498 1.358 10 20 JDCD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21 1792238505 ILCUHQYIRUSFIQ-NOLJZWGESA-N 478.596 1.007 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2)c1nc(Cl)ccc1F 1794233423 RJOKSZVERPFQFA-VTEUUUEMSA-N 485.903 1.870 10 20 JDCD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C2=NN(c3ccccc3)C(=O)C2)n1 1796480523 LNGICLKRIZXNFZ-MFKICJERSA-N 463.494 1.086 10 20 JDCD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)[C@@H](O)c1cccc(Br)c1 1799097467 JFUVVRIFFCAOCY-FTUNRGFVSA-N 492.326 1.192 10 20 JDCD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)N2CCN(C)CC2)C3)cc1 1799620972 VYEPJIITGCUEKB-PXFVTCTCSA-N 493.652 1.933 10 20 JDCD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1800762941 AKDJLFPMPKMAKL-BTTYYORXSA-N 491.595 1.773 10 20 JDCD CC(C)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)c(O)c1O 1802082569 SYASSWKZFPVULT-CLWRDFIBSA-N 459.543 1.279 10 20 JDCD O=C1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)[C@@H]2c2cccnc2)N1 1806817459 OXENQUHXBNEHQH-VVFCZOMOSA-N 458.902 1.744 10 20 JDCD Cc1nc(CC(=O)N2CCCC3(CCN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CC3)C2)no1 1807010168 FTPCDWGNKFVZFV-UHFFFAOYSA-N 464.526 1.945 10 20 JDCD CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(c3ccccc3)C(=O)C2)[C@@H]1c1cccnc1 1812658796 OPSTZNVPXZUZNK-YADARESESA-N 476.537 1.407 10 20 JDCD CCOC(CC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)OCC 1813208278 ZHVJEMLMZUMTKB-OPAMFIHVSA-N 458.515 1.997 10 20 JDCD CN1CCN(CC(=O)N2CC[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)CC1 1814164115 RFNCYBYPXMIVQN-FEPWBRBISA-N 495.580 1.165 10 20 JDCD CC(=O)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)C(C)(C)C 1815062042 HNVDOZMOTNYCER-KBXCAEBGSA-N 494.643 1.813 10 20 JDCD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)[nH]n1)c1cnc(OCF)cn1 1816183609 RPWXBTDBKSKOON-CQSZACIVSA-N 457.422 1.931 10 20 JDCD CC(=O)NC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817363061 FRYSGWMQTJJAKM-CQSZACIVSA-N 482.566 1.763 10 20 JDCD O=C(N[C@H]1CCc2nc(NC(=O)c3cccc(N4CCOCC4)n3)sc2C1)c1cc(O)nc(O)c1 1817661696 VWYHSNVPPWLMOS-AWEZNQCLSA-N 496.549 1.721 10 20 JDCD C[C@@H](CC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2O)CC1 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C[C@H]1CN(c2ccc(CNC(=O)N3CCN(C(=O)C(=O)NC4CC4)CC3)cc2F)C[C@H](C)O1 918223259 YWKOQVFCHHVMPX-HOTGVXAUSA-N 461.538 1.072 10 20 JDCD CN(C)c1ccc(CNC(=O)CN2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)cc1 918740860 XANUENKNPPLOGF-UHFFFAOYSA-N 456.572 1.252 10 20 JDCD O=C(COC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)NCc1ccc(N2CCOCC2)c(F)c1 919093219 KIPOVTIDDYRHQC-CQSZACIVSA-N 461.412 1.233 10 20 JDCD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 919969344 KFEWFUTWQUMHTA-RUZDIDTESA-N 466.513 1.797 10 20 JDCD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 920343073 QOTXJYMZBZAUKU-UHFFFAOYSA-N 480.518 1.680 10 20 JDCD CCCC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779258024 QRTMZCUSKJCVQG-YEJXKQKISA-N 453.923 1.500 10 20 JDCD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)cc(Cl)n1 1779792396 UQCHUAJNIVEROO-DEOSSOPVSA-N 497.939 1.980 10 20 JDCD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CN(C(=O)c4cc(O)nc(O)c4)CCO3)C2)c1 1780117775 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Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)CN3C(=O)CSC3=S)[C@@H]2c2cccnc2)c(O)n1 1811484444 KRMCRHPAWLKUFL-DNVCBOLYSA-N 485.591 1.671 10 20 JDCD Cn1c(C(=O)N2CC[C@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@@H]2c2cccnc2)cccc1=O 1814161912 CSBUBQWCLZOWBO-LTPZRKEVSA-N 490.516 1.930 10 20 JDCD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1 1814162889 XXYUTIHMDRDMOG-JFJMSNSPSA-N 477.477 1.727 10 20 JDCD O=C(Cn1ccccc1=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)CC2 1815444585 CPXUVTWQBXTDKP-HNNXBMFYSA-N 490.545 1.710 10 20 JDCD NC[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(O)nc(O)c3)sc2C1)c1ccccc1 1816722624 RTNSXCGWZHJQCY-CABCVRRESA-N 453.524 1.918 10 20 JDCD Cc1noc(N)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1817292421 QPKKWMLNSVQJCH-LLVKDONJSA-N 463.545 1.455 10 20 JDCD C=CC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)C3=NN(c4ccccc4)C(=O)C3)sc2C1 1817362190 QRKVVBFEYJVJSZ-KBPBESRZSA-N 480.550 1.539 10 20 JDCD CC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2=NN(c3ccccc3)C(=O)C2)n[nH]1 1818148009 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CCOC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)CN4C(=O)CSC4=S)CC3)CC2)CC1 1838737662 GWXZEAMBPVUDJT-UHFFFAOYSA-N 497.639 1.189 10 20 JDCD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1)n1ccccc1=O 1839433248 BGNDNRFEWVCUFC-WNSKOXEYSA-N 491.928 1.244 10 20 JDCD O=C(CCc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840547687 PUIWSNYXCWFRND-JOCHJYFZSA-N 495.598 1.075 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@@H](C)NC(=O)c3n[nH]c4ccccc34)nc12 728370512 UGGQLHBDCIKJKE-LLVKDONJSA-N 452.427 1.350 10 20 JDCD COc1ccc(CC(=O)NCc2ccc3c(c2)CCCN3C)cc1S(=O)(=O)N1CCOCC1 746808419 ASLWQIHRTFUXPC-UHFFFAOYSA-N 473.595 1.957 10 20 JDCD C[C@H]1CN(c2ccc(CNC(=O)COC(=O)c3cccc(CS(N)(=O)=O)c3)cc2F)C[C@H](C)O1 748967446 IMPSJLKIIWPJEH-HOTGVXAUSA-N 493.557 1.701 10 20 JDCD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCNS(=O)(=O)Cc3ccccc3)cc2)C1 918117518 MVPMSCWROYUEPF-HXUWFJFHSA-N 473.599 1.307 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)c3cc(F)ccc3NS(C)(=O)=O)nc12 919097729 BVAMPVMZXAMDLI-UHFFFAOYSA-N 452.420 1.479 10 20 JDCD NS(=O)(=O)c1ccc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 919741966 LBQVQIJJVWCKDQ-UHFFFAOYSA-N 485.545 1.911 10 20 JDCD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919970180 SIEQGUYQILDRTG-UHFFFAOYSA-N 469.586 1.785 10 20 JDCD CCOC(=O)c1cnn2c(O)cc(COC(=O)[C@H](C)S(=O)(=O)c3ccc(F)cc3)nc12 920532012 ALSGSGBHMFZKPO-NSHDSACASA-N 451.432 1.656 10 20 JDCD COC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 920787147 ULSLGMFKHHDZRO-GOSISDBHSA-N 452.511 1.359 10 20 JDCD CCNc1ccc(S(=O)(=O)N2CCOCC2)cc1N/C=C1/C(=O)NC(=S)N(CC(C)C)C1=O 920979051 RWWXZOBSSVLUKL-VBKFSLOCSA-N 495.627 1.334 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2)c1nccc2nc[nH]c12 1777928733 KAGMAKRUFRGEJS-JQYJTOAUSA-N 493.520 1.916 10 20 JDCD Cn1nc(C(=O)N2CC[C@@]3(CN(C(=O)C4=NN(c5ccccc5)C(=O)C4)CCO3)C2)c2c1CCC2 1777962085 LYCQOIQHWKUOTC-VWLOTQADSA-N 476.537 1.145 10 20 JDCD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(O)c1)C2)c1cnc2ccccn12 1778581503 ZWPFBDYKZPXJQD-UZUQRXQVSA-N 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